Metabolite Name 20200715_003_srm1950 20200715_005_qc 20200715_007_qc 20200715_009_qc 20200715_001_Blank-pos 20200715_003_QC-pos 20200715_027_QC-pos 20200715_049_QC-pos 20200716_001_Blank-pos 20200716_003_QC-pos 20200716_027_QC-pos 20200716_049_QC-pos 20200717_001_Blank-pos 20200717_003_QC-pos 20200717_027_QC-pos 20200717_049_QC-pos 20200718_001_Blank-pos 20200718_003_QC-pos 20200718_027_QC-pos 20200718_049_QC-pos 20200719_001_Blank-pos 20200719_003_QC-pos 20200719_027_QC-pos 20200719_049_QC-pos 20200720_001_Blank-pos 20200720_003_QC-pos 20200720_027_QC-pos 20200720_049_QC-pos 20200721_001_Blank-pos 20200721_003_QC-pos 20200721_027_QC-pos 20200721_049_QC-pos 20200722_001_Blank-pos 20200722_003_QC-pos 20200722_027_QC-pos 20200722_049_QC-pos 20200723_001_Blank-pos 20200723_003_QC-pos 20200723_027_QC-pos 20200723_049_QC-pos 20200724_001_Blank-pos 20200724_003_QC-pos 20200724_027_QC-pos 20200724_049_QC-pos 20200725_001_Blank-pos 20200725_003_QC-pos 20200725_027_QC-pos 20200725_043_QC-pos FIT01-001-pos FIT01-002-pos FIT01-003-pos FIT01-004-pos FIT01-005-pos FIT01-006-pos FIT01-007-pos FIT01-008-pos FIT01-009-pos FIT01-010-pos FIT01-011-pos FIT01-012-pos FIT01-013-pos FIT01-014-pos FIT01-015-pos FIT01-016-pos FIT01-017-pos FIT01-018-pos FIT01-019-pos FIT01-020-pos FIT01-021-pos FIT01-022-pos FIT01-023-pos FIT01-024-pos FIT01-025-pos FIT01-026-pos FIT01-027-pos FIT01-028-pos FIT01-029-pos FIT01-030-pos FIT01-031-pos FIT01-032-pos FIT01-033-pos FIT01-034-pos FIT01-035-pos FIT01-036-pos FIT01-037-pos FIT01-038-pos FIT01-039-pos FIT01-040-pos FIT01-041-pos FIT01-042-pos FIT01-043-pos FIT01-044-pos FIT01-045-pos FIT01-046-pos FIT01-047-pos FIT01-048-pos FIT01-049-pos FIT01-050-pos FIT01-051-pos FIT01-052-pos FIT01-053-pos FIT01-054-pos FIT01-055-pos FIT01-056-pos FIT01-057-pos FIT01-058-pos FIT01-059-pos FIT01-060-pos FIT01-061-pos FIT01-062-pos FIT01-063-pos FIT01-064-pos FIT01-065-pos FIT01-066-pos FIT01-067-pos FIT01-068-pos FIT01-069-pos FIT01-070-pos FIT01-071-pos FIT01-072-pos FIT01-073-pos FIT01-074-pos FIT01-075-pos FIT01-076-pos FIT01-077-pos FIT01-078-pos FIT01-079-pos FIT01-080-pos FIT01-081-pos FIT01-082-pos FIT01-083-pos FIT01-084-pos FIT01-085-pos FIT01-086-pos FIT01-087-pos FIT01-088-pos FIT01-089-pos FIT01-090-pos FIT01-091-pos FIT01-092-pos FIT01-093-pos FIT01-094-pos FIT01-095-pos FIT01-096-pos FIT01-098-pos FIT01-099-pos FIT01-100-pos FIT01-101-pos FIT01-102-pos FIT01-103-pos FIT01-104-pos FIT01-105-pos FIT01-106-pos FIT01-107-pos FIT01-108-pos FIT01-109-pos FIT01-110-pos FIT01-111-pos FIT01-112-pos FIT01-113-pos FIT01-114-pos FIT01-115-pos FIT01-116-pos FIT01-117-pos FIT01-118-pos FIT01-119-pos FIT01-120-pos FIT01-121-pos FIT01-122-pos FIT01-123-pos FIT01-124-pos FIT01-125-pos FIT01-126-pos FIT01-127-pos FIT01-129-pos FIT01-130-pos FIT01-131-pos FIT01-133-pos FIT01-134-pos FIT01-135-pos FIT01-136-pos FIT01-137-pos FIT01-138-pos FIT01-139-pos FIT01-140-pos FIT01-141-pos FIT01-142-pos FIT01-143-pos FIT01-144-pos FIT01-145-pos FIT01-146-pos FIT01-147-pos FIT01-148-pos FIT01-149-pos FIT01-150-pos FIT01-151-pos FIT01-152-pos FIT01-153-pos FIT01-154-pos FIT01-155-pos FIT01-156-pos FIT01-157-pos FIT01-158-pos FIT01-159-pos FIT01-160-pos FIT01-161-pos FIT01-162-pos FIT01-163-pos FIT01-164-pos FIT01-165-pos FIT01-166-pos FIT01-167-pos FIT01-168-pos FIT01-170-pos FIT01-171-pos FIT01-172-pos FIT01-173-pos FIT01-174-pos FIT01-175-pos FIT01-176-pos FIT01-178-pos FIT01-179-pos FIT01-181-pos FIT01-183-pos FIT01-184-pos FIT01-185-pos FIT01-186-pos FIT01-187-pos FIT01-188-pos FIT01-189-pos FIT01-190-pos FIT01-194-pos FIT01-195-pos FIT01-196-pos FIT01-197-pos FIT01-198-pos FIT01-199-pos FIT01-200-pos FIT01-201-pos FIT01-202-pos FIT01-203-pos FIT01-204-pos FIT01-205-pos FIT01-206-pos FIT01-207-pos FIT01-208-pos FIT01-209-pos FIT01-210-pos FIT01-211-pos FIT01-213-pos FIT01-214-pos FIT01-215-pos FIT01-216-pos FIT01-217-pos FIT01-218-pos FIT01-219-pos FIT01-220-pos FIT01-221-pos FIT01-222-pos FIT01-223-pos FIT01-224-pos FIT01-225-pos "(3Z)-3-(3-Methylbutylidene)-3a,4-dihydro-2-benzofuran-1(3H)-one_1.73" 6.478581e+05 2.544998e+05 2.677194e+05 2.970616e+05 3.320703e+04 2.844458e+05 2.978268e+05 4.064207e+05 54196.81 2.775950e+05 2.168301e+05 3.280052e+05 52889.52 2.248066e+05 2.334269e+05 3.488046e+05 3.127078e+04 3.516389e+05 2.939288e+05 2.396833e+05 1.114603e+05 1.940200e+05 3.018997e+05 3.750540e+05 48916.68 2.770734e+05 2.696403e+05 2.926017e+05 5.364409e+04 2.548479e+05 3.818641e+05 2.354505e+05 48939.02 2.847116e+05 2.698990e+05 3.062065e+05 8.385855e+04 2.445568e+05 2.792318e+05 2.810932e+05 6.143709e+04 2.209132e+05 3.332570e+05 4.134951e+05 7.582822e+04 1.045749e+05 2.002116e+05 2.842463e+05 2.378219e+05 2.386843e+05 1.211751e+05 1.357634e+05 2.614307e+05 3.928939e+05 3.942428e+05 2.623427e+05 3.856537e+05 2.936276e+05 3.464648e+05 2.898125e+05 5.001425e+05 2.321963e+05 3.506443e+05 3.693977e+05 4.156335e+05 1.939753e+05 3.449521e+05 5.741093e+05 2.836606e+05 2.126569e+05 3.984370e+05 3.783477e+05 2.694771e+05 4.322266e+05 1.963257e+05 1.966862e+05 2.803850e+05 3.812471e+05 9.180425e+04 2.796482e+05 1.577256e+05 1.400843e+05 2.589439e+05 2.481668e+05 1.462720e+05 1.746117e+05 7.147882e+04 1.054461e+05 2.176777e+05 2.646307e+05 4.016050e+05 3.352550e+05 2.555525e+05 2.148166e+05 2.979010e+05 2.809273e+05 4.299617e+05 1.459870e+05 2.919959e+05 1.988102e+05 2.108390e+05 2.897682e+05 9.818388e+04 4.587776e+05 2.925664e+05 1.398604e+05 2.682681e+05 1.799851e+05 9.873472e+04 1.937806e+05 2.052765e+05 3.667429e+05 3.304222e+05 6.521117e+04 1.599951e+05 1.626722e+05 2.394332e+05 1.350120e+05 1.580848e+05 1.087337e+05 1.036630e+05 1.799232e+05 1.312755e+05 9.379125e+04 2.123478e+05 5.054452e+06 2.605386e+05 1.250861e+05 1.986516e+05 1.270976e+05 2.099359e+05 6.338438e+04 1.215005e+05 2.370124e+05 3.005543e+05 7.635275e+04 9.959467e+04 2.488161e+05 1.696339e+05 2.292102e+05 7.742269e+04 2.863596e+05 2.095622e+05 1.243250e+05 1.862927e+05 3.393403e+05 2.866660e+05 1.989695e+05 2.343065e+05 2.023765e+05 1.900290e+05 3.279672e+05 9.745275e+04 2.066880e+05 1.971179e+05 1.040809e+05 2.597687e+05 3.162639e+05 5.382724e+05 1.922831e+05 3.575363e+05 3.150675e+05 3.335630e+05 2.172170e+05 4.542619e+05 2.352755e+05 2.639944e+05 2.268836e+05 3.329485e+05 1.644855e+05 1.827485e+05 2.070751e+05 1.699711e+05 2.094319e+05 2.307638e+05 3.035354e+05 3.850702e+05 3.863716e+05 1.065469e+05 4.127016e+05 3.370050e+05 2.117049e+06 2.996393e+05 2.830571e+05 2.308055e+05 3.777852e+05 2.729607e+05 1.256446e+05 1.412080e+06 1.223637e+05 4.069838e+05 1.982902e+05 5.558664e+05 3.165673e+05 7.804663e+05 2.333407e+05 6.959313e+06 5.083934e+05 2.379862e+05 3.780317e+05 3.236425e+05 5.218262e+05 3.614903e+05 2.036656e+05 2.966523e+05 1.133263e+05 3.691325e+05 8.112982e+04 3.318377e+05 1.808572e+05 2.997278e+05 2.831622e+05 2.224053e+05 2.972879e+05 2.853940e+05 4.190043e+05 4.319178e+05 3.068404e+05 3.793497e+05 3.144141e+05 3.378037e+05 3.069997e+05 8.841592e+04 1.897321e+05 1.656442e+05 7.212649e+05 2.304071e+05 4.152106e+05 3.110533e+05 2.860226e+05 3.279437e+05 3.401857e+05 2.043592e+05 3.359247e+05 1.929507e+05 1.495287e+05 1.008969e+05 2.867419e+05 2.210307e+05 1.484652e+05 1.215289e+05 2.101377e+05 3.016852e+05 1.918550e+05 2.171255e+05 1.427961e+05 1.413653e+05 1.488859e+05 1.787834e+05 2.605578e+05 2.168435e+05 3.153313e+05 2.471933e+05 2.233453e+05 2.342289e+05 1.293838e+05 2.427394e+05 4.127858e+05 1.443288e+05 2.764764e+05 2.479347e+05 1.834741e+05 C22 H33 N P2_1.732 5.584680e+04 4.496340e+06 4.464100e+06 4.126186e+06 4.790114e+04 4.948111e+06 3.052332e+06 5.645682e+06 117692.39 3.960017e+06 2.515734e+06 5.086156e+06 120817.08 4.537330e+06 3.943284e+06 6.090865e+06 7.886466e+04 4.446353e+06 3.400987e+06 4.588077e+06 2.759975e+05 3.665913e+06 3.708458e+06 3.997757e+06 126592.215 5.315617e+06 4.179651e+06 6.004429e+06 1.178957e+05 2.539349e+06 5.000818e+06 5.216712e+06 101069.15 2.792903e+06 3.980163e+06 3.919795e+06 1.480566e+05 5.191423e+06 4.403434e+06 4.627447e+06 1.258816e+05 3.197408e+06 4.516509e+06 7.176570e+06 1.996220e+05 3.082544e+06 3.232002e+06 4.136426e+06 3.382174e+06 4.368698e+06 1.004042e+06 7.067535e+06 4.275788e+06 2.766146e+06 4.873031e+06 2.845363e+06 4.206351e+06 3.458883e+06 5.919576e+06 6.429473e+06 5.887518e+06 2.733755e+06 3.963225e+06 3.421497e+06 5.639084e+06 3.851751e+06 4.689315e+06 2.110784e+06 3.195534e+06 4.023573e+06 7.384327e+06 3.810047e+06 4.836566e+06 2.991597e+06 3.807675e+06 3.736902e+06 2.531231e+06 6.382097e+06 1.366798e+05 4.896841e+06 4.444843e+06 6.205648e+06 2.685390e+06 3.521903e+06 2.908775e+06 4.199766e+06 2.196522e+06 1.844106e+06 4.544745e+06 3.513613e+06 2.642905e+06 4.511561e+06 1.395668e+06 2.997990e+06 5.082773e+06 4.069470e+06 5.436972e+06 3.657430e+06 5.266241e+06 3.619258e+06 2.813746e+06 6.233828e+06 2.746761e+06 2.746392e+06 3.073502e+06 4.982215e+06 9.363236e+05 4.883678e+06 1.786078e+06 4.590734e+06 4.049368e+06 2.181509e+06 2.004363e+06 5.034215e+06 7.553671e+06 2.474076e+06 6.478118e+06 4.034551e+06 1.826551e+06 2.036191e+06 2.898397e+06 7.984512e+05 2.150254e+06 2.252970e+06 3.268602e+06 3.123351e+06 3.872172e+06 2.413984e+06 2.624536e+06 3.764985e+06 3.311440e+06 1.350910e+05 4.349243e+06 5.192500e+06 5.183632e+06 4.391161e+06 3.989725e+06 4.675979e+06 3.192056e+06 2.390410e+06 3.115245e+06 3.301804e+06 5.555071e+06 2.682188e+06 3.729839e+06 4.344008e+06 2.372819e+06 3.399840e+06 2.377534e+06 2.877943e+06 4.514540e+06 7.013164e+06 2.865986e+06 2.148924e+06 3.738609e+06 3.458566e+06 3.032850e+06 3.482356e+06 3.808112e+06 3.709965e+06 4.225258e+06 4.591941e+06 1.620426e+06 3.232710e+06 2.356377e+06 3.505016e+06 3.697970e+06 3.321998e+06 3.954808e+06 2.328461e+06 3.424812e+06 4.424418e+06 3.018027e+06 3.331959e+06 4.467327e+06 3.787475e+06 2.256976e+06 4.838401e+06 4.978280e+06 4.634700e+06 1.034916e+07 2.059914e+06 4.581236e+06 3.092774e+06 2.918784e+06 3.559915e+06 3.714073e+06 5.004752e+06 4.960975e+06 1.680798e+06 1.371073e+07 4.435243e+06 3.293057e+06 6.132578e+06 4.231479e+06 4.173955e+06 1.122097e+07 1.209559e+07 4.384057e+06 1.043202e+07 8.159004e+06 8.464341e+06 4.896014e+06 2.919957e+06 4.705180e+06 4.491383e+06 2.676835e+06 1.054542e+06 4.463008e+06 6.503286e+06 4.381569e+06 3.045372e+06 4.350403e+06 7.292774e+06 6.080281e+06 2.875038e+06 1.247630e+07 1.876317e+06 5.591259e+06 3.593559e+06 4.774584e+06 4.560411e+06 1.828362e+06 4.871796e+06 6.390097e+06 7.745651e+06 3.913361e+06 6.801084e+06 3.869425e+06 4.392580e+06 4.716442e+06 2.807189e+06 5.171304e+06 3.304520e+06 2.670545e+06 4.360959e+06 5.318355e+06 3.749682e+06 3.370564e+06 3.975857e+06 5.139579e+06 4.471413e+06 6.452208e+06 3.951106e+06 5.079335e+06 7.009506e+06 6.539547e+06 3.819432e+06 4.671075e+06 4.484830e+06 8.435204e+06 5.169569e+06 7.049549e+06 3.634595e+06 7.232603e+06 4.665199e+06 2.897287e+06 2.713352e+06 8.876633e+05 3.609804e+06 9.980400e+06 5.045013e+06 C17 H38 Cl N6 O4 P S2_1.733 8.214608e+04 6.095183e+06 5.350462e+06 5.225905e+06 6.234519e+04 4.678410e+06 4.604440e+06 6.863813e+06 80263.60 4.908044e+06 5.227051e+06 5.714094e+06 64930.63 5.982229e+06 5.076335e+06 6.580338e+06 3.941920e+04 4.792789e+06 4.327735e+06 5.502064e+06 1.355487e+05 5.034146e+06 5.075800e+06 5.664931e+06 58069.687 5.812158e+06 6.769694e+06 6.346664e+06 6.512106e+04 3.439812e+06 4.869668e+06 5.731659e+06 54461.12 5.012199e+06 5.228137e+06 6.262352e+06 8.352987e+04 5.410397e+06 4.891076e+06 4.636750e+06 7.246972e+04 7.130197e+06 5.460770e+06 4.630539e+06 1.026803e+05 4.715934e+06 6.592590e+06 5.054920e+06 5.846305e+06 4.948445e+06 2.653809e+06 3.477711e+06 4.117942e+06 5.712540e+06 5.889368e+06 4.367267e+06 5.217062e+06 5.775581e+06 4.544337e+06 3.407688e+06 5.204579e+06 5.482334e+06 5.753009e+06 6.247916e+06 6.765973e+06 5.528187e+06 6.140345e+06 4.707829e+06 6.403029e+06 5.112498e+06 5.711189e+06 5.699349e+06 7.140521e+06 6.793286e+06 4.383222e+06 4.114329e+06 5.445442e+06 7.319396e+06 1.229343e+05 6.521537e+06 5.891872e+06 4.849235e+06 4.764228e+06 5.807494e+06 5.345037e+06 5.710011e+06 4.537325e+06 5.714762e+06 6.200878e+06 6.558011e+06 5.816937e+06 6.861485e+06 4.394430e+06 4.513399e+06 7.406269e+06 5.789327e+06 7.062920e+06 5.280396e+06 5.436940e+06 4.797722e+06 4.588896e+06 3.548453e+06 5.639957e+06 5.425990e+06 5.764376e+06 5.008378e+06 4.615155e+06 3.414875e+06 3.736374e+06 3.679310e+06 3.717522e+06 6.484837e+06 5.373604e+06 5.135543e+06 6.293528e+06 5.084305e+06 6.881408e+06 6.540907e+06 3.215416e+06 5.503726e+06 4.602572e+06 2.657384e+06 5.760174e+06 3.519216e+06 4.920369e+06 3.951198e+06 6.944177e+06 3.992985e+06 4.441564e+06 4.388969e+06 3.888900e+06 7.534966e+04 5.748793e+06 5.011496e+06 5.143164e+06 6.276764e+06 6.156224e+06 4.082626e+06 4.697011e+06 6.293869e+06 5.055635e+06 6.855171e+06 4.235065e+06 4.570612e+06 5.313773e+06 4.700092e+06 6.242237e+06 4.472583e+06 5.319959e+06 6.209564e+06 5.713658e+06 6.106436e+06 4.939653e+06 4.341215e+06 5.761356e+06 5.725363e+06 6.792241e+06 9.227989e+06 8.109693e+06 5.146683e+06 5.691448e+06 3.943416e+06 4.330340e+06 6.604143e+06 4.271814e+06 4.193926e+06 5.353639e+06 4.295667e+06 5.029207e+06 5.354557e+06 4.871509e+06 6.695896e+06 5.385272e+06 5.393391e+06 6.623991e+06 5.805134e+06 4.327785e+06 5.733542e+06 6.196039e+06 6.044524e+06 4.615091e+06 7.847816e+06 5.611913e+06 4.913515e+06 6.067977e+06 6.476832e+06 5.521947e+06 5.990693e+06 5.343939e+06 5.527245e+06 5.568436e+06 6.094336e+06 6.824256e+06 6.083943e+06 5.352227e+06 6.569032e+06 6.332197e+06 8.743472e+06 4.600701e+06 6.144182e+06 6.589733e+06 6.586566e+06 7.565879e+06 5.828856e+06 6.972094e+06 5.741420e+06 4.814968e+06 4.826242e+06 7.053635e+06 6.836937e+06 5.247320e+06 4.479596e+06 5.511388e+06 5.622448e+06 6.747943e+06 7.115080e+06 8.476487e+06 5.600724e+06 6.658089e+06 7.825392e+06 6.525610e+06 5.265745e+06 2.675354e+06 6.627556e+06 5.750803e+06 9.481431e+06 5.619590e+06 6.873337e+06 6.089590e+06 4.709230e+06 6.900653e+06 7.019682e+06 7.064773e+06 5.792920e+06 5.827915e+06 5.789458e+06 7.913747e+06 5.437433e+06 5.786470e+06 5.618504e+06 6.051953e+06 6.638930e+06 6.476333e+06 5.751531e+06 5.912726e+06 7.872369e+06 5.614904e+06 4.510682e+06 5.622844e+06 5.149054e+06 6.279840e+06 3.276303e+06 7.994103e+06 6.132068e+06 6.402458e+06 4.288426e+06 6.526986e+06 5.193659e+06 3.781027e+06 4.765195e+06 4.362378e+06 5.487960e+06 C11 H23 N O5_1.734 4.687646e+04 3.858853e+07 2.804413e+07 3.361203e+07 3.798621e+04 3.556443e+07 3.596507e+07 2.548461e+07 65646.78 3.328139e+07 4.142731e+07 3.541939e+07 55890.58 3.211927e+07 2.781203e+07 3.885801e+07 3.074202e+04 3.579018e+07 3.368904e+07 2.678511e+07 9.935985e+04 3.707489e+07 3.193857e+07 3.318858e+07 43925.035 3.767171e+07 3.565417e+07 3.244625e+07 3.984139e+04 3.478801e+07 3.334592e+07 3.406405e+07 41752.91 2.827623e+07 3.927814e+07 3.092929e+07 7.032762e+04 3.248575e+07 3.756971e+07 2.741021e+07 6.175001e+04 3.543537e+07 3.480986e+07 3.478334e+07 8.646541e+04 3.726089e+07 3.542109e+07 2.942041e+07 3.618067e+07 3.420770e+07 8.677076e+06 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2.977406e+07 3.288562e+07 2.493597e+07 3.934699e+07 4.435540e+07 3.989065e+07 2.896000e+07 2.811955e+07 3.335917e+07 4.559365e+07 3.741369e+07 2.799328e+07 3.653566e+07 3.923095e+07 3.862538e+07 4.403436e+07 3.426209e+07 2.589298e+07 4.000284e+07 3.298648e+07 5.445204e+07 2.221210e+07 4.134868e+07 3.455903e+07 3.552329e+07 3.208042e+07 3.427778e+07 3.840207e+07 4.026044e+07 3.242865e+07 3.511890e+07 3.542186e+07 3.695711e+07 3.743690e+07 3.852080e+07 3.849666e+07 3.985416e+07 3.268218e+07 4.379989e+07 3.137055e+07 2.981775e+07 3.621143e+07 3.668659e+07 2.917865e+07 4.090146e+07 3.899084e+07 2.955779e+07 3.731486e+07 3.430908e+07 3.622098e+07 2.627613e+07 3.035593e+07 3.298287e+07 2.633114e+07 3.307627e+07 2.024996e+07 4.120380e+07 C16 H23 N8 P_1.734 3.947259e+04 1.222440e+07 1.226555e+07 9.626220e+06 3.182572e+04 1.058279e+07 9.937245e+06 1.535522e+07 53985.16 8.972015e+06 1.099785e+07 1.168314e+07 49353.55 1.161299e+07 9.278040e+06 1.381988e+07 2.972289e+04 1.125446e+07 9.971911e+06 1.013738e+07 1.033655e+05 1.111736e+07 1.199747e+07 1.202297e+07 48541.369 1.020510e+07 1.350320e+07 1.253713e+07 4.614098e+04 8.190885e+06 1.065772e+07 1.419097e+07 46156.01 6.845504e+06 1.422682e+07 1.209937e+07 7.206174e+04 8.706831e+06 1.137694e+07 1.096699e+07 5.892389e+04 1.076827e+07 1.315326e+07 1.617019e+07 7.991514e+04 4.632051e+06 1.295630e+07 1.059570e+07 1.036577e+07 8.979519e+06 6.640849e+06 1.935458e+07 9.238379e+06 1.144019e+07 9.837784e+06 1.161269e+07 9.418304e+06 1.010523e+07 9.581501e+06 7.707735e+06 1.664909e+07 1.049234e+07 1.078415e+07 1.209453e+07 1.864763e+07 1.040300e+07 1.092043e+07 9.714139e+06 8.703596e+06 1.028517e+07 2.006555e+07 1.153213e+07 1.322753e+07 1.879750e+07 7.519059e+06 8.995969e+06 4.813647e+06 1.581276e+07 5.650657e+04 1.704991e+07 9.887963e+06 1.316933e+07 8.380364e+06 1.060828e+07 7.310280e+06 1.351987e+07 4.565069e+06 4.168402e+06 8.201765e+06 8.081280e+06 1.663535e+07 1.098742e+07 8.172699e+06 6.892379e+06 1.560262e+07 8.770135e+06 1.653282e+07 8.115370e+06 1.146224e+07 9.418053e+06 8.380352e+06 7.352104e+06 6.179796e+06 1.017740e+07 9.484002e+06 1.193010e+07 5.937668e+06 7.895464e+06 3.426345e+06 8.607390e+06 5.317619e+06 1.244499e+07 1.278829e+07 1.099846e+07 2.180541e+07 5.149253e+06 1.391739e+07 1.322087e+07 6.121142e+06 9.690319e+06 5.315951e+06 3.475152e+06 4.884206e+06 6.105190e+06 7.587513e+06 7.322139e+06 1.278187e+07 4.101280e+06 5.081446e+06 9.726092e+06 6.992738e+06 6.490721e+04 1.174814e+07 8.878268e+06 9.382025e+06 1.089019e+07 9.399734e+06 1.323791e+07 8.532904e+06 9.691490e+06 4.227002e+06 1.209662e+07 1.063936e+07 6.910590e+06 1.021513e+07 1.258242e+07 7.491664e+06 9.563919e+06 4.629328e+06 1.684074e+07 1.174472e+07 1.212542e+07 7.648957e+06 1.004468e+07 6.918558e+06 8.472966e+06 1.421865e+07 1.998856e+07 2.003928e+07 8.947269e+06 1.085640e+07 1.233200e+07 9.787467e+06 9.925684e+06 1.113585e+07 7.142444e+06 1.011994e+07 7.331493e+06 6.870778e+06 5.164850e+06 9.645064e+06 8.522206e+06 8.802313e+06 6.667906e+06 1.103736e+07 1.039879e+07 1.221189e+07 1.383350e+07 1.086464e+07 9.502651e+06 4.047185e+07 5.867127e+06 8.771523e+06 3.197626e+07 1.156058e+07 2.376944e+07 5.289621e+06 1.003119e+07 3.019505e+07 4.184015e+06 2.542780e+07 1.336242e+07 1.248046e+07 1.148045e+07 2.979465e+07 1.252753e+07 4.363013e+07 3.002941e+07 7.107125e+06 3.254943e+07 3.239832e+07 3.465554e+07 1.139281e+07 7.060714e+06 1.229924e+07 1.057824e+07 1.107558e+07 7.434823e+06 1.414001e+07 1.486081e+07 1.064134e+07 6.655940e+06 8.745655e+06 7.166965e+06 1.497688e+07 2.197902e+07 4.271277e+07 1.353989e+07 2.897730e+07 1.221268e+07 1.056903e+07 9.530550e+06 6.668522e+06 1.458242e+07 1.922793e+07 2.897649e+07 2.334308e+07 1.922286e+07 1.413267e+07 9.494444e+06 1.302073e+07 1.187818e+07 1.756560e+07 1.308877e+07 1.154679e+07 1.200706e+07 1.228720e+07 1.270887e+07 9.796456e+06 1.045604e+07 1.478049e+07 1.348801e+07 2.136364e+07 1.730897e+07 1.988073e+07 2.275041e+07 2.120987e+07 1.724468e+07 9.835912e+06 1.161101e+07 2.221487e+07 9.794685e+06 1.915618e+07 5.609078e+06 2.996875e+07 8.973385e+06 7.982984e+06 8.271078e+06 4.081057e+06 1.238713e+07 1.440056e+07 1.303727e+07 C26 H38 O4 S_1.734 4.568180e+04 7.780660e+05 8.784517e+05 5.374398e+05 4.028105e+04 1.007590e+06 4.871349e+05 8.569382e+05 126348.52 6.472414e+05 7.154368e+05 7.837655e+05 159405.39 7.069044e+05 5.302097e+05 1.087574e+06 9.083746e+04 8.334473e+05 7.554872e+05 7.502546e+05 3.031907e+05 7.069471e+05 7.304399e+05 6.934692e+05 136203.808 7.635789e+05 5.663555e+05 9.753188e+05 1.154957e+05 8.193285e+05 7.621495e+05 9.239471e+05 112800.27 5.451690e+05 7.176471e+05 5.096927e+05 1.604690e+05 8.988766e+05 7.969032e+05 8.410477e+05 1.259896e+05 7.026713e+05 5.498261e+05 1.124678e+06 1.675125e+05 6.554706e+05 7.869346e+05 6.401484e+05 9.021302e+05 1.204977e+06 3.553432e+05 4.629806e+05 7.665310e+05 8.263332e+05 9.963976e+05 2.990893e+05 6.131195e+05 1.329412e+06 1.903574e+06 1.376811e+06 1.804561e+06 1.672440e+06 9.392394e+05 7.944403e+05 3.430153e+05 4.904201e+05 8.274611e+05 7.052099e+05 8.928130e+05 8.638976e+05 4.779736e+05 6.465681e+05 5.831918e+05 5.114692e+05 7.326591e+05 3.816823e+05 8.301232e+05 1.167004e+06 1.859200e+06 6.622547e+05 1.656837e+06 7.048252e+05 4.016842e+05 4.508559e+05 5.474453e+05 4.143596e+05 5.302473e+05 2.537264e+05 7.763739e+05 8.906519e+05 5.434504e+05 4.514276e+05 6.343525e+05 7.869507e+05 6.293719e+05 5.239662e+05 6.276771e+05 1.498717e+06 3.992920e+05 6.145955e+05 1.420205e+06 6.090443e+05 1.614177e+06 7.896881e+05 6.120049e+05 2.201315e+06 3.540949e+05 8.118996e+05 4.906502e+05 4.196443e+05 3.750889e+05 4.648371e+05 8.665955e+05 6.225759e+05 7.973892e+05 8.719637e+05 1.082235e+06 9.551325e+05 5.956985e+05 2.202057e+06 6.592183e+05 1.886089e+05 4.985463e+05 3.950301e+06 1.056292e+06 1.875276e+06 1.557947e+06 1.052754e+06 2.057791e+06 8.369666e+05 7.189265e+05 1.762687e+05 6.350936e+05 5.234888e+05 1.096164e+06 6.277548e+05 6.105541e+05 1.777881e+06 8.003773e+05 5.412656e+05 8.794242e+05 1.191490e+06 7.589245e+05 3.324607e+05 8.265192e+05 7.214717e+05 6.254098e+05 5.446026e+05 6.048000e+06 1.008714e+06 1.777653e+06 5.229803e+05 4.960261e+05 5.042607e+05 5.094163e+05 7.338193e+05 2.123894e+06 6.301124e+05 4.601821e+05 3.382930e+06 1.095077e+06 6.853544e+05 5.566745e+05 9.352567e+05 9.308568e+05 7.845096e+05 5.933569e+05 5.748353e+05 4.818619e+05 6.659044e+05 7.223536e+05 9.033598e+05 1.887592e+06 2.295743e+06 9.033119e+05 3.230073e+05 4.415510e+05 7.282957e+05 9.381665e+05 7.867847e+05 1.542744e+06 2.478999e+06 6.101158e+05 7.388111e+05 6.282770e+05 6.142140e+05 6.484417e+05 5.520087e+05 7.013463e+05 3.486815e+05 6.167273e+05 8.759514e+05 7.327590e+05 7.119616e+05 1.279794e+06 4.627156e+05 1.325996e+06 1.154284e+06 5.683918e+05 4.831889e+05 4.464540e+05 5.961436e+05 1.039206e+06 4.766310e+05 4.936587e+05 3.697646e+05 3.822983e+05 1.783119e+05 8.167837e+05 4.433072e+05 4.884011e+05 5.110070e+05 5.064101e+05 7.055426e+05 4.132909e+05 8.288636e+05 1.092497e+06 3.358641e+05 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3.793011e+06 4.709777e+05 4.782629e+05 5.428872e+05 6.861202e+05 8.204975e+05 8.783056e+05 5.682991e+05 8.242683e+05 5.944561e+05 5.815499e+05 4.643945e+05 4.801326e+05 1.826883e+06 1.057536e+06 1.448058e+06 2.950805e+06 4.156295e+06 2.686199e+06 5.279308e+05 1.043015e+07 7.316848e+05 7.498374e+05 7.320418e+05 5.626588e+05 7.266128e+05 1.546017e+06 1.075448e+06 5.357048e+05 5.501664e+05 7.471726e+05 7.322450e+05 1.830506e+06 7.447225e+05 5.717094e+05 6.788609e+05 8.312784e+05 5.940249e+05 4.670645e+05 6.417583e+05 5.369009e+05 4.672576e+05 7.603271e+05 5.412871e+05 9.099893e+05 5.077399e+05 4.802306e+05 6.305845e+05 6.039085e+05 6.209013e+05 5.760628e+05 6.274084e+05 C19 H27 N3 O2 S_1.737 4.841653e+04 2.364207e+06 1.685974e+06 2.079684e+06 3.836537e+04 1.918188e+06 1.315200e+06 2.837370e+06 58234.81 1.573093e+06 2.008874e+06 2.112691e+06 50606.90 2.183793e+06 1.772937e+06 2.232793e+06 3.276828e+04 1.908646e+06 1.706047e+06 1.843039e+06 1.222842e+05 1.979676e+06 1.973614e+06 2.078029e+06 57085.303 1.743201e+06 2.662794e+06 2.217099e+06 5.379148e+04 1.377509e+06 2.118045e+06 2.115269e+06 70387.72 1.524396e+06 1.992299e+06 2.674327e+06 9.195913e+04 1.361662e+06 1.867120e+06 2.159500e+06 7.030977e+04 1.636798e+06 1.885929e+06 2.653583e+06 8.945648e+04 1.964459e+06 2.296320e+06 1.378750e+06 1.403178e+06 1.255684e+06 5.208926e+05 3.559252e+06 1.888960e+06 1.648390e+06 1.520044e+06 1.453779e+06 1.447351e+06 1.973030e+06 1.709002e+06 2.005845e+06 2.345243e+06 1.807297e+06 1.684910e+06 2.372090e+06 2.910448e+06 2.109003e+06 1.900657e+06 2.623487e+06 1.655606e+06 1.752180e+06 3.800803e+06 1.869855e+06 2.669221e+06 3.449376e+06 1.408013e+06 1.063527e+06 1.120442e+06 3.219057e+06 6.035274e+04 3.245781e+06 1.640076e+06 2.534582e+06 1.431036e+06 1.840096e+06 7.580362e+05 1.871495e+06 7.676973e+05 3.438644e+05 1.458271e+06 1.690055e+06 2.352748e+06 1.830588e+06 1.029262e+06 9.212093e+05 2.492962e+06 1.149267e+06 3.236152e+06 1.641803e+06 2.228331e+06 1.471282e+06 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5.193542e+06 1.787781e+06 1.552886e+06 1.132340e+06 5.095783e+05 2.462698e+06 2.045455e+06 2.283783e+06 2-Oxo-6-pentyltetrahydro-2H-pyran-3-carboxylic acid_1.738 4.164475e+05 7.855496e+08 7.061161e+08 6.677917e+08 2.188901e+05 6.922782e+08 7.118798e+08 8.879467e+08 325331.98 6.152393e+08 6.681204e+08 7.698036e+08 272105.20 8.220836e+08 5.632242e+08 9.201275e+08 1.579257e+05 6.843805e+08 6.598694e+08 7.172516e+08 5.470920e+05 7.201310e+08 6.397704e+08 8.206046e+08 249701.817 6.565367e+08 8.225957e+08 7.694119e+08 2.148246e+05 5.632209e+08 7.797882e+08 8.893075e+08 252362.24 5.773014e+08 7.532662e+08 7.937652e+08 3.596173e+05 6.165276e+08 7.358265e+08 7.265228e+08 3.035033e+05 5.634960e+08 6.829144e+08 7.699214e+08 3.759167e+05 9.767270e+08 7.519464e+08 5.596670e+08 4.866398e+08 5.642292e+08 3.617188e+08 8.685537e+08 5.765857e+08 5.962091e+08 6.824459e+08 6.012053e+08 7.583198e+08 7.976909e+08 8.057299e+08 6.301804e+08 8.525421e+08 6.373065e+08 6.463883e+08 8.457747e+08 8.372006e+08 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7.642291e+05 6.401711e+05 5.309876e+05 5.684420e+05 5.111255e+05 4.863720e+05 3.960390e+05 1.249537e+06 5.951550e+05 5.392972e+05 5.633007e+05 1.534147e+06 2.693603e+05 5.585391e+05 6.486055e+05 3.434512e+05 1.079170e+06 C15 H24 O8_1.741 2.537760e+05 3.219204e+07 3.813692e+07 3.604724e+07 1.695923e+05 3.467325e+07 3.069099e+07 4.254295e+07 268887.50 3.090591e+07 3.960213e+07 3.717121e+07 246044.94 3.763739e+07 2.901487e+07 4.458224e+07 1.579444e+05 2.672163e+07 3.540092e+07 3.480118e+07 5.322931e+05 3.388493e+07 3.101878e+07 3.707360e+07 220627.204 3.795998e+07 4.002477e+07 3.727757e+07 1.847133e+05 3.106119e+07 3.568943e+07 4.118462e+07 231356.97 2.466641e+07 4.164339e+07 3.556893e+07 3.229272e+05 3.002917e+07 3.749682e+07 3.582129e+07 2.808066e+05 3.038898e+07 3.735804e+07 4.847365e+07 3.982995e+05 2.421403e+07 4.563254e+07 2.566091e+07 2.476091e+07 1.596331e+07 9.252326e+06 3.812146e+07 2.371533e+07 2.379271e+07 2.663128e+07 1.990330e+07 2.245123e+07 2.754686e+07 2.815890e+07 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3.380064e+07 5.877800e+07 2.900446e+07 1.917956e+08 4.826040e+07 7.060111e+07 3.622199e+07 3.130818e+07 3.291931e+07 3.336201e+07 5.011295e+07 5.979755e+07 6.788662e+07 3.861902e+07 4.937202e+07 5.134392e+07 3.929920e+07 4.884504e+07 3.289242e+07 4.749261e+07 5.211486e+07 3.173978e+07 4.842903e+07 5.305279e+07 3.739772e+07 3.904548e+07 2.538755e+07 2.575857e+07 3.344948e+07 3.766063e+07 4.302072e+07 3.408715e+07 3.043747e+07 2.440064e+07 2.345009e+07 2.516330e+07 3.221635e+07 3.853433e+07 1.836794e+07 4.936887e+07 2.485245e+07 5.400228e+07 1.689035e+07 1.279742e+07 1.512003e+07 1.453750e+07 3.163848e+07 2.718019e+07 3.932895e+07 C9 H14 N6 O3_1.741 4.694576e+04 3.956018e+07 3.169400e+07 2.736704e+07 3.781134e+04 3.079195e+07 3.197018e+07 3.997604e+07 65260.60 2.893676e+07 4.454594e+07 3.406073e+07 67159.08 2.199583e+07 3.166340e+07 4.168764e+07 4.535315e+04 2.730328e+07 3.939224e+07 2.556737e+07 1.566228e+05 2.319369e+07 3.729110e+07 4.088186e+07 60718.873 2.398676e+07 4.727128e+07 4.131265e+07 5.185723e+04 1.917275e+07 2.805722e+07 4.207187e+07 61431.10 1.879144e+07 4.258445e+07 3.873343e+07 8.161552e+04 1.784135e+07 5.247157e+07 3.425743e+07 8.382054e+04 1.655453e+07 4.554750e+07 3.139710e+07 1.442624e+05 1.285333e+07 5.415536e+07 2.595190e+07 4.225921e+07 3.541150e+07 2.752544e+07 2.754858e+07 3.591205e+07 2.950602e+07 4.167317e+07 1.087870e+07 3.454154e+07 4.053160e+07 3.437776e+07 2.447342e+07 4.503674e+07 3.271756e+07 3.295515e+07 2.232175e+07 2.339296e+07 3.085371e+07 4.444031e+07 3.206134e+07 4.160160e+07 3.446749e+07 4.021310e+07 4.464923e+07 5.698542e+07 4.162081e+07 3.982581e+07 4.289584e+07 3.616006e+07 4.945851e+07 6.990611e+05 3.787349e+07 3.906765e+07 4.262445e+07 2.132882e+07 4.507170e+07 4.490222e+07 4.900012e+07 2.168691e+07 3.017038e+07 4.716834e+07 4.114488e+07 2.579392e+07 3.802059e+07 3.614209e+07 3.628092e+07 2.736471e+07 4.300619e+07 3.773133e+07 2.181979e+07 2.537761e+07 2.144286e+07 4.110898e+07 3.459443e+07 3.467991e+07 3.870864e+07 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5.474673e+07 3.851546e+07 1.950761e+07 3.903918e+07 3.938059e+07 2.677135e+07 3.443017e+07 3.090841e+07 2.191300e+07 1.909909e+07 4.274285e+07 3.243528e+07 4.537904e+07 3.228003e+07 4.365792e+07 4.306147e+07 3.776196e+07 2.437131e+07 5.276384e+07 4.306270e+07 3.791018e+07 4.172875e+07 4.489043e+07 4.378166e+07 3.247539e+07 3.795477e+07 2.260228e+07 5.280908e+07 4.244941e+07 3.611064e+07 3.060659e+07 3.471298e+07 4.489596e+07 6.864227e+07 4.615331e+07 4.542114e+07 4.526797e+07 4.059604e+07 5.122122e+07 4.726888e+07 2.519984e+07 1.797166e+07 6.217642e+07 4.551459e+07 3.792789e+07 3.814319e+07 5.201907e+07 4.381962e+07 3.285262e+07 4.304234e+07 4.643601e+07 4.170201e+07 5.178722e+07 2.375834e+07 3.888003e+07 4.039138e+07 4.429249e+07 3.856379e+07 3.775165e+07 3.438403e+07 4.507916e+07 3.976491e+07 2.319481e+07 3.079674e+07 3.151621e+07 3.771512e+07 5.662544e+07 4.236429e+07 1.825657e+07 4.121422e+07 3.565078e+07 4.764466e+07 4.112215e+07 2.186906e+07 2.979400e+07 3.691248e+07 4.017455e+07 3.119952e+07 2.627419e+07 1.698971e+07 4.549354e+07 C20 H34 O9_1.741 1.853303e+05 5.031962e+06 6.441927e+06 5.814523e+06 1.459792e+05 6.162613e+06 5.074565e+06 8.267976e+06 228871.55 5.281898e+06 5.593969e+06 6.787324e+06 219486.57 6.201481e+06 4.113719e+06 7.313864e+06 1.459827e+05 5.712597e+06 5.072720e+06 6.659535e+06 5.201888e+05 5.541851e+06 5.410630e+06 5.953366e+06 232155.149 6.055727e+06 6.795007e+06 6.775952e+06 1.955177e+05 5.079616e+06 5.878198e+06 7.141247e+06 245916.66 4.008466e+06 6.313811e+06 6.721851e+06 3.226431e+05 5.094110e+06 6.117763e+06 6.014075e+06 2.640929e+05 5.154719e+06 6.062670e+06 9.506524e+06 3.540110e+05 3.161602e+06 6.487223e+06 5.342556e+06 7.369104e+06 4.626474e+06 3.150309e+06 4.365423e+06 3.764878e+06 8.797934e+06 6.140527e+06 4.514986e+06 5.681767e+06 7.440544e+06 7.517706e+06 5.271207e+06 1.172677e+07 8.605293e+06 7.034848e+06 6.060407e+06 4.775469e+06 2.274924e+06 7.438727e+06 6.702540e+06 7.088321e+06 4.785499e+06 4.720486e+06 5.945894e+06 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4.023033e+06 5.291573e+06 69630.95 3.526933e+06 3.641201e+06 4.601565e+06 57412.20 3.983342e+06 3.147470e+06 4.016146e+06 3.398188e+04 4.359584e+06 3.808768e+06 3.857031e+06 1.150228e+05 3.816873e+06 3.667701e+06 4.863284e+06 52654.648 3.285588e+06 4.752585e+06 4.220456e+06 4.702620e+04 2.680913e+06 4.620697e+06 5.350377e+06 63302.55 1.982628e+06 4.892050e+06 4.616614e+06 9.515043e+04 2.920788e+06 2.799240e+06 4.897119e+06 7.750159e+04 3.275687e+06 4.419498e+06 5.831327e+06 9.794080e+04 2.303674e+06 4.511976e+06 3.453758e+06 1.159706e+06 8.714120e+06 1.958194e+06 4.685978e+06 1.378188e+06 4.781104e+07 1.275852e+05 1.636556e+05 7.216724e+05 1.895103e+05 3.779471e+06 4.491283e+06 5.877253e+06 1.748685e+06 1.659038e+07 2.539610e+06 2.277485e+06 4.322292e+06 8.457309e+06 5.127060e+05 2.931302e+06 2.234878e+07 5.929023e+05 1.355515e+05 1.109902e+07 1.118114e+07 5.902855e+05 1.133320e+05 4.086239e+06 5.746627e+05 6.497380e+04 3.810259e+06 2.202577e+05 7.150076e+06 1.506096e+06 8.772970e+05 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6.821983e+06 4.500368e+05 2.931885e+06 5.489084e+07 1.987037e+07 2.670634e+07 2.437751e+07 9.610478e+06 2.623812e+07 1.440545e+07 5.084509e+05 2.597945e+07 1.516227e+06 5.644309e+05 5.649833e+06 3.241258e+05 4.163610e+06 2.313444e+05 3.578125e+05 3.535975e+05 6.147200e+05 8.242357e+05 3.219052e+07 3.385542e+07 C32 H39 Cl N2 O10_1.741 1.226918e+05 1.399832e+06 8.505768e+05 1.085009e+06 8.755001e+04 1.049439e+06 1.007533e+06 1.273678e+06 89949.39 9.184538e+05 9.848014e+05 8.935565e+05 61955.22 1.572048e+06 1.304939e+06 1.342622e+06 3.534605e+04 6.934219e+05 6.398264e+05 9.294328e+05 1.160749e+05 1.792788e+06 1.053238e+06 9.656006e+05 53300.258 7.188770e+05 1.576090e+06 1.597466e+06 4.323181e+04 6.836448e+05 8.021628e+05 9.299102e+05 48117.43 1.284849e+06 8.893206e+05 1.016935e+06 5.282295e+04 1.457153e+06 1.091625e+06 1.153789e+06 4.830022e+04 1.328622e+06 7.793862e+05 1.012201e+06 8.343016e+04 9.005773e+05 1.712771e+06 7.676079e+05 5.654416e+05 5.011274e+05 1.970768e+05 4.674732e+05 7.062865e+05 7.132357e+05 1.564054e+06 7.547958e+05 6.311632e+05 7.054811e+05 4.548777e+05 9.358723e+05 3.979709e+05 8.123189e+05 9.585322e+05 1.060793e+06 9.392014e+05 5.510001e+05 6.941762e+05 7.220163e+05 9.633429e+05 8.219135e+05 1.908056e+06 8.149186e+05 1.137423e+06 2.268234e+06 5.292325e+05 8.802601e+05 5.914381e+05 1.854963e+06 6.684911e+04 1.539428e+06 8.763370e+05 8.143637e+05 6.146228e+05 7.134384e+05 8.791705e+05 1.004651e+06 3.765582e+05 6.320016e+05 1.518798e+06 8.160092e+05 9.340903e+05 1.526456e+06 6.606969e+05 5.830480e+05 1.323039e+06 8.513474e+05 1.398365e+06 6.958783e+05 9.338337e+05 6.206238e+05 5.333920e+05 4.278676e+05 8.372226e+05 6.889094e+05 3.081507e+05 9.919984e+05 5.233189e+05 5.223905e+05 6.099050e+05 5.864214e+05 6.350360e+05 1.223583e+06 1.110318e+06 7.744334e+05 2.536298e+06 8.861699e+05 1.068624e+06 1.007231e+06 4.536185e+05 9.207491e+05 3.357118e+05 3.134891e+05 3.925287e+05 3.752133e+05 8.641916e+05 5.136245e+05 1.258758e+06 6.932869e+05 4.613927e+05 7.603659e+05 6.567653e+05 4.861540e+04 4.731604e+05 6.975831e+05 1.147079e+06 1.059207e+06 7.413008e+05 8.496211e+05 6.943645e+05 8.703889e+05 5.107892e+05 9.372782e+05 8.502099e+05 7.850920e+05 1.314975e+06 1.000069e+06 7.266624e+05 5.180155e+05 5.923978e+05 1.245096e+06 9.172613e+05 1.512027e+06 9.118445e+05 5.075789e+05 7.678746e+05 1.029826e+06 9.920914e+05 2.498790e+06 2.298232e+06 5.674516e+05 9.346212e+05 7.221358e+05 4.628726e+05 8.170661e+05 3.516422e+05 5.847139e+05 8.463110e+05 5.099117e+05 5.221961e+05 8.507510e+05 8.532403e+05 8.150942e+05 5.343726e+05 6.043504e+05 1.381742e+06 8.344967e+05 6.500617e+05 7.416915e+05 7.309886e+05 8.616223e+05 1.504750e+06 5.980903e+05 7.470164e+05 1.807523e+06 1.352537e+06 1.351784e+06 6.292986e+05 1.070763e+06 1.543764e+06 5.312515e+05 1.761642e+06 1.079034e+06 1.000199e+06 1.100806e+06 1.194676e+06 1.525790e+06 1.191037e+06 2.498126e+06 6.963909e+05 2.135823e+06 1.711641e+06 2.702664e+06 7.846318e+05 6.334218e+05 1.837900e+06 1.502107e+06 1.610255e+06 7.527434e+05 1.340042e+06 1.205998e+06 1.495852e+06 5.131468e+05 8.717832e+05 8.697885e+05 1.916450e+06 1.230973e+06 1.367381e+06 5.951080e+05 3.640484e+06 1.390234e+06 5.248285e+05 4.331818e+05 4.121218e+05 8.516683e+05 1.993148e+06 1.989219e+06 1.113857e+06 6.089768e+05 1.237708e+06 9.981074e+05 1.691905e+06 9.186845e+05 1.181425e+06 8.495766e+05 1.033105e+06 7.328251e+05 1.416130e+06 6.356602e+05 8.086522e+05 1.196521e+06 1.207254e+06 1.220671e+06 1.904558e+06 1.418088e+06 1.703736e+06 2.522690e+06 1.848783e+06 8.771368e+05 6.762712e+05 2.183569e+06 1.072108e+06 5.654041e+05 2.144751e+06 7.579176e+05 2.120166e+06 4.468030e+05 1.066524e+06 7.062201e+05 3.175752e+05 5.869553e+05 1.296320e+06 1.027298e+06 C14 H23 N3 O4_1.741 6.637664e+05 2.791728e+07 2.581425e+07 2.271206e+07 1.122688e+05 2.366203e+07 2.280262e+07 3.433387e+07 178214.57 2.005778e+07 2.568817e+07 2.698836e+07 188477.56 2.667308e+07 1.962252e+07 3.087538e+07 1.136530e+05 2.546495e+07 2.405302e+07 2.405974e+07 3.760604e+05 2.385687e+07 2.380256e+07 2.663880e+07 174859.037 2.478052e+07 2.777873e+07 2.861562e+07 1.470920e+05 2.190190e+07 2.568924e+07 3.115845e+07 179921.89 1.654743e+07 2.820976e+07 2.755922e+07 2.395248e+05 2.103583e+07 2.753845e+07 2.573606e+07 1.989665e+05 1.987013e+07 2.553915e+07 3.166969e+07 2.656339e+05 2.595084e+07 2.805672e+07 1.947647e+07 2.314729e+07 1.990403e+07 1.051305e+07 3.637151e+07 2.226288e+07 2.172350e+07 2.831649e+07 2.373092e+07 2.371707e+07 2.464750e+07 2.800202e+07 2.871439e+07 3.522319e+07 2.415635e+07 2.175006e+07 2.749539e+07 3.858393e+07 2.098835e+07 2.725970e+07 2.380438e+07 2.312039e+07 2.716472e+07 5.153349e+07 3.155836e+07 3.299929e+07 4.560156e+07 1.940295e+07 2.147442e+07 1.854903e+07 3.543816e+07 3.632817e+06 3.557042e+07 2.404224e+07 3.321551e+07 1.630826e+07 2.057071e+07 1.734011e+07 2.368522e+07 9.180424e+06 8.944326e+06 2.254563e+07 2.042139e+07 3.278928e+07 2.416175e+07 1.895420e+07 1.676734e+07 2.544345e+07 2.244350e+07 3.268634e+07 1.741282e+07 2.817882e+07 2.012506e+07 1.894962e+07 2.144118e+07 1.525683e+07 2.068878e+07 1.908826e+07 3.047367e+07 1.498881e+07 2.347638e+07 8.277876e+06 2.032827e+07 1.812021e+07 3.326024e+07 2.788023e+07 2.395964e+07 4.118917e+07 1.430196e+07 3.570575e+07 2.736029e+07 1.490339e+07 2.122274e+07 1.219934e+07 9.614219e+06 1.060592e+07 1.667931e+07 1.544902e+07 1.584979e+07 3.025985e+07 1.591484e+07 1.258900e+07 2.108336e+07 1.768540e+07 2.426891e+05 2.009331e+07 2.463750e+07 2.163752e+07 2.421712e+07 2.126827e+07 2.952426e+07 1.663617e+07 2.389404e+07 9.496614e+06 2.664755e+07 2.863842e+07 1.328571e+07 1.982721e+07 2.712409e+07 1.887300e+07 2.015602e+07 1.616558e+07 3.252497e+07 2.313178e+07 3.212550e+07 1.653880e+07 1.969577e+07 1.741792e+07 1.961283e+07 2.464075e+07 3.327687e+07 4.446380e+07 1.956758e+07 2.113516e+07 2.480633e+07 2.193011e+07 2.400959e+07 2.275305e+07 1.729274e+07 2.036221e+07 2.092302e+07 1.809715e+07 1.568814e+07 2.242641e+07 2.071261e+07 1.742721e+07 1.734301e+07 2.926896e+07 2.302649e+07 2.463471e+07 2.924358e+07 2.933048e+07 2.850827e+07 9.233915e+07 1.188198e+07 1.812098e+07 6.179762e+07 2.638186e+07 1.614352e+07 1.714916e+07 2.267175e+07 7.378586e+07 1.135782e+07 7.601435e+07 2.965637e+07 1.986151e+07 3.149069e+07 5.448156e+07 2.443924e+07 8.052355e+07 8.093517e+07 1.653463e+07 8.141662e+07 6.861735e+07 8.047177e+07 2.155869e+07 1.628576e+07 2.867902e+07 2.114521e+07 2.509396e+07 1.405295e+07 2.791473e+07 3.267218e+07 1.990350e+07 1.508112e+07 1.913078e+07 2.290456e+07 3.297084e+07 2.955671e+07 8.318494e+07 1.559637e+07 6.387962e+07 2.646893e+07 2.107159e+07 1.778181e+07 1.709514e+07 3.033535e+07 4.134523e+07 4.820766e+07 1.796974e+07 3.790695e+07 2.945325e+07 2.147748e+07 3.024076e+07 2.291711e+07 2.963041e+07 2.883074e+07 2.204870e+07 2.044453e+07 2.846461e+07 2.239471e+07 1.960280e+07 1.956039e+07 3.395603e+07 2.853947e+07 4.187501e+07 3.916012e+07 3.262929e+07 4.958893e+07 4.430809e+07 3.767961e+07 2.551426e+07 4.539890e+07 4.553024e+07 1.727829e+07 4.131697e+07 2.075863e+07 6.974182e+07 2.789824e+07 1.845111e+07 1.678203e+07 8.752158e+06 2.601686e+07 3.857077e+07 3.093780e+07 C11 H14 O2_1.741 6.329292e+04 4.165095e+06 4.033902e+06 3.613127e+06 9.492526e+04 3.898110e+06 3.948902e+06 5.164575e+06 87024.39 1.888625e+06 4.045707e+06 4.750497e+06 73251.22 4.262022e+06 3.348160e+06 4.119582e+06 5.557034e+04 3.540330e+06 3.848066e+06 4.208855e+06 1.394343e+05 3.811480e+06 3.509654e+06 4.356133e+06 65095.503 3.639495e+06 4.724478e+06 4.337358e+06 6.434078e+04 3.773571e+06 2.012790e+06 4.725205e+06 79546.69 3.447502e+06 4.396674e+06 4.145603e+06 9.981435e+04 3.398486e+06 4.429141e+06 3.603025e+06 7.957501e+04 3.283885e+06 4.434661e+06 6.302995e+06 1.118869e+05 1.873480e+06 3.800986e+06 3.829504e+06 3.461482e+06 4.285439e+06 1.002838e+06 6.173750e+06 4.924846e+06 3.826485e+06 4.421752e+06 4.106969e+06 5.330682e+06 4.859032e+06 5.787306e+06 4.711612e+06 6.689670e+06 1.300463e+06 5.133103e+06 6.126704e+06 5.707778e+06 3.221850e+06 4.283583e+06 4.711172e+06 4.550996e+06 4.796778e+06 5.967729e+06 4.981559e+06 6.961034e+06 5.993121e+06 3.461325e+06 2.554863e+06 2.657963e+06 4.269761e+06 1.267551e+05 4.715125e+06 1.955248e+06 4.391981e+06 3.459215e+06 3.100698e+06 3.663144e+06 3.814315e+06 2.192188e+06 2.259899e+06 3.585119e+06 3.540619e+06 6.468309e+06 3.603457e+06 4.795073e+06 1.851025e+06 2.097103e+06 2.148385e+06 4.849676e+06 2.615125e+06 4.119963e+06 2.021100e+06 3.498557e+06 3.382363e+06 2.527723e+06 4.716266e+06 4.512155e+06 5.319088e+06 1.984832e+06 4.330573e+06 2.453941e+06 3.139753e+06 3.041105e+06 4.317677e+06 5.319248e+06 2.220534e+06 4.866574e+06 2.883592e+06 4.163643e+06 3.610963e+06 2.936160e+06 4.722372e+06 1.384106e+06 1.897880e+06 1.795644e+06 3.595857e+06 1.975035e+06 3.508498e+06 5.637524e+06 1.614623e+06 2.711798e+06 3.638466e+06 3.673776e+06 1.025763e+05 3.079844e+06 4.335424e+06 3.568729e+06 3.910486e+06 4.553123e+06 4.870599e+06 3.763523e+06 4.290458e+06 1.945736e+06 4.751952e+06 4.967234e+06 2.457215e+06 3.858639e+06 5.331765e+06 1.991629e+06 4.298492e+06 5.055265e+06 5.630494e+06 4.518885e+06 4.797437e+06 1.719462e+06 3.716468e+06 3.228383e+06 4.619382e+06 4.152491e+06 7.116522e+06 7.424994e+06 4.120290e+06 4.440383e+06 4.563128e+06 3.916013e+06 4.321348e+06 4.816126e+06 2.979540e+06 3.685530e+06 3.918800e+06 3.019223e+06 3.421380e+06 4.115628e+06 4.460212e+06 3.395267e+06 3.098445e+06 4.639500e+06 4.103062e+06 6.180755e+06 2.710883e+06 5.444269e+06 5.547865e+06 1.806641e+06 4.721079e+06 3.210473e+06 1.855050e+06 3.932378e+06 4.885142e+06 3.841955e+06 3.976025e+06 5.999343e+06 3.252959e+06 4.954208e+06 4.851647e+06 5.425537e+06 2.688447e+06 6.846755e+06 4.180739e+06 8.676574e+06 6.769116e+06 4.594195e+06 6.004224e+06 5.997231e+06 7.127111e+06 4.541540e+06 4.520454e+06 5.171894e+06 3.586044e+06 5.491944e+06 3.144294e+06 6.094397e+06 4.647787e+06 2.403877e+06 4.129046e+06 4.202359e+06 5.736481e+06 5.458671e+06 2.702019e+06 2.551110e+06 5.758572e+06 3.620290e+06 4.780257e+06 5.014044e+06 2.571142e+06 3.669477e+06 5.287641e+06 5.140844e+06 8.849646e+06 4.668736e+06 6.535714e+06 4.297282e+06 4.731448e+06 4.118812e+06 4.930840e+06 4.347710e+06 4.260046e+06 4.758361e+06 1.808175e+06 4.302406e+06 3.973675e+06 4.472899e+06 3.640984e+06 5.925321e+06 3.985679e+06 5.055402e+06 4.466508e+06 4.292966e+06 4.595341e+06 2.802657e+06 5.572573e+06 4.071308e+06 2.410840e+06 5.235357e+06 4.903946e+06 3.767717e+06 2.068575e+06 7.222641e+06 2.469680e+06 3.050540e+06 3.231985e+06 2.700401e+06 4.337460e+06 2.343339e+06 3.278050e+06 Hexyl 2-furoate_1.741 1.760068e+05 2.535633e+07 2.126467e+07 2.245829e+07 1.809401e+05 2.192064e+07 2.185868e+07 2.940174e+07 214033.55 1.846475e+07 2.382249e+07 2.349527e+07 184308.73 2.402242e+07 2.000029e+07 2.565606e+07 1.062667e+05 2.325904e+07 2.173089e+07 2.292566e+07 3.511368e+05 2.285652e+07 2.006932e+07 2.644160e+07 156103.493 2.194558e+07 2.587434e+07 2.513766e+07 1.418014e+05 1.841729e+07 2.260065e+07 2.917095e+07 177699.72 1.635728e+07 2.480840e+07 2.406628e+07 2.355937e+05 1.984367e+07 2.429946e+07 2.552479e+07 2.034353e+05 1.859356e+07 2.577586e+07 3.080774e+07 2.873739e+05 1.260783e+07 2.790768e+07 2.043581e+07 1.666855e+07 2.117377e+07 8.966155e+06 3.163139e+07 1.796645e+07 1.948813e+07 2.499912e+07 2.216256e+07 2.587467e+07 2.704664e+07 2.827450e+07 2.128150e+07 3.002566e+07 2.190912e+07 2.531655e+07 2.985867e+07 3.124674e+07 1.928025e+07 2.538904e+07 2.588536e+07 2.352510e+07 2.409993e+07 3.404307e+07 2.982230e+07 3.584716e+07 2.955262e+07 1.999200e+07 1.968590e+07 1.840182e+07 2.685440e+07 4.357596e+07 2.923736e+07 2.345368e+07 2.541232e+07 1.851599e+07 2.365556e+07 2.119306e+07 2.405434e+07 1.192196e+07 1.273214e+07 2.217213e+07 2.437005e+07 3.076762e+07 2.087657e+07 2.453255e+07 1.684017e+07 2.308371e+07 1.991901e+07 2.533443e+07 1.808420e+07 2.345555e+07 2.008800e+07 2.082348e+07 1.836623e+07 1.495666e+07 2.038205e+07 2.240915e+07 2.598143e+07 1.765353e+07 2.164766e+07 1.282324e+07 1.775564e+07 1.855577e+07 3.125096e+07 2.761174e+07 1.783110e+07 2.831276e+07 1.621627e+07 2.696884e+07 2.399496e+07 1.738642e+07 2.629087e+07 1.405383e+07 1.123857e+07 1.381693e+07 1.831386e+07 1.662577e+07 1.939137e+07 3.057681e+07 1.799399e+07 1.651330e+07 2.056186e+07 1.953118e+07 5.036993e+06 1.303656e+07 2.229925e+07 2.086832e+07 2.335744e+07 2.693408e+07 2.612551e+07 1.827634e+07 2.340169e+07 1.631923e+07 3.045497e+07 2.734936e+07 1.569060e+07 2.129341e+07 2.644911e+07 1.448057e+07 2.164055e+07 2.820671e+07 2.978641e+07 2.628770e+07 2.747014e+07 1.738489e+07 1.785186e+07 1.886944e+07 2.457845e+07 2.540500e+07 3.853693e+07 4.077523e+07 2.347301e+07 2.108701e+07 2.537320e+07 2.154329e+07 2.350240e+07 2.312919e+07 1.926440e+07 1.925565e+07 2.065597e+07 1.744486e+07 1.661743e+07 2.108410e+07 1.862265e+07 1.837658e+07 1.862812e+07 2.447557e+07 2.149936e+07 2.567393e+07 2.248241e+07 3.025614e+07 2.682637e+07 3.147296e+07 1.546834e+07 1.858381e+07 3.357546e+07 2.164071e+07 2.469410e+07 2.377836e+07 2.013549e+07 3.917235e+07 1.403589e+07 3.363560e+07 2.881811e+07 2.269056e+07 2.672754e+07 4.246128e+07 2.478481e+07 4.863514e+07 3.814218e+07 2.020641e+07 4.255290e+07 3.690652e+07 3.904202e+07 2.446720e+07 2.164521e+07 3.000242e+07 1.872240e+07 2.703940e+07 1.885789e+07 3.135697e+07 2.888273e+07 1.957893e+07 1.953729e+07 2.046415e+07 2.460330e+07 3.382877e+07 2.591018e+07 3.825106e+07 2.923593e+07 2.860845e+07 2.763689e+07 2.724683e+07 2.230174e+07 1.901097e+07 3.241671e+07 3.290441e+07 4.864390e+07 2.451493e+07 3.820549e+07 2.678547e+07 2.385376e+07 2.558745e+07 2.738677e+07 2.550713e+07 2.803443e+07 2.589450e+07 1.960926e+07 2.744112e+07 2.401471e+07 2.610913e+07 2.201232e+07 3.028156e+07 2.506704e+07 2.951792e+07 3.102183e+07 2.455333e+07 2.863571e+07 2.828154e+07 2.762183e+07 2.227535e+07 3.136590e+07 3.082677e+07 9.702450e+06 2.882095e+07 2.116459e+07 3.993425e+07 1.563477e+07 1.912205e+07 1.884446e+07 1.580286e+07 2.273315e+07 2.729374e+07 2.614810e+07 ADIPATE (less likely METHYLGLUTARATE) (may need manual integration) 1.602454e+05 7.524314e+07 4.895891e+07 4.194443e+07 1.233561e+05 7.442807e+07 4.698347e+07 8.859830e+07 168282.99 3.296544e+07 6.598770e+07 6.859546e+07 140629.76 6.790292e+07 5.058026e+07 7.622118e+07 1.202241e+05 4.662194e+07 4.773916e+07 4.460627e+07 3.176408e+05 6.778253e+07 7.381936e+07 5.161791e+07 128940.539 6.966228e+07 4.308339e+07 6.860194e+07 9.733007e+04 5.145507e+07 8.381137e+07 6.875167e+07 115083.15 4.767967e+07 4.634529e+07 7.312382e+07 1.730527e+05 5.468278e+07 3.720770e+07 6.503911e+07 1.351994e+05 5.124715e+07 8.493865e+07 8.101804e+07 1.774415e+05 3.196383e+07 7.066951e+07 4.862950e+07 3.213829e+07 3.530539e+07 3.024824e+07 9.481305e+07 6.883949e+07 5.314061e+07 7.212579e+07 6.991902e+07 7.817345e+07 9.151627e+07 4.428482e+07 6.721646e+07 4.580828e+07 7.082547e+07 5.760582e+07 5.696819e+07 1.031909e+08 6.190535e+07 1.105652e+08 6.535012e+07 7.281574e+07 4.240663e+07 9.438137e+07 9.945381e+07 6.800299e+07 5.617246e+07 3.527507e+07 3.704118e+07 4.135450e+07 8.070410e+07 3.574426e+05 9.859462e+07 9.026747e+07 8.060591e+07 5.570990e+07 9.318774e+07 8.446109e+07 3.783955e+07 4.772933e+07 2.141343e+07 9.534037e+07 7.314585e+07 9.243117e+07 6.226835e+07 4.219465e+07 5.087790e+07 3.341003e+07 4.631852e+07 9.182123e+07 4.489751e+07 7.372318e+07 6.086704e+07 6.010099e+07 3.919030e+07 2.925867e+07 8.314689e+07 6.160389e+07 6.233718e+07 4.615205e+07 3.226628e+07 4.373337e+07 4.456644e+07 4.816838e+07 9.493915e+07 7.305951e+07 5.364158e+07 7.610770e+07 3.345672e+07 8.434387e+07 8.140701e+07 4.159798e+07 8.784072e+07 4.760500e+07 2.642196e+07 2.795013e+07 4.008405e+07 4.602022e+07 5.063333e+07 8.907725e+07 3.113028e+07 2.848786e+07 7.732867e+07 3.297721e+07 1.795791e+05 7.694262e+07 5.451592e+07 7.388141e+07 8.319625e+07 6.974601e+07 1.053797e+08 6.525203e+07 9.255440e+07 5.365353e+07 4.980965e+07 1.155848e+08 2.986310e+07 6.193540e+07 7.880189e+07 5.178622e+07 5.560730e+07 8.048834e+07 8.941084e+07 6.726444e+07 9.163572e+07 6.334638e+07 3.232394e+07 6.306471e+07 6.992501e+07 4.821177e+07 1.305227e+08 1.473372e+08 6.117594e+07 4.953888e+07 8.736167e+07 8.715116e+07 5.049257e+07 8.044807e+07 4.909091e+07 5.668712e+07 4.831205e+07 5.171409e+07 6.520484e+07 5.831532e+07 8.131928e+07 4.244315e+07 5.656105e+07 7.794485e+07 5.833211e+07 6.098162e+07 4.300176e+07 1.144513e+08 8.443579e+07 6.116801e+07 4.885522e+07 3.811301e+07 5.852179e+07 4.166849e+07 5.594163e+07 6.997675e+07 4.973750e+07 6.214973e+07 4.234749e+07 1.010865e+08 8.606950e+07 5.712445e+07 8.209210e+07 5.958977e+07 5.849444e+07 8.875950e+07 9.842317e+07 3.605951e+07 1.457522e+08 5.791198e+07 7.100901e+07 8.180522e+07 5.933907e+07 9.289146e+07 1.718785e+07 4.528849e+07 6.426737e+07 1.010265e+08 1.046986e+08 6.299145e+07 3.836173e+07 5.388752e+07 1.708468e+07 7.831205e+07 5.146907e+07 9.804121e+07 1.017060e+08 8.967328e+07 9.341423e+07 7.403273e+07 5.890498e+07 6.057655e+07 8.300193e+07 6.223306e+07 1.190314e+08 6.729740e+07 9.816635e+07 5.004299e+07 1.790771e+07 4.711572e+07 3.914345e+07 4.409243e+07 8.889974e+07 7.263167e+07 4.133966e+07 5.215735e+07 4.014976e+07 4.170484e+07 6.874545e+07 1.195617e+08 4.777137e+07 1.170969e+08 1.392525e+08 4.166290e+07 8.581187e+07 1.080334e+08 6.043445e+07 3.985793e+07 9.764473e+07 1.150730e+08 4.460779e+07 7.950849e+07 6.067563e+07 6.470375e+07 6.269177e+07 6.646565e+07 6.735690e+07 3.082083e+07 3.956618e+07 7.619552e+07 8.677116e+07 carbazeran_1.742 1.881147e+05 5.460760e+07 6.558444e+07 5.952434e+07 1.529895e+05 5.654836e+07 4.602188e+07 6.225367e+07 265176.20 5.164433e+07 6.461013e+07 6.498847e+07 237002.22 6.219320e+07 4.705762e+07 7.038886e+07 2.126936e+05 4.907101e+07 5.751087e+07 5.634505e+07 5.343110e+05 5.419523e+07 5.033887e+07 6.066543e+07 229953.545 6.090131e+07 6.521811e+07 6.180113e+07 1.896822e+05 4.987620e+07 6.170124e+07 6.944925e+07 239672.30 3.589849e+07 6.618837e+07 6.249395e+07 3.304202e+05 4.712659e+07 6.257526e+07 5.759099e+07 2.796385e+05 4.762956e+07 5.963817e+07 7.881872e+07 3.749304e+05 4.648668e+07 6.564378e+07 4.728791e+07 4.972408e+07 4.802684e+07 1.815005e+07 8.427418e+07 4.985946e+07 4.760947e+07 5.406228e+07 5.319323e+07 5.156005e+07 5.609909e+07 5.272033e+07 5.669053e+07 7.203740e+07 4.444818e+07 4.717739e+07 5.484960e+07 7.947595e+07 5.196399e+07 6.125012e+07 4.627772e+07 4.469747e+07 5.120901e+07 1.203437e+08 6.130080e+07 6.260319e+07 9.380014e+07 3.692276e+07 4.577692e+07 3.823808e+07 7.995210e+07 3.448727e+05 7.311887e+07 5.684329e+07 7.490332e+07 3.470023e+07 5.086214e+07 4.164047e+07 5.870917e+07 2.344017e+07 1.800795e+07 4.839207e+07 4.483709e+07 5.399626e+07 6.036160e+07 3.831570e+07 4.128387e+07 5.031948e+07 4.508497e+07 7.376398e+07 3.835407e+07 6.508104e+07 3.732786e+07 4.206971e+07 4.423326e+07 3.082191e+07 4.540273e+07 4.371984e+07 5.697305e+07 2.593533e+07 4.837254e+07 1.484552e+07 4.854787e+07 3.807936e+07 6.585987e+07 5.676795e+07 5.687796e+07 1.023449e+08 3.302182e+07 7.375866e+07 6.138643e+07 3.203222e+07 4.337849e+07 2.977286e+07 1.486040e+07 2.372645e+07 3.177180e+07 2.896868e+07 3.520904e+07 7.064834e+07 3.449132e+07 2.494059e+07 5.091419e+07 3.905575e+07 2.951698e+05 4.730359e+07 4.493579e+07 5.377506e+07 5.451252e+07 4.958606e+07 6.177369e+07 3.859234e+07 4.818252e+07 2.336221e+07 5.380087e+07 6.642031e+07 3.274272e+07 5.620063e+07 6.468877e+07 3.793361e+07 4.735897e+07 3.911298e+07 7.024110e+07 5.626578e+07 6.112101e+07 3.615320e+07 4.711397e+07 4.504083e+07 5.479821e+07 5.340820e+07 8.543067e+07 8.829122e+07 5.022535e+07 4.798562e+07 5.734399e+07 5.185457e+07 5.638003e+07 4.794238e+07 3.761071e+07 4.348482e+07 4.564050e+07 3.909708e+07 3.250182e+07 5.193460e+07 4.302167e+07 3.447900e+07 3.498263e+07 5.581754e+07 5.787095e+07 3.805722e+07 6.047744e+07 6.172727e+07 6.155681e+07 1.827465e+08 2.740975e+07 5.286413e+07 1.471652e+08 6.660375e+07 4.981583e+07 5.060621e+07 4.420078e+07 1.724514e+08 2.487547e+07 1.452394e+08 7.749282e+07 4.496558e+07 7.714478e+07 7.845666e+07 5.064644e+07 1.850142e+08 1.558509e+08 3.887432e+07 1.766502e+08 1.549814e+08 1.631298e+08 5.343590e+07 4.438831e+07 7.515719e+07 5.856495e+07 5.470429e+07 3.295836e+07 6.383625e+07 7.480021e+07 5.132642e+07 3.974922e+07 4.649951e+07 5.984739e+07 7.707310e+07 7.866317e+07 1.541922e+08 5.542688e+07 1.268768e+08 5.980050e+07 6.197306e+07 4.100540e+07 4.478296e+07 7.313597e+07 9.481480e+07 1.173023e+08 4.771420e+07 8.768243e+07 7.447375e+07 6.046063e+07 6.835654e+07 5.455434e+07 7.342028e+07 7.707856e+07 4.846560e+07 6.091130e+07 7.521155e+07 5.660554e+07 5.158777e+07 5.239143e+07 6.999371e+07 7.214259e+07 8.614931e+07 7.552970e+07 7.867499e+07 9.621430e+07 8.793465e+07 8.198269e+07 5.779892e+07 8.237617e+07 1.002777e+08 4.107284e+07 1.034121e+08 4.046768e+07 1.507775e+08 4.789092e+07 4.833863e+07 3.852097e+07 2.283646e+07 5.075516e+07 7.648748e+07 7.003354e+07 "(2S)-3-Hydroxy-1,2-propanediyl dibutanoate_1.742" 2.782503e+05 1.671789e+09 1.506606e+09 1.437984e+09 2.176410e+05 1.500377e+09 1.563727e+09 1.906561e+09 324518.01 1.340148e+09 1.550723e+09 1.692870e+09 280187.58 1.638580e+09 1.263083e+09 1.830722e+09 1.896730e+05 1.526907e+09 1.500926e+09 1.478839e+09 5.605772e+05 1.578786e+09 1.417244e+09 1.767322e+09 253322.949 1.472339e+09 1.738538e+09 1.670225e+09 2.215253e+05 1.222897e+09 1.659926e+09 1.867678e+09 258650.94 1.247797e+09 1.655047e+09 1.654962e+09 3.733777e+05 1.321577e+09 1.673985e+09 1.616530e+09 3.382708e+05 1.353705e+09 1.676428e+09 1.964790e+09 4.720203e+05 1.064533e+09 1.853605e+09 1.400927e+09 1.331354e+09 1.277307e+09 9.211312e+08 1.931552e+09 1.363007e+09 1.301489e+09 1.527092e+09 1.347906e+09 1.594866e+09 1.738448e+09 1.749004e+09 1.439453e+09 1.896892e+09 1.583834e+09 1.434129e+09 1.841797e+09 1.816699e+09 1.402218e+09 1.598351e+09 1.564656e+09 1.489648e+09 1.531116e+09 2.127904e+09 2.008912e+09 2.040879e+09 1.896441e+09 1.425869e+09 1.420782e+09 1.313993e+09 1.872161e+09 4.665140e+07 1.975821e+09 1.498343e+09 1.698016e+09 1.244668e+09 1.503718e+09 1.277319e+09 1.845804e+09 9.607376e+08 8.360039e+08 1.455174e+09 1.541661e+09 2.034550e+09 1.339285e+09 1.566835e+09 1.243987e+09 1.899513e+09 1.447856e+09 1.805183e+09 1.267017e+09 1.489482e+09 1.308178e+09 1.375246e+09 1.294902e+09 1.044653e+09 1.386358e+09 1.486444e+09 1.618428e+09 1.289877e+09 1.428636e+09 9.362923e+08 1.216699e+09 1.303742e+09 1.954669e+09 1.742616e+09 1.360826e+09 1.826628e+09 1.248586e+09 1.857949e+09 1.635807e+09 1.152240e+09 1.679299e+09 1.086128e+09 9.210689e+08 1.007586e+09 1.259515e+09 1.359773e+09 1.387131e+09 1.900753e+09 8.299013e+08 1.087938e+09 1.380015e+09 1.278609e+09 5.983268e+06 1.501938e+09 1.479003e+09 1.339765e+09 1.466818e+09 1.745365e+09 1.811449e+09 1.221015e+09 1.558320e+09 1.252355e+09 1.989562e+09 2.192105e+09 1.067993e+09 1.450082e+09 1.675611e+09 1.530361e+09 1.447089e+09 1.577183e+09 2.069718e+09 1.589225e+09 2.034450e+09 1.386873e+09 1.250178e+09 1.297808e+09 1.520195e+09 1.771616e+09 2.230438e+09 2.629003e+09 1.432739e+09 1.435481e+09 1.635518e+09 1.353299e+09 1.484684e+09 1.477279e+09 1.139889e+09 1.320156e+09 1.393142e+09 1.137583e+09 1.242659e+09 1.352986e+09 1.326192e+09 1.270525e+09 1.254694e+09 1.722736e+09 1.374137e+09 1.673327e+09 1.666388e+09 1.807807e+09 1.626117e+09 2.265366e+09 1.539932e+09 1.348067e+09 2.243275e+09 1.492236e+09 1.555206e+09 1.547707e+09 1.505691e+09 2.432578e+09 1.416117e+09 2.340079e+09 1.797179e+09 1.497960e+09 1.879472e+09 2.577865e+09 1.595985e+09 2.963980e+09 2.352627e+09 1.342562e+09 2.769841e+09 2.236712e+09 2.319295e+09 1.605915e+09 1.314590e+09 1.869596e+09 1.225402e+09 1.734374e+09 1.231568e+09 2.056298e+09 1.880580e+09 1.537963e+09 1.272495e+09 1.402995e+09 1.624525e+09 1.999750e+09 1.878614e+09 2.660874e+09 1.892929e+09 2.040169e+09 1.921120e+09 1.697338e+09 1.456307e+09 1.254080e+09 1.994391e+09 2.125905e+09 2.831044e+09 1.778445e+09 2.650929e+09 1.739160e+09 1.576229e+09 1.814319e+09 1.759282e+09 1.758653e+09 1.782280e+09 1.553690e+09 1.502738e+09 1.907379e+09 1.690800e+09 1.610624e+09 1.508567e+09 1.965960e+09 1.788776e+09 1.975233e+09 2.149457e+09 1.496545e+09 2.025696e+09 2.047768e+09 1.920377e+09 1.418461e+09 2.119322e+09 2.056412e+09 1.295015e+09 1.834606e+09 1.514114e+09 2.641793e+09 1.026645e+09 1.300987e+09 1.369229e+09 1.041778e+09 1.634814e+09 1.847327e+09 1.800839e+09 C16 H31 P S_1.742 7.151597e+04 3.902653e+05 3.689245e+05 2.984933e+05 5.459365e+04 3.313176e+05 4.374260e+05 3.467137e+05 74281.36 3.529098e+05 3.514240e+05 5.095852e+05 60910.83 3.294147e+05 2.091662e+05 3.518299e+05 4.439812e+04 4.715119e+05 3.024329e+05 3.980470e+05 1.105520e+05 3.846857e+05 3.703615e+05 3.551194e+05 55398.669 3.056870e+05 4.306730e+05 4.108425e+05 5.423953e+04 3.094011e+05 3.205446e+05 4.742016e+05 68951.71 2.574182e+05 3.076236e+05 4.852662e+05 8.977832e+04 3.027266e+05 3.424416e+05 4.274195e+05 7.764862e+04 3.609597e+05 3.150989e+05 3.943997e+05 1.134807e+05 3.391489e+05 4.277731e+05 3.133234e+05 1.851657e+05 1.054921e+05 1.400373e+05 1.717106e+05 1.478182e+05 1.525492e+05 1.295018e+05 1.989291e+05 1.263733e+05 1.268431e+05 1.738672e+05 1.068822e+05 1.878352e+05 1.852362e+05 1.285204e+05 1.704186e+05 1.865311e+05 1.434520e+05 1.286798e+05 1.741551e+05 1.134749e+05 1.563953e+05 1.746500e+05 1.301506e+05 1.911184e+05 1.578190e+05 1.439670e+05 1.241764e+05 1.195548e+05 1.469296e+05 6.679774e+04 1.763236e+05 1.129366e+05 1.239984e+05 1.206619e+05 1.181297e+05 9.540047e+04 1.530914e+05 1.356673e+05 9.405733e+04 1.140271e+05 1.248027e+05 1.646638e+05 1.150352e+05 1.440252e+05 9.976655e+04 1.998500e+05 1.128784e+05 1.897440e+05 1.311506e+05 1.002310e+05 1.100849e+05 1.017287e+05 1.245667e+05 1.128015e+05 1.444596e+05 1.511694e+05 1.763365e+05 1.505155e+05 1.319588e+05 9.832482e+04 1.285958e+05 1.337895e+05 1.433704e+05 1.508171e+05 1.301060e+05 1.362398e+05 1.156185e+05 1.309297e+05 1.512519e+05 1.236281e+05 1.642011e+05 1.471867e+05 1.114037e+05 1.214805e+05 1.187495e+05 1.365247e+05 1.445691e+05 1.567939e+05 1.694388e+05 9.565072e+04 1.099709e+05 1.170606e+05 8.105006e+04 1.579748e+05 1.487808e+05 9.973164e+04 1.285769e+05 1.623576e+05 1.456233e+05 1.169922e+05 1.216234e+05 1.439567e+05 1.666786e+05 1.342182e+05 1.112596e+05 1.269755e+05 1.577803e+05 1.452641e+05 1.393983e+05 1.350138e+05 1.815589e+05 1.196541e+05 1.702898e+05 1.127328e+05 1.343782e+05 9.688799e+04 1.267716e+05 2.112476e+05 1.707099e+05 1.790425e+05 1.071778e+05 1.701486e+05 1.557719e+05 9.946370e+04 1.615519e+05 1.519801e+05 1.019796e+05 1.424686e+05 1.450127e+05 1.506284e+05 1.424448e+05 1.445514e+05 1.163669e+05 1.375931e+05 1.252945e+05 1.811318e+05 1.073374e+05 1.621757e+05 1.760779e+05 1.288522e+05 1.220206e+05 2.408425e+06 4.564245e+05 6.018109e+05 5.134849e+05 6.288677e+05 1.143915e+06 1.359754e+06 2.836318e+06 8.896567e+05 5.825682e+05 1.843430e+06 6.616350e+06 1.196460e+07 1.985417e+06 1.449182e+06 5.714034e+05 1.599190e+06 9.521910e+05 4.103856e+05 1.049555e+06 2.111997e+06 1.445194e+06 1.948961e+05 4.896766e+05 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1.651411e+05 1.949565e+05 9.155821e+05 1.109037e+06 4.838378e+05 5.932587e+05 7.590018e+05 6.436149e+05 6.401504e+05 4.759075e+05 5.674296e+05 7.875979e+05 5.791512e+05 3.075112e+05 1.191386e+05 5.602742e+05 1.028674e+06 2.040391e+05 2.173082e+05 8.373172e+05 4.088143e+05 2.804327e+05 1.760722e+05 5.348377e+05 8.824498e+05 3.820595e+05 6.751822e+04 5.985217e+05 5.935579e+05 1.455023e+05 6.563646e+05 3.604622e+05 6.430577e+05 C20 H32 O8_1.742 1.109870e+05 1.015605e+06 9.680911e+05 1.308636e+06 8.289791e+04 1.457790e+06 7.814737e+05 1.685398e+06 104793.63 1.091512e+06 1.371301e+06 1.367117e+06 96745.83 1.292842e+06 5.967020e+05 1.697626e+06 8.071850e+04 1.008574e+06 7.537424e+05 1.596699e+06 2.562773e+05 9.765153e+05 1.445574e+06 1.119273e+06 122513.353 1.035304e+06 1.372833e+06 1.478824e+06 1.059812e+05 6.475336e+05 1.900038e+06 1.016229e+06 138133.81 7.808765e+05 1.071899e+06 1.822346e+06 1.734663e+05 8.246738e+05 1.288707e+06 1.139323e+06 1.307232e+05 7.310276e+05 1.382951e+06 2.003904e+06 1.592112e+05 8.282620e+05 1.115001e+06 1.074396e+06 1.504479e+06 9.035093e+05 3.673807e+05 1.409338e+06 5.009055e+05 2.002369e+06 6.644910e+05 1.208156e+06 1.388282e+06 1.800127e+06 2.050560e+06 8.692729e+05 3.157744e+06 2.195763e+06 1.681521e+06 1.320376e+06 8.905601e+05 5.382483e+05 1.521559e+06 1.290135e+06 1.008773e+06 1.243285e+06 9.122225e+05 1.013796e+06 2.413967e+06 1.008015e+06 7.090651e+05 6.711764e+05 8.236044e+05 2.247403e+06 3.095784e+06 1.946455e+06 1.538257e+06 8.215282e+05 7.061906e+05 2.959207e+05 7.508120e+05 6.948762e+05 5.089063e+05 3.065193e+05 8.698466e+05 1.870396e+06 1.159284e+06 5.037916e+05 1.008599e+06 9.963971e+05 9.507691e+05 7.607881e+05 8.165083e+05 1.377840e+06 4.826722e+05 1.459467e+06 1.514564e+06 7.070246e+05 1.221485e+06 1.893003e+06 6.209464e+05 2.323487e+06 8.413320e+05 1.182672e+06 4.486684e+05 7.766227e+05 5.770867e+05 9.835665e+05 2.636484e+06 7.850461e+05 1.003902e+06 7.789479e+05 2.192373e+06 2.052136e+06 7.403237e+05 2.839646e+06 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4.861034e+07 9.025348e+07 5.069077e+07 6.852433e+07 5.088647e+07 6.111869e+07 7.692140e+07 6.027235e+07 9.974424e+07 3.834147e+07 5.676673e+07 8.306104e+07 5.808368e+07 5.680107e+07 4.451982e+07 1.377948e+08 8.626341e+07 6.294479e+07 4.639266e+07 3.707841e+07 5.059131e+07 3.700012e+07 4.997032e+07 6.046796e+07 4.661771e+07 5.987494e+07 3.536908e+07 9.138199e+07 8.161125e+07 5.825822e+07 8.078292e+07 6.524062e+07 3.652336e+07 9.864169e+07 9.320418e+07 4.418901e+07 1.472578e+08 5.179883e+07 6.696761e+07 9.594326e+07 4.024961e+07 9.195134e+07 3.395013e+07 3.940447e+07 5.935322e+07 9.577658e+07 1.087672e+08 6.009146e+07 3.316657e+07 4.683098e+07 5.088375e+07 7.578640e+07 4.533823e+07 1.002848e+08 1.181040e+08 9.507820e+07 8.817205e+07 7.550322e+07 6.005975e+07 5.961296e+07 8.740653e+07 5.710040e+07 1.198317e+08 5.595633e+07 1.051493e+08 5.071689e+07 3.983681e+07 4.336184e+07 3.956155e+07 3.734939e+07 9.091996e+07 6.649785e+07 4.169155e+07 4.837128e+07 2.820555e+07 3.654271e+07 6.521246e+07 1.394403e+08 4.445739e+07 1.090064e+08 1.387703e+08 4.521035e+07 1.109131e+08 9.056634e+07 5.558383e+07 3.909854e+07 9.418113e+07 1.395149e+08 3.838999e+07 7.751135e+07 6.570148e+07 5.669705e+07 7.471193e+07 6.914394e+07 7.502375e+07 2.798702e+07 4.231005e+07 8.557865e+07 8.260212e+07 C11 H27 N4 O6 P_1.742 5.782820e+04 3.255418e+06 3.155570e+06 2.926897e+06 4.538595e+04 2.599922e+06 2.659736e+06 3.850211e+06 67902.20 2.704890e+06 2.945193e+06 3.470103e+06 61358.47 3.439421e+06 2.481130e+06 3.500478e+06 5.468703e+04 2.397650e+06 3.093572e+06 3.197649e+06 1.559998e+05 3.017004e+06 1.817093e+06 3.752877e+06 66300.652 3.016248e+06 3.464704e+06 3.384975e+06 5.366034e+04 2.268823e+06 3.452444e+06 3.858617e+06 64457.02 1.895842e+06 3.286456e+06 3.401654e+06 9.282163e+04 2.422050e+06 3.176628e+06 3.016813e+06 7.951909e+04 2.329205e+06 3.464241e+06 4.358978e+06 1.038911e+05 1.801868e+06 3.830955e+06 2.381078e+06 2.528900e+06 1.921447e+06 1.595846e+06 4.436987e+06 2.020764e+06 1.588509e+06 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4.611985e+06 4.436992e+06 2.454540e+06 2.397132e+06 2.304056e+06 1.498997e+06 4.072635e+06 4.348768e+06 1.054050e+07 4.202740e+06 9.024443e+06 3.266948e+06 2.809188e+06 2.278293e+06 1.976985e+06 4.143422e+06 6.089917e+06 6.197919e+06 2.078203e+06 5.843615e+06 4.052144e+06 2.884435e+06 4.086958e+06 3.354005e+06 3.312473e+06 4.270185e+06 2.747654e+06 1.951975e+06 3.386637e+06 2.878897e+06 2.285309e+06 2.521938e+06 4.671339e+06 3.565517e+06 5.000490e+06 4.938882e+06 4.252685e+06 6.162223e+06 4.821215e+06 4.050805e+06 3.082342e+06 6.305159e+06 5.564075e+06 1.663773e+06 4.740632e+06 1.890947e+06 8.609757e+06 2.620897e+06 2.275806e+06 2.100839e+06 4.106680e+05 2.671744e+06 3.419136e+06 4.412151e+06 C5 H12 O2_1.742 1.731637e+05 4.391988e+06 4.062159e+06 3.935624e+06 1.429783e+05 3.722427e+06 3.133848e+06 3.080009e+06 258658.18 4.222445e+06 3.652857e+06 5.226423e+06 208959.99 3.878085e+06 3.133154e+06 3.817058e+06 1.408943e+05 4.551674e+06 3.448385e+06 3.679600e+06 3.647402e+05 3.619799e+06 4.238811e+06 4.982196e+06 163116.806 3.183114e+06 3.216442e+06 4.340397e+06 1.328896e+05 3.488172e+06 4.835104e+06 3.160458e+06 164578.25 3.484653e+06 4.429048e+06 3.805174e+06 2.229836e+05 3.936503e+06 4.327773e+06 3.078808e+06 2.097701e+05 3.065194e+06 5.002040e+06 4.184869e+06 3.044346e+05 3.210687e+06 3.087525e+06 3.487586e+06 1.757478e+06 4.081986e+06 3.308394e+06 4.026782e+06 4.484333e+06 3.203675e+06 4.078571e+06 2.393816e+06 4.112225e+06 3.463111e+06 4.259737e+06 2.421304e+06 4.017735e+06 4.660455e+06 2.883353e+06 3.693463e+06 3.337001e+06 3.140604e+06 4.044928e+06 3.757794e+06 4.758597e+06 4.155623e+06 3.365254e+06 3.777999e+06 2.887950e+06 3.374985e+06 2.312757e+06 4.068952e+06 3.367796e+06 2.659315e+06 3.743747e+06 3.760900e+06 4.926764e+06 1.700082e+06 3.337444e+06 4.318721e+06 3.396265e+06 3.871512e+06 1.983290e+06 2.746238e+06 3.836303e+06 3.720781e+06 2.496203e+06 2.503250e+06 4.345052e+06 2.165547e+06 2.326305e+06 2.809343e+06 4.836772e+06 3.350550e+06 3.405255e+06 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3.727761e+06 2.686361e+06 3.838918e+06 3.098167e+06 5.289299e+06 2.507061e+06 4.038267e+06 3.253105e+06 2.167282e+06 3.764793e+06 3.504340e+06 4.792506e+06 7.567556e+06 3.318426e+06 4.541035e+06 5.681022e+06 2.240814e+06 3.200021e+06 2.945839e+06 3.402696e+06 7.340119e+06 2.648957e+06 3.839935e+06 7.936165e+06 2.243659e+06 5.264563e+06 3.894851e+06 3.499507e+06 3.997519e+06 3.754593e+06 4.307946e+06 3.806844e+06 3.219150e+06 4.425782e+06 4.563612e+06 3.447719e+06 2.822624e+06 3.224409e+06 5.878923e+06 3.948898e+06 5.212042e+06 2.676754e+06 2.822220e+06 3.059854e+06 4.876010e+06 4.107700e+06 3.517679e+06 5.347513e+06 4.924392e+06 5.135181e+06 4.516973e+06 5.113985e+06 4.042284e+06 4.848267e+06 4.124303e+06 4.476418e+06 3.779372e+06 3.974019e+06 4.287266e+06 3.361325e+06 4.947180e+06 4.500285e+06 5.204131e+06 2.434541e+06 1.634136e+06 4.767108e+06 3.814301e+06 6.470052e+06 4.286235e+06 4.387005e+06 5.366421e+06 1.920928e+06 4.335577e+06 4.544937e+06 3.417938e+06 3.175072e+06 5.728939e+06 1.676574e+06 4.330135e+06 2.482182e+06 2.185770e+06 4.500837e+06 3.465574e+06 4.181333e+06 5.610803e+06 4.573760e+06 C12 H21 N O4_1.742 5.379745e+04 3.960352e+05 4.591903e+05 4.516817e+05 4.286575e+04 6.181200e+05 3.764286e+05 4.591062e+05 73584.51 5.728569e+05 3.864708e+05 5.641962e+05 63525.20 4.833269e+05 2.455864e+05 5.443015e+05 3.250821e+04 5.210324e+05 4.688162e+05 3.830303e+05 1.005054e+05 6.682090e+05 4.103985e+05 3.798506e+05 50373.672 4.562793e+05 4.600772e+05 5.388541e+05 4.335832e+04 4.347238e+05 5.553400e+05 6.052535e+05 62823.34 4.286583e+05 2.315390e+05 2.462612e+05 9.673443e+04 5.505580e+05 6.090097e+05 5.922368e+05 7.649945e+04 3.304318e+05 4.923224e+05 5.792095e+05 1.172855e+05 4.391613e+05 4.439276e+05 4.095372e+05 5.424775e+05 4.282411e+05 9.150828e+05 2.199763e+05 3.811816e+05 3.310212e+05 4.641202e+05 6.149164e+05 2.998214e+05 4.029006e+05 3.358710e+05 2.103043e+05 4.019466e+05 3.295604e+05 4.823028e+05 4.878576e+05 3.969502e+05 6.542954e+05 5.941234e+05 3.914459e+05 3.672952e+05 3.254127e+05 6.670297e+05 6.747391e+05 5.689697e+05 2.525951e+05 1.737153e+05 3.529985e+05 2.753753e+05 4.516630e+05 6.589810e+04 4.677275e+05 2.745834e+05 3.596996e+05 4.862745e+05 4.631755e+05 1.329614e+05 4.558831e+05 2.458467e+05 3.038359e+05 3.891132e+05 2.737152e+05 4.969452e+05 2.847454e+05 3.865225e+05 4.050057e+05 4.099874e+05 4.116633e+05 4.557334e+05 4.028128e+05 5.621559e+05 4.881312e+05 4.729779e+05 5.241238e+05 3.190472e+05 4.344231e+05 3.661243e+05 7.317228e+05 3.298458e+05 1.404615e+06 3.756456e+05 3.544881e+05 5.728824e+05 3.879702e+05 4.305435e+05 5.263511e+05 5.530504e+05 4.598107e+05 5.739287e+05 4.591062e+05 3.522889e+05 7.933725e+05 3.095196e+05 3.487724e+05 4.386325e+05 3.245240e+05 4.027488e+05 4.795356e+05 5.648517e+05 2.079055e+05 3.389457e+05 4.394506e+05 3.764037e+05 1.040174e+05 7.545677e+05 4.832027e+05 3.579529e+05 3.954601e+05 6.707528e+05 3.780045e+05 5.542525e+05 5.103408e+05 2.764481e+05 4.281950e+05 5.886690e+05 1.715224e+05 3.886218e+05 5.494576e+05 5.228426e+05 3.369710e+05 5.466763e+05 1.157910e+06 5.007288e+05 5.621442e+05 2.970787e+05 5.101968e+05 4.636478e+05 5.358404e+05 8.262424e+05 1.026326e+06 1.158394e+06 5.459128e+05 9.341792e+05 7.972597e+05 3.065633e+05 2.697731e+05 3.938019e+05 2.657781e+05 4.730912e+05 3.787354e+05 2.828069e+05 6.284264e+05 4.541576e+05 3.480901e+05 5.105184e+05 3.763433e+05 3.355698e+05 3.969328e+05 5.006735e+05 5.936821e+05 4.982994e+05 4.185549e+05 3.780676e+05 4.304569e+05 3.918780e+05 5.272965e+05 3.776285e+05 5.202036e+05 3.574409e+05 2.693544e+05 3.284941e+05 4.661683e+05 6.866846e+05 3.838804e+05 3.150330e+05 8.740970e+05 4.983716e+05 4.029481e+05 5.432112e+05 6.595328e+05 3.940974e+05 8.225477e+05 5.965406e+05 4.947335e+05 5.563173e+05 6.495524e+05 4.683181e+05 3.632976e+05 4.119680e+05 1.939617e+05 4.883571e+05 1.206107e+06 5.936722e+05 2.170078e+05 4.669243e+05 4.324688e+05 4.879898e+05 4.309538e+05 6.823326e+05 6.540433e+05 6.245007e+05 5.114412e+05 4.239055e+05 4.178136e+05 2.569480e+05 5.964968e+05 4.572706e+05 7.247894e+05 5.137603e+05 4.185355e+05 4.140412e+05 5.500204e+05 3.609597e+05 5.316947e+05 5.354105e+05 4.645287e+05 4.422297e+05 4.937076e+05 7.775019e+05 4.566005e+05 4.614157e+05 6.200326e+05 3.860189e+05 5.183497e+05 4.121359e+05 3.626309e+05 2.412280e+05 5.051621e+05 4.652541e+05 3.241436e+05 2.560094e+05 6.122522e+05 4.528190e+05 4.546375e+05 6.210349e+05 4.780606e+05 5.667343e+05 1.075372e+05 3.515820e+05 5.847805e+05 3.015441e+05 4.052121e+05 5.045270e+05 5.371423e+05 C12 H14 O2_1.742 1.458701e+05 4.240554e+06 3.365435e+06 4.368579e+06 6.020050e+04 4.486521e+06 4.525085e+06 4.025796e+06 86092.02 4.270269e+06 4.927649e+06 3.553487e+06 72970.75 4.823761e+06 3.184784e+06 4.789622e+06 5.293648e+04 4.241254e+06 4.595072e+06 3.752473e+06 1.321221e+05 4.070555e+06 3.794011e+06 5.402375e+06 62992.423 4.342482e+06 5.397143e+06 2.723335e+06 6.122838e+04 1.957555e+06 5.352097e+06 5.335311e+06 66744.40 3.479773e+06 4.665485e+06 4.567548e+06 8.553151e+04 3.637101e+06 4.266739e+06 4.530034e+06 7.299619e+04 3.170723e+06 4.334282e+06 5.313627e+06 9.686667e+04 3.943677e+06 4.501277e+06 3.641815e+06 3.697024e+06 4.518028e+06 1.564137e+06 6.943299e+06 4.571089e+06 2.660331e+06 5.479015e+06 3.987932e+06 4.722074e+06 6.123608e+06 3.726351e+06 3.155044e+06 7.317621e+06 4.015088e+06 5.570290e+06 5.949960e+06 5.653849e+06 3.398929e+06 2.877517e+06 5.144382e+06 4.481816e+06 4.998306e+06 8.561020e+06 3.692495e+06 7.023992e+06 7.608046e+06 4.592043e+06 5.194568e+06 2.902053e+06 5.015200e+06 5.769403e+05 5.381583e+06 4.929474e+06 4.951301e+06 3.068062e+06 2.452459e+06 2.770299e+06 3.471571e+06 1.468876e+06 2.292456e+06 3.382289e+06 4.584119e+06 3.063172e+06 3.948159e+06 5.970919e+06 4.084267e+06 2.248110e+06 4.267987e+06 4.648754e+06 1.702844e+06 4.597756e+06 4.132693e+06 4.710435e+06 3.778193e+06 2.675313e+06 4.293552e+06 4.185761e+06 5.357343e+06 3.456647e+06 5.291394e+06 2.626298e+06 3.513894e+06 2.129934e+06 6.321777e+06 5.157433e+06 3.441760e+06 5.487039e+06 3.064941e+06 2.487051e+06 4.306231e+06 3.131700e+06 4.580502e+06 6.183544e+05 1.731690e+06 2.073820e+06 4.020347e+06 2.755976e+06 3.658152e+06 5.955158e+06 1.588851e+06 3.224300e+06 3.896726e+06 4.464236e+06 1.440852e+05 3.409964e+06 5.079391e+06 3.946077e+06 4.340725e+06 4.764570e+06 5.297034e+06 3.806257e+06 4.496584e+06 2.832302e+06 5.977836e+06 5.507201e+06 3.021895e+06 4.097757e+06 4.477554e+06 2.249785e+06 1.917871e+06 5.134485e+06 5.422232e+06 4.360207e+06 2.261063e+06 2.325707e+06 3.764548e+06 4.101629e+06 5.380341e+06 5.225248e+06 8.121026e+06 8.074876e+06 2.324127e+06 2.207237e+06 4.507298e+06 4.772505e+06 4.591548e+06 5.010796e+06 4.383569e+06 3.470889e+06 4.036901e+06 3.386951e+06 4.217702e+06 5.355119e+06 4.107961e+06 3.612235e+06 4.156322e+06 4.660378e+06 4.880986e+06 5.353345e+06 2.887943e+06 5.826998e+06 5.418018e+06 5.226529e+06 4.832564e+06 3.998935e+06 5.260951e+06 4.574387e+06 5.843191e+06 5.117555e+06 3.330132e+06 1.606362e+06 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2.637508e+06 3.104912e+06 1.210210e+05 2.642877e+06 3.887002e+06 1.885814e+06 163872.43 2.559134e+06 4.080733e+06 2.956426e+06 130718.40 3.361338e+06 1.775264e+06 3.257352e+06 8.478417e+04 2.766220e+06 3.335131e+06 2.352476e+06 2.447173e+05 3.898952e+06 2.747337e+06 3.791483e+06 147569.718 2.094329e+06 2.228147e+06 3.022805e+06 1.143915e+05 2.507608e+06 3.029616e+06 4.120210e+06 113728.88 2.343817e+06 2.811972e+06 3.616717e+06 1.479705e+05 2.655679e+06 2.658039e+06 2.781338e+06 1.332926e+05 2.504288e+06 2.950635e+06 4.179895e+06 1.852092e+05 2.324678e+06 2.040605e+06 3.109582e+06 1.120638e+06 2.214639e+06 2.150828e+06 3.513925e+06 3.193348e+06 3.498161e+06 3.079753e+06 1.566507e+06 2.745292e+06 1.646610e+06 2.401436e+06 2.647102e+06 4.345108e+06 2.787831e+06 1.866409e+06 3.817251e+06 3.586521e+06 2.635000e+06 2.242434e+06 2.390935e+06 3.263285e+06 3.216039e+06 2.835379e+06 3.643362e+06 3.529394e+06 2.548893e+06 2.077580e+06 3.023793e+06 2.156061e+06 2.239476e+06 1.215421e+06 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1.268276e+06 9.020209e+05 3.912418e+06 8.140939e+05 9.319867e+05 9.521704e+05 8.881780e+05 7.803271e+05 4.669361e+05 6.452280e+05 1.258171e+06 2.649651e+06 1.103362e+06 1.395975e+06 9.069934e+05 4.629996e+05 7.473951e+05 1.082307e+06 1.408455e+06 7.832148e+05 7.924176e+05 1.043566e+06 8.699633e+05 1.051738e+06 3.594273e+05 4.536206e+05 9.309907e+05 4.514555e+05 5.670051e+05 4.279955e+05 7.907598e+05 5.795071e+05 4.898501e+05 6.154292e+05 8.582688e+05 1.062842e+06 8.916870e+05 6.816698e+05 1.162675e+06 4.415065e+06 7.814875e+05 3.554310e+05 7.467604e+05 1.032390e+06 3.517067e+05 1.230112e+06 5.260373e+05 9.268097e+05 C5 H10 N O3 P_1.743 9.342465e+04 1.407970e+06 1.399273e+06 1.643283e+06 6.745858e+04 1.648437e+06 1.910019e+06 1.995732e+06 78218.13 1.425506e+06 1.712579e+06 1.633208e+06 63924.30 1.740812e+06 1.654800e+06 1.049421e+06 3.555790e+04 1.798723e+06 1.569761e+06 1.536316e+06 1.061505e+05 2.300557e+06 1.729979e+06 1.490865e+06 52332.700 1.106179e+06 2.162751e+06 1.866059e+06 4.598614e+04 1.260361e+06 1.463044e+06 1.467035e+06 54490.82 2.018851e+06 1.706068e+06 1.756939e+06 6.565362e+04 1.410598e+06 1.369025e+06 1.330853e+06 5.879130e+04 2.254846e+06 1.514338e+06 2.108445e+06 8.960799e+04 1.743894e+06 1.082288e+06 1.716331e+06 2.380433e+06 1.406783e+06 5.519351e+05 1.314561e+06 1.785782e+06 1.709579e+06 1.699933e+06 2.399784e+06 1.296989e+06 1.798640e+06 4.157360e+05 1.461490e+06 9.619662e+05 7.327718e+05 1.802100e+06 1.450667e+06 1.188056e+06 1.674249e+06 1.578528e+06 1.625133e+06 2.666617e+06 1.571151e+06 1.634381e+06 1.331075e+06 1.222891e+06 1.516021e+06 1.383903e+06 1.011279e+06 1.536223e+06 1.887631e+06 6.995081e+04 1.950845e+06 1.726359e+06 1.305971e+06 1.776265e+06 1.877509e+06 1.038831e+06 1.461498e+06 1.374436e+06 3.056088e+06 1.470442e+06 1.910513e+06 1.445888e+06 1.375493e+06 1.572812e+06 1.962973e+06 5.198182e+05 1.325183e+06 1.234428e+06 1.906934e+06 1.697253e+06 1.186218e+06 2.511387e+06 1.329410e+06 1.717094e+06 1.512595e+06 1.430990e+06 1.128304e+06 1.060028e+06 8.458509e+05 1.308808e+06 1.053549e+06 1.018619e+06 2.127332e+06 1.658637e+06 1.380200e+06 1.828172e+06 1.581266e+06 1.879193e+06 1.640658e+06 7.915923e+05 1.798929e+06 1.725962e+06 1.367370e+06 1.091723e+06 1.054586e+06 1.759955e+06 1.746532e+06 1.306677e+06 1.866747e+06 2.168165e+06 3.020753e+06 1.372528e+06 7.973227e+04 1.861900e+06 1.534978e+06 1.499056e+06 1.796713e+06 3.337559e+06 1.665714e+06 1.723760e+06 1.107342e+06 1.737456e+06 1.294663e+06 1.730206e+06 1.998793e+06 1.880480e+06 1.269639e+06 1.016825e+06 9.810096e+05 1.370948e+06 1.345898e+06 2.946632e+06 8.326112e+05 1.668944e+06 1.922740e+06 1.782051e+06 2.031869e+06 1.532903e+06 2.950314e+06 1.612436e+06 2.509676e+06 1.872934e+06 1.218349e+06 1.847589e+06 2.434331e+06 1.473333e+06 1.732924e+06 1.577829e+06 1.254209e+06 1.466206e+06 1.621038e+06 1.790968e+06 8.750683e+05 1.471107e+06 1.856811e+06 2.372829e+06 2.586988e+06 1.461323e+06 1.088794e+06 1.648370e+06 1.140929e+06 1.636512e+06 1.917990e+06 1.671528e+06 1.562881e+06 2.009250e+06 2.184283e+06 2.268829e+06 2.324109e+06 1.116656e+06 1.314267e+06 1.335049e+06 1.345152e+06 2.209238e+06 2.036802e+06 1.224898e+06 2.111172e+06 1.126537e+06 8.935362e+05 1.348907e+06 1.615400e+06 1.117476e+06 1.247203e+06 2.705220e+06 2.390078e+06 1.525079e+06 1.981502e+06 1.581775e+06 2.133235e+06 1.293514e+06 1.795509e+06 1.777794e+06 1.147540e+06 2.364004e+06 1.292449e+06 2.132070e+06 1.492010e+06 9.206510e+05 1.277670e+06 1.614081e+06 2.070943e+06 1.530488e+06 1.273755e+06 1.512618e+06 1.284566e+06 1.300363e+06 1.194372e+06 9.348076e+05 1.552414e+06 1.412819e+06 1.761991e+06 1.287891e+06 1.384062e+06 1.502587e+06 1.618509e+06 1.796658e+06 1.169814e+06 2.538293e+06 1.981661e+06 1.743034e+06 1.932008e+06 1.478199e+06 1.319371e+06 2.160609e+06 2.250417e+06 1.871352e+06 2.309468e+06 1.957853e+06 1.482734e+06 1.384899e+06 1.253307e+06 1.465650e+06 1.301990e+06 2.318645e+06 1.888414e+06 1.510645e+06 1.490666e+06 2.265899e+06 1.688168e+06 2.215324e+06 1.484151e+06 9.263653e+05 2.019574e+06 C24 H36 O2_1.743 8.855134e+06 6.876471e+05 7.799649e+05 9.061789e+05 5.251513e+04 7.008606e+05 6.276290e+05 1.366212e+06 63368.22 4.925307e+05 5.730050e+05 9.789462e+05 51545.53 9.455654e+05 4.436759e+05 8.646379e+05 4.188677e+04 1.026115e+06 8.750015e+05 5.913840e+05 1.304809e+05 6.287079e+05 6.696333e+05 8.577284e+05 56965.819 7.177922e+05 8.735615e+05 1.307218e+06 4.225407e+04 3.711181e+05 7.753071e+05 9.186639e+05 54524.97 7.224311e+05 6.934429e+05 9.383501e+05 8.229313e+04 6.129316e+05 9.655973e+05 6.161813e+05 7.429671e+04 6.528054e+05 7.463069e+05 1.126888e+06 9.740171e+04 7.521528e+05 9.149784e+05 5.691571e+05 1.658158e+05 1.099337e+06 4.299247e+05 3.276616e+05 1.199006e+05 1.116624e+06 6.778041e+05 1.818900e+05 6.096228e+05 4.586855e+05 3.240663e+05 2.447998e+05 5.145675e+05 3.103520e+05 1.552457e+06 2.635649e+05 5.520244e+05 1.497963e+06 1.694986e+06 5.983556e+05 6.254933e+05 3.535097e+06 9.024397e+05 3.139677e+05 5.249356e+05 4.935338e+06 2.659198e+05 2.028588e+05 2.553685e+05 1.756143e+05 1.556175e+06 4.297080e+05 1.253362e+06 1.712017e+06 6.372559e+05 2.926992e+05 2.417021e+05 2.119095e+05 4.311348e+05 8.601789e+05 3.222016e+06 2.087710e+06 2.410660e+05 2.105396e+05 4.241609e+06 1.595449e+05 1.578947e+06 1.477030e+05 1.830797e+05 1.923958e+05 6.155848e+05 2.183655e+05 2.707694e+05 3.788024e+06 3.276698e+06 4.814388e+05 2.438915e+06 1.482465e+05 1.209147e+05 2.409723e+06 2.666608e+05 1.060449e+05 6.035253e+05 1.927317e+05 1.344815e+05 3.190673e+06 3.811231e+05 2.556668e+05 1.513645e+05 1.460313e+05 3.037063e+05 4.234030e+05 2.464071e+05 1.011124e+05 3.858170e+06 5.204707e+05 3.822203e+05 3.270742e+05 4.461433e+06 6.253451e+05 2.633349e+05 1.594630e+05 1.417797e+05 2.279725e+06 4.437639e+05 4.749036e+05 4.897446e+05 1.967527e+05 1.788098e+05 4.794822e+05 1.363684e+06 1.096701e+06 2.471974e+06 5.468157e+05 3.233571e+05 6.731163e+05 1.771120e+05 3.443311e+05 1.598494e+05 4.495978e+05 1.140396e+05 3.314770e+05 2.988407e+05 1.456298e+05 3.306474e+05 7.168608e+05 2.086140e+06 2.061629e+05 3.714560e+05 1.759381e+05 2.281008e+05 1.423903e+06 3.482270e+05 7.924459e+06 4.736609e+06 1.661603e+06 6.046206e+05 3.760910e+05 1.350105e+05 3.273382e+06 1.571939e+06 2.485738e+06 3.542916e+06 1.527980e+06 3.169931e+06 2.653143e+05 8.642123e+05 4.665588e+05 2.716596e+05 4.504738e+06 1.330492e+06 5.418495e+05 2.087020e+05 1.232280e+06 4.008952e+05 1.541410e+05 5.453188e+05 1.833953e+06 1.141239e+05 1.546024e+05 2.096658e+05 1.684262e+05 3.986609e+05 3.454632e+05 7.095522e+06 5.235458e+05 2.151574e+05 2.477442e+06 5.957545e+05 1.688875e+05 3.765645e+05 3.165004e+05 4.013972e+06 6.133377e+05 1.279198e+06 3.600078e+05 1.157984e+06 6.786265e+05 2.524267e+05 3.674852e+07 5.561135e+05 1.586534e+06 5.242409e+05 6.322248e+05 6.836938e+05 9.127611e+05 7.875616e+05 4.292747e+05 2.158996e+05 1.381595e+05 2.538874e+05 1.358695e+06 2.995460e+05 1.202171e+05 1.186658e+05 8.340545e+05 1.801978e+06 6.607620e+05 8.165687e+05 5.587030e+05 5.504557e+06 3.925283e+05 4.998493e+05 3.522613e+05 1.282068e+06 7.781761e+05 1.401058e+05 1.447183e+05 7.279788e+05 2.583366e+05 3.884793e+05 3.924862e+05 2.872961e+06 1.983138e+06 5.391478e+05 3.415011e+06 2.295300e+06 1.964105e+05 2.592948e+06 2.148037e+06 2.436097e+05 1.962896e+05 3.028399e+05 1.919080e+05 4.537213e+06 1.810601e+06 1.772316e+05 4.370918e+05 2.836878e+05 2.829334e+06 4.931908e+06 3.780760e+05 1.402873e+05 5.409808e+05 C21 H24 O P2_1.743 4.707865e+04 1.101089e+06 1.496137e+06 8.373817e+05 3.887094e+04 1.582096e+06 8.582221e+05 1.248439e+06 75893.04 1.580234e+06 1.151557e+06 1.643108e+06 77106.46 4.342580e+05 1.337421e+06 2.348308e+06 6.543172e+04 7.399889e+05 1.038714e+06 1.045071e+06 1.978335e+05 5.715173e+05 1.189149e+06 1.709350e+06 69513.622 6.975608e+05 1.997515e+06 1.638720e+06 5.059518e+04 2.922120e+05 1.279228e+06 1.659236e+06 59037.41 5.465532e+05 1.864701e+06 1.424723e+06 8.348836e+04 4.941465e+05 1.650255e+06 1.169231e+06 7.530436e+04 5.282053e+05 1.446399e+06 2.096297e+06 9.697353e+04 6.366826e+05 1.390519e+06 9.976925e+05 4.979218e+05 3.776074e+05 1.412216e+05 5.452646e+05 7.742088e+05 4.249762e+05 7.435502e+05 4.723312e+05 5.400540e+05 5.842766e+05 3.215405e+05 6.634455e+05 5.202826e+05 4.432978e+05 4.958311e+05 5.596793e+05 1.052497e+06 4.843145e+05 1.904589e+06 7.588436e+05 9.725737e+05 6.566443e+05 1.502549e+06 2.099889e+06 1.323329e+06 8.571413e+05 2.491465e+05 1.565874e+06 8.128110e+05 1.815518e+06 9.177144e+04 1.226090e+06 6.647528e+05 5.001475e+05 2.646918e+05 6.579472e+05 7.882822e+05 5.650354e+05 4.320610e+05 4.344899e+05 9.026056e+05 8.205941e+05 5.216333e+05 1.735908e+06 2.162403e+05 9.865535e+05 6.369199e+05 1.557549e+06 1.206857e+06 3.046789e+05 3.030513e+06 5.179582e+05 5.413293e+05 3.058473e+05 5.832833e+05 6.276602e+05 1.894010e+05 4.790404e+05 3.234812e+05 5.517856e+05 1.032015e+05 4.908191e+05 4.901229e+05 7.497074e+05 8.187142e+05 9.751467e+05 3.707424e+06 1.153237e+06 8.365854e+05 1.125338e+06 4.212179e+05 3.690643e+05 5.154245e+05 3.338842e+05 5.064086e+05 2.486296e+05 2.947442e+05 5.252987e+05 4.819023e+05 3.710078e+05 3.338507e+05 9.046800e+05 5.125309e+05 7.314339e+04 7.487768e+05 6.413374e+05 3.827241e+05 9.285373e+05 1.093153e+06 4.781514e+05 6.526551e+05 7.510094e+05 5.238687e+05 1.188144e+06 3.992569e+05 4.216400e+05 8.449870e+05 1.526841e+06 7.525753e+05 5.503797e+05 3.941663e+05 8.705975e+05 3.794554e+05 5.976872e+05 4.002703e+05 5.163112e+05 7.723308e+05 8.409075e+05 4.127490e+05 3.169803e+05 2.818952e+05 8.387234e+05 5.405894e+05 5.646843e+05 7.140104e+05 5.071673e+05 1.362957e+05 6.388787e+05 7.079053e+05 5.475921e+05 4.731588e+05 7.097931e+05 7.671299e+05 1.525680e+06 3.367883e+05 3.572583e+05 1.259134e+06 7.237339e+05 3.858508e+05 1.123387e+06 4.218406e+05 1.837553e+06 6.405302e+06 5.257520e+05 1.261666e+06 3.005784e+06 1.055010e+06 9.812219e+05 1.982977e+06 9.646574e+05 4.814575e+06 8.961062e+05 4.199971e+06 2.354194e+06 8.827583e+05 1.727719e+06 1.606830e+06 2.310181e+06 4.705012e+06 3.304581e+06 8.822028e+05 7.197860e+06 7.566412e+06 7.770855e+06 4.479989e+05 1.861269e+06 1.283664e+06 1.899392e+06 7.365271e+05 8.676550e+05 1.990757e+06 2.373661e+06 1.418854e+06 8.717701e+05 8.788149e+05 3.903640e+05 2.074475e+06 1.292167e+06 4.735324e+06 1.078239e+06 2.550055e+06 2.002340e+06 2.371001e+06 1.663698e+06 7.305178e+05 1.192092e+06 2.643063e+06 2.162790e+06 8.577968e+05 8.360411e+05 1.306578e+06 2.212001e+06 2.836899e+06 5.735447e+05 2.041939e+06 3.038975e+06 1.521024e+06 2.315253e+06 2.862248e+06 1.812301e+06 2.082900e+06 4.276322e+05 6.539189e+05 1.436072e+06 1.613868e+06 9.440517e+05 1.672383e+06 7.259112e+05 4.633039e+05 4.576016e+05 7.449038e+05 8.910817e+05 1.857121e+06 4.874725e+05 2.953210e+06 1.706236e+06 1.933152e+06 2.167090e+05 8.221633e+05 3.478715e+05 2.100375e+05 7.550020e+05 4.060524e+05 1.609568e+06 "Hexa-2,4-dienedial (1)_1.743" 2.033386e+05 3.489270e+07 3.174043e+07 3.568446e+07 1.590881e+05 3.604884e+07 2.779532e+07 4.482670e+07 236432.52 3.397775e+07 3.763140e+07 3.402250e+07 208059.91 3.338756e+07 2.638786e+07 4.113601e+07 1.412368e+05 3.505925e+07 3.425572e+07 3.465254e+07 3.536971e+05 3.324385e+07 3.390620e+07 4.173034e+07 154860.777 2.977521e+07 3.371810e+07 3.713128e+07 1.233441e+05 2.660197e+07 4.959121e+07 3.515794e+07 201764.05 2.587346e+07 3.391039e+07 3.948368e+07 2.362524e+05 3.012616e+07 3.178894e+07 4.161144e+07 2.176447e+05 3.056441e+07 3.382016e+07 4.386495e+07 3.124009e+05 2.365957e+07 4.699861e+07 2.651583e+07 3.475795e+07 3.385161e+07 6.850574e+06 4.175743e+07 3.689784e+07 2.819705e+07 3.269943e+07 4.898328e+07 3.613267e+07 3.051906e+07 3.604309e+07 3.053375e+07 4.602275e+07 6.013014e+07 3.772631e+07 4.347388e+07 3.139172e+07 4.409255e+07 4.746908e+07 3.750242e+07 2.744482e+07 3.156951e+07 5.299651e+07 3.545456e+07 4.272820e+07 4.608871e+07 2.174600e+07 2.511954e+07 2.962160e+07 3.819341e+07 3.838147e+05 6.210420e+07 3.302840e+07 2.517379e+07 3.105408e+07 3.740348e+07 3.046312e+07 3.068246e+07 1.774292e+07 1.828917e+07 2.903894e+07 3.385387e+07 6.278633e+07 3.470122e+07 3.454262e+07 3.217704e+07 3.611383e+07 3.887868e+07 6.876215e+07 2.930169e+07 3.480477e+07 3.883775e+07 3.420699e+07 3.035527e+07 2.311181e+07 4.471670e+07 3.777818e+07 3.812027e+07 2.668886e+07 3.249158e+07 1.793751e+07 2.604212e+07 2.809132e+07 5.443762e+07 4.096458e+07 4.865498e+07 4.729307e+07 2.649072e+07 4.271376e+07 5.788390e+07 2.065303e+07 3.149549e+07 3.200883e+07 1.659035e+07 2.039197e+07 2.110434e+07 2.930663e+07 2.879266e+07 7.314765e+07 2.660228e+07 2.959679e+07 3.423321e+07 3.020598e+07 2.120033e+05 2.611216e+07 3.107119e+07 2.898466e+07 3.327402e+07 5.075327e+07 6.112316e+07 2.449533e+07 3.713058e+07 2.987583e+07 4.283237e+07 7.779777e+07 3.039687e+07 3.172482e+07 4.730308e+07 3.974704e+07 3.177274e+07 4.306801e+07 7.472189e+07 4.699036e+07 4.114513e+07 2.296324e+07 3.566376e+07 2.929103e+07 3.943090e+07 4.248338e+07 6.766363e+07 6.261838e+07 4.236635e+07 5.174022e+07 5.793971e+07 4.352295e+07 3.117401e+07 4.719634e+07 2.670142e+07 4.009079e+07 3.223909e+07 3.564205e+07 4.040074e+07 3.430058e+07 4.008396e+07 2.274784e+07 2.629190e+07 4.269936e+07 3.649486e+07 3.362052e+07 3.409584e+07 5.796037e+07 3.921610e+07 8.427077e+07 3.150112e+07 2.622901e+07 6.635196e+07 2.863096e+07 3.052889e+07 2.681868e+07 2.769497e+07 7.258155e+07 1.940764e+07 5.847838e+07 4.555233e+07 2.886605e+07 4.253883e+07 7.669600e+07 1.242586e+07 9.173609e+07 6.633437e+07 2.269455e+07 7.873827e+07 7.222137e+07 7.065372e+07 4.600704e+07 9.824946e+06 3.800299e+07 2.819828e+07 3.160055e+07 2.567205e+07 4.114313e+07 4.072164e+07 3.024278e+07 2.363166e+07 2.125361e+07 4.879947e+07 4.575853e+07 3.343146e+07 8.026339e+07 6.318844e+07 4.729656e+07 3.523188e+07 4.062428e+07 2.983604e+07 2.649215e+07 5.198288e+07 4.208391e+07 6.629798e+07 3.355496e+07 6.503466e+07 4.038582e+07 3.524840e+07 3.566070e+07 4.389047e+07 3.403684e+07 3.784328e+07 3.384752e+07 2.490904e+07 4.256098e+07 2.759643e+07 3.401061e+07 3.032417e+07 6.616556e+07 3.883650e+07 4.055374e+07 5.311143e+07 3.934512e+07 7.479034e+07 3.794268e+07 3.369883e+07 3.459336e+07 5.428574e+07 7.212485e+07 2.401451e+07 4.402424e+07 3.273946e+07 6.881459e+07 3.210300e+07 3.029455e+07 3.945593e+07 2.159675e+07 4.460048e+07 5.509446e+07 4.266192e+07 "cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylic acid_1.744" 1.051474e+06 1.132763e+07 8.193829e+06 9.885019e+06 1.134619e+05 1.009093e+07 1.007513e+07 1.298239e+07 155992.13 9.798222e+06 1.106056e+07 9.797808e+06 138688.55 9.982948e+06 9.168931e+06 1.085150e+07 1.068767e+05 1.046982e+07 9.970906e+06 1.035087e+07 2.688684e+05 1.024107e+07 9.714552e+06 1.226366e+07 120761.584 7.897767e+06 1.215590e+07 1.039454e+07 1.015903e+05 9.080413e+06 1.066888e+07 1.229285e+07 149975.65 7.815829e+06 1.140736e+07 1.033021e+07 1.911232e+05 9.092787e+06 1.008540e+07 1.049358e+07 1.727896e+05 9.673658e+06 1.172152e+07 1.429863e+07 2.496063e+05 4.219622e+06 1.384868e+07 8.391517e+06 6.846961e+06 9.396148e+06 1.389060e+06 1.090204e+07 7.301281e+06 7.746961e+06 7.430737e+06 9.059160e+06 9.189763e+06 1.026295e+07 8.189788e+06 9.292320e+06 1.236679e+07 7.814565e+06 1.053775e+07 1.015423e+07 1.073678e+07 1.010128e+07 1.424116e+07 9.675873e+06 1.011995e+07 9.352011e+06 1.311979e+07 1.182409e+07 1.339357e+07 1.301564e+07 7.419398e+06 8.356953e+06 8.815940e+06 9.053035e+06 4.892848e+05 1.062963e+07 9.375569e+06 1.026396e+07 8.868223e+06 1.022703e+07 7.711523e+06 8.393394e+06 4.134251e+06 6.043050e+06 9.732645e+06 9.800315e+06 1.559859e+07 9.871291e+06 1.212149e+07 9.544499e+06 8.410829e+06 1.146840e+07 1.720906e+07 8.019437e+06 1.159417e+07 1.029723e+07 1.082224e+07 1.000039e+07 6.334116e+06 1.179177e+07 1.325259e+07 1.305811e+07 1.025985e+07 1.060392e+07 6.513050e+06 8.003289e+06 9.226015e+06 1.749574e+07 1.355275e+07 9.013685e+06 1.298296e+07 8.835780e+06 1.345054e+07 1.171109e+07 7.838542e+06 1.272380e+07 6.675247e+06 6.280165e+06 6.361793e+06 7.714368e+06 9.059072e+06 8.417927e+06 1.423380e+07 5.221346e+06 8.368540e+06 1.026399e+07 9.572242e+06 3.094293e+05 1.167246e+07 1.091110e+07 1.032674e+07 1.104664e+07 1.545078e+07 1.362361e+07 9.386812e+06 1.333089e+07 4.757711e+06 1.526150e+07 1.571135e+07 7.153054e+06 9.250703e+06 1.132819e+07 5.383386e+06 1.028881e+07 1.117395e+07 1.561983e+07 1.242598e+07 1.159300e+07 7.507668e+06 1.223100e+07 1.277246e+07 1.443945e+07 1.912852e+07 2.448764e+07 2.851861e+07 1.532289e+07 1.320596e+07 1.820550e+07 9.577872e+06 1.044983e+07 9.962127e+06 8.467026e+06 7.830729e+06 8.602140e+06 7.997705e+06 7.977666e+06 8.757889e+06 8.216418e+06 8.046189e+06 7.539753e+06 1.033756e+07 1.010771e+07 1.080044e+07 6.761571e+06 1.311140e+07 1.031926e+07 1.665615e+07 8.783483e+06 8.103682e+06 1.500751e+07 9.741457e+06 9.544156e+06 9.426944e+06 7.065982e+06 1.719825e+07 5.995490e+06 1.635415e+07 1.181933e+07 7.405409e+06 1.144205e+07 1.369273e+07 8.312191e+06 1.728860e+07 1.842698e+07 8.340439e+06 2.007227e+07 1.751514e+07 1.661409e+07 8.742272e+06 8.702666e+06 1.113473e+07 8.093085e+06 1.208593e+07 7.568720e+06 1.358095e+07 1.309366e+07 8.636182e+06 8.666198e+06 8.734947e+06 1.036667e+07 1.496323e+07 1.049911e+07 1.441429e+07 1.234773e+07 1.215660e+07 1.351532e+07 1.138678e+07 8.649322e+06 7.901827e+06 1.376774e+07 1.337670e+07 1.897174e+07 1.184716e+07 1.257348e+07 1.229854e+07 1.062287e+07 1.165624e+07 1.109737e+07 1.016598e+07 1.055736e+07 1.021087e+07 7.776942e+06 1.110136e+07 1.000903e+07 9.735863e+06 7.936328e+06 1.384712e+07 8.208516e+06 1.006708e+07 1.147586e+07 8.122965e+06 1.043356e+07 1.190527e+07 9.860533e+06 8.916340e+06 1.212752e+07 1.011063e+07 1.397000e+07 1.016626e+07 9.386610e+06 1.680216e+07 6.422750e+06 8.253378e+06 1.496928e+07 6.858259e+06 6.641956e+06 9.685141e+06 9.814612e+06 C20 H37 N O9_1.744 4.621934e+04 3.272419e+06 4.458102e+06 3.779281e+06 3.694926e+04 4.048519e+06 3.725421e+06 5.198603e+06 62610.58 3.686868e+06 3.567782e+06 4.306960e+06 61281.91 3.872432e+06 3.209033e+06 4.594913e+06 5.067512e+04 4.016212e+06 3.698541e+06 4.189347e+06 1.359970e+05 3.829016e+06 3.195158e+06 4.034635e+06 59631.988 4.127299e+06 4.474383e+06 4.369865e+06 4.867602e+04 3.888031e+06 3.243549e+06 5.195818e+06 61962.94 2.645199e+06 4.255215e+06 4.066597e+06 7.686404e+04 3.550148e+06 4.142606e+06 4.113649e+06 7.020441e+04 3.641687e+06 4.039856e+06 5.760059e+06 9.688865e+04 1.992451e+06 4.718636e+06 3.532397e+06 5.240607e+06 3.257360e+06 1.668316e+06 2.432501e+06 2.742946e+06 5.736685e+06 4.484098e+06 2.598053e+06 3.648795e+06 4.883249e+06 4.878573e+06 3.786997e+06 7.070238e+06 2.810364e+06 4.418835e+06 3.869269e+06 3.182742e+06 1.373070e+06 4.771842e+06 4.599078e+06 5.357899e+06 2.818478e+06 3.165336e+06 4.005017e+06 6.552467e+06 2.885914e+06 3.441476e+06 2.703976e+06 4.117122e+06 6.157885e+06 3.446367e+05 5.083817e+06 5.197544e+06 3.979187e+06 1.291594e+06 2.113689e+06 2.493725e+06 3.253395e+06 3.695753e+06 1.332528e+06 3.963084e+06 4.752665e+06 4.189447e+06 2.146155e+06 3.890365e+06 4.123776e+06 3.829773e+06 2.758559e+06 2.918340e+06 5.712695e+06 2.333740e+06 4.628029e+06 5.003821e+06 2.470877e+06 4.901060e+06 4.349684e+06 3.422442e+06 6.943661e+06 2.136094e+06 4.527000e+06 1.731257e+06 3.229339e+06 2.833782e+06 3.183586e+06 3.708055e+06 3.324471e+06 3.595518e+06 4.506676e+06 5.627814e+06 6.085695e+06 2.969061e+06 7.429362e+06 2.490566e+06 1.144071e+06 3.217176e+06 1.237936e+07 3.442114e+06 8.127443e+06 8.295454e+06 7.233430e+06 1.854930e+06 4.383413e+06 5.134981e+06 7.466793e+04 4.060510e+06 3.980541e+06 2.960775e+06 4.557694e+06 4.165221e+06 3.316182e+06 3.763414e+06 2.352460e+06 4.892875e+06 7.861088e+06 3.150729e+06 2.131572e+06 4.284799e+06 5.715777e+06 2.838573e+06 4.536593e+06 1.376386e+07 4.744868e+06 5.213238e+06 5.135342e+06 2.849468e+06 3.055524e+06 2.365560e+06 5.874257e+06 5.098864e+06 4.669155e+06 4.444070e+06 4.410577e+06 6.304751e+06 3.803045e+06 1.668349e+06 6.262573e+06 4.808604e+06 3.040546e+06 3.815303e+06 4.580038e+06 2.178376e+06 3.575597e+06 4.876280e+06 3.532989e+06 5.469087e+06 6.675360e+06 4.473077e+06 2.985156e+06 2.452232e+06 3.880524e+06 5.117942e+06 4.621199e+06 5.433696e+06 1.089706e+07 3.314257e+06 2.159083e+06 4.354100e+06 2.867148e+06 3.753110e+06 2.143285e+06 5.676699e+06 1.260393e+06 3.880359e+06 5.825845e+06 3.926479e+06 4.228972e+06 5.621238e+06 2.966026e+06 1.630656e+07 8.574440e+06 1.639615e+06 4.721043e+06 2.042261e+06 3.842497e+06 3.260357e+06 2.209328e+06 3.504350e+06 1.274171e+06 1.352699e+06 1.306261e+06 4.580011e+06 3.402275e+06 2.904590e+06 2.546558e+06 2.440511e+06 3.030185e+06 3.921497e+06 2.523118e+06 6.781563e+06 1.638917e+06 8.354424e+05 2.875017e+06 2.954579e+06 2.464781e+06 4.650506e+05 2.279838e+06 3.116857e+06 6.500523e+06 1.999166e+06 2.248678e+07 1.054772e+06 2.993325e+06 4.304604e+05 6.966401e+06 6.345168e+06 2.382077e+06 2.531461e+06 1.801836e+06 3.351825e+06 4.701170e+06 2.177193e+06 3.932815e+06 3.879903e+06 4.945923e+06 4.999169e+06 2.133231e+06 2.300260e+06 1.314184e+06 3.200750e+06 2.190472e+06 3.458751e+06 2.275356e+06 3.481480e+06 1.931824e+06 3.841330e+06 2.571788e+06 5.577441e+06 5.429622e+05 1.946955e+06 2.533528e+06 1.058960e+07 1.365682e+07 2.336803e+06 2.806487e+06 C15 H35 N7 P2 S_1.744 7.759396e+04 2.982191e+06 4.005030e+06 3.585361e+06 4.102720e+04 3.400477e+06 3.193541e+06 4.805987e+06 62865.22 3.189303e+06 4.112098e+06 3.530941e+06 61499.52 3.629985e+06 2.136280e+06 3.960582e+06 5.276808e+04 4.094173e+06 4.162763e+06 3.997380e+06 1.481002e+05 2.206687e+06 3.235457e+06 4.098282e+06 64451.166 3.197793e+06 3.843646e+06 4.171592e+06 4.933523e+04 3.329228e+06 3.859106e+06 4.739556e+06 72308.52 1.589707e+06 4.448444e+06 3.213898e+06 8.557597e+04 2.889995e+06 3.967791e+06 3.461504e+06 6.831017e+04 3.304617e+06 3.997206e+06 5.077069e+06 9.675716e+04 2.177141e+06 4.913613e+06 2.221362e+06 4.118744e+06 1.706207e+06 2.596750e+06 2.155027e+06 3.579423e+06 4.683467e+06 3.715549e+06 2.259339e+06 4.045034e+06 4.495712e+06 2.199624e+06 2.635874e+06 6.895524e+06 5.167990e+06 3.982821e+06 3.157407e+06 2.249777e+06 1.728175e+06 4.866513e+06 4.293826e+06 5.473088e+06 4.056488e+06 1.008620e+06 4.289202e+06 7.187865e+06 2.904582e+06 3.338891e+06 7.962342e+05 3.716275e+06 5.889034e+06 1.400400e+05 4.517021e+06 3.740491e+06 3.246328e+06 5.966713e+05 1.301324e+06 2.624062e+06 2.056484e+06 3.357891e+06 9.334881e+05 3.592032e+06 5.002061e+06 2.832458e+06 1.247747e+06 3.687022e+06 3.766868e+06 1.804364e+06 2.342909e+06 2.522284e+06 4.552124e+06 1.779841e+06 4.473185e+06 3.144250e+06 3.061262e+06 4.691737e+06 4.866711e+06 1.830210e+06 5.638552e+06 2.903149e+06 1.981252e+06 4.317647e+05 2.570892e+06 2.644845e+06 4.272807e+06 6.362828e+06 2.456160e+06 1.349627e+06 3.567299e+06 4.625610e+06 5.906740e+06 2.700201e+06 5.903792e+06 2.494860e+06 8.447192e+05 2.552896e+06 1.029191e+07 4.037280e+06 5.645676e+06 5.706552e+06 3.833729e+06 4.766854e+06 3.593423e+06 4.109882e+06 7.712732e+04 3.874918e+06 2.269273e+06 2.043277e+06 4.133858e+06 4.808929e+06 6.819945e+06 3.210484e+06 3.651318e+06 1.722630e+06 7.654764e+06 3.717503e+06 1.013638e+06 2.159925e+06 4.985618e+06 2.593092e+06 3.862966e+06 1.099120e+07 4.511263e+06 4.211584e+06 4.006591e+06 1.870599e+06 3.215193e+06 3.083197e+06 5.485409e+06 5.004409e+06 3.770510e+06 4.005196e+06 4.582684e+06 4.602424e+06 3.495437e+06 3.148776e+06 5.270677e+06 3.574651e+06 7.892915e+05 2.939143e+06 1.187183e+06 1.237208e+06 2.014329e+06 4.115523e+06 3.806976e+06 4.238091e+06 5.628363e+06 5.259897e+06 2.556505e+06 1.754590e+06 2.690524e+06 4.178137e+06 3.966537e+06 6.265277e+06 1.042333e+07 3.360916e+06 4.705860e+06 5.253082e+06 3.750984e+06 3.277393e+06 2.266798e+06 1.914796e+06 1.044175e+06 2.751373e+06 5.707644e+06 3.486911e+06 3.660733e+06 6.390222e+06 3.355533e+06 1.630069e+07 7.396498e+06 3.177645e+06 5.590756e+06 2.449841e+06 6.898083e+06 2.261448e+06 2.154455e+06 3.093802e+06 4.759301e+05 3.028619e+06 1.347328e+06 5.275643e+06 3.580683e+06 2.593637e+06 3.110869e+06 2.639994e+06 2.727189e+06 3.931126e+06 2.327480e+06 7.618565e+06 1.614855e+06 5.049790e+05 4.291169e+06 3.235081e+06 2.891618e+06 4.790642e+05 2.539406e+06 4.766232e+06 6.187231e+06 2.374545e+06 2.015195e+07 9.574223e+05 2.995703e+06 5.049952e+05 6.921487e+06 6.170897e+06 2.638895e+06 1.907468e+06 2.920999e+06 1.279082e+06 4.648317e+06 2.300431e+06 2.818478e+06 3.210175e+06 3.965481e+06 4.446979e+06 3.314267e+06 9.686783e+05 8.443025e+05 7.731654e+05 1.371947e+06 1.070945e+06 1.901055e+06 2.053143e+06 1.088444e+06 1.524438e+06 2.261828e+06 4.926376e+06 1.516325e+05 1.252662e+06 1.882220e+06 9.789112e+06 1.344565e+07 2.875190e+06 3.217360e+06 C5 H14 N8 O2 S_1.744 9.026888e+04 1.776159e+06 1.652107e+06 1.819906e+06 6.783460e+04 1.586929e+06 1.322971e+06 2.137404e+06 82892.00 1.450667e+06 1.673726e+06 2.006057e+06 63040.00 1.657904e+06 1.410229e+06 2.509349e+06 4.779574e+04 1.520321e+06 1.216528e+06 1.560787e+06 1.318375e+05 1.654084e+06 1.462984e+06 2.274310e+06 57386.634 1.402563e+06 1.904492e+06 2.463680e+06 4.946748e+04 8.966260e+05 1.336886e+06 2.398124e+06 72645.69 1.418680e+06 1.512533e+06 1.739229e+06 8.299470e+04 1.427260e+06 1.544624e+06 2.015150e+06 6.773027e+04 2.154099e+06 1.463120e+06 1.676656e+06 1.052791e+05 1.510884e+06 1.768930e+06 1.691920e+06 2.313671e+06 1.364583e+06 1.513423e+06 9.603934e+05 1.607201e+06 1.614031e+06 1.670938e+06 1.807898e+06 1.584825e+06 1.864526e+06 2.240258e+06 9.366237e+05 2.149629e+06 1.851735e+06 1.611395e+06 2.179677e+06 1.891758e+06 1.828787e+06 1.767921e+06 1.943085e+06 2.795394e+06 2.153218e+06 1.671778e+06 2.518473e+06 2.289613e+06 3.053566e+06 1.090143e+06 1.092309e+06 1.450013e+06 2.899914e+06 6.935099e+04 2.619480e+06 1.759022e+06 1.551165e+06 1.423732e+06 1.915892e+06 1.465004e+06 1.712333e+06 9.204238e+05 2.110873e+06 2.331902e+06 2.281978e+06 2.548362e+06 2.067863e+06 1.935709e+06 1.368611e+06 2.584142e+06 1.401480e+06 1.986610e+06 2.363281e+06 1.447511e+06 1.179239e+06 1.479432e+06 1.944780e+06 1.422854e+06 2.000948e+06 1.802677e+06 1.456308e+06 2.264391e+06 2.016704e+06 1.594969e+06 1.151330e+06 1.267610e+06 2.226620e+06 1.818780e+06 1.805207e+06 1.869604e+06 1.967760e+06 1.683858e+06 1.777103e+06 1.009795e+06 2.444516e+06 1.941410e+06 7.545443e+05 1.460185e+06 1.534660e+06 1.427794e+06 1.465165e+06 2.053893e+06 2.185396e+06 1.359719e+06 1.377372e+06 2.055643e+06 7.530743e+04 2.160400e+06 2.306686e+06 1.711284e+06 1.753200e+06 2.066306e+06 1.343924e+06 1.228679e+06 1.648401e+06 1.062275e+06 1.886531e+06 2.247947e+06 1.262862e+06 1.771708e+06 1.329042e+06 2.376350e+06 1.436671e+06 1.480868e+06 1.957629e+06 1.746344e+06 1.604023e+06 1.439505e+06 1.298599e+06 1.702296e+06 1.807616e+06 2.052357e+06 2.692746e+06 2.541574e+06 1.471290e+06 2.202729e+06 1.508791e+06 1.225549e+06 2.143819e+06 1.725614e+06 1.285455e+06 2.272580e+06 2.497587e+06 1.453384e+06 1.446753e+06 1.940437e+06 1.754760e+06 2.072110e+06 2.189887e+06 2.530074e+06 1.765546e+06 1.675281e+06 2.101459e+06 1.833942e+06 2.693951e+06 1.768463e+06 2.374249e+06 1.531075e+06 1.532533e+06 2.393593e+06 1.996968e+06 1.781404e+06 1.562597e+06 1.759070e+06 1.244655e+06 2.022110e+06 1.611487e+06 2.231593e+06 1.851995e+06 1.361820e+06 1.808864e+06 1.786810e+06 1.384432e+06 1.966358e+06 1.729627e+06 1.832272e+06 1.630791e+06 1.914322e+06 1.640394e+06 2.250987e+06 1.629192e+06 1.383581e+06 1.392935e+06 3.163144e+06 2.483031e+06 1.642154e+06 1.450200e+06 1.593807e+06 2.344932e+06 1.982637e+06 1.643202e+06 2.233961e+06 1.836735e+06 1.600695e+06 1.918349e+06 2.220519e+06 1.605623e+06 7.200813e+05 3.310044e+06 2.379936e+06 2.694257e+06 2.073004e+06 2.006851e+06 2.012991e+06 1.455620e+06 2.058479e+06 2.066214e+06 1.984790e+06 2.514033e+06 1.873000e+06 1.432175e+06 2.349835e+06 2.418011e+06 1.806895e+06 1.708390e+06 1.817341e+06 1.897231e+06 1.989971e+06 2.019813e+06 2.061974e+06 2.319248e+06 1.834005e+06 1.565767e+06 1.677321e+06 1.482485e+06 1.708542e+06 1.523391e+06 3.533998e+06 1.964906e+06 1.876195e+06 1.149953e+06 1.927179e+06 1.754613e+06 1.070077e+06 1.428659e+06 1.153966e+06 1.431556e+06 C17 H38 N9 O4 P_1.744 1.819794e+04 6.561083e+05 7.212566e+05 4.383252e+05 1.623217e+04 8.287226e+05 3.739339e+05 6.202170e+05 56192.23 5.074300e+05 6.139942e+05 7.220396e+05 73088.94 5.854707e+05 3.774930e+05 9.368094e+05 5.416349e+04 7.197352e+05 5.336404e+05 6.436928e+05 1.336652e+05 5.744734e+05 6.361438e+05 5.456351e+05 62615.650 6.582041e+05 4.052514e+05 8.207008e+05 4.006798e+04 6.493553e+05 6.305288e+05 7.769994e+05 53673.31 3.820221e+05 5.656194e+05 5.658198e+05 6.600292e+04 7.855572e+05 6.122768e+05 7.081771e+05 6.186765e+04 4.601692e+05 4.458191e+05 8.330908e+05 8.305718e+04 6.137418e+05 6.692278e+05 5.337710e+05 8.427643e+05 1.088281e+06 3.003781e+05 3.754357e+05 6.366952e+05 6.865074e+05 8.363277e+05 6.158924e+05 5.003270e+05 6.686817e+05 1.758480e+06 6.827884e+05 1.625813e+06 1.427682e+06 8.663556e+05 5.400216e+05 4.532407e+05 3.789062e+05 6.980264e+05 5.557532e+05 7.704114e+05 7.308590e+05 3.666780e+05 5.113441e+05 5.337335e+05 2.960854e+05 6.167482e+05 3.030940e+05 7.098729e+05 1.011374e+06 2.406349e+05 5.726235e+05 1.456523e+06 5.738451e+05 2.820345e+05 3.310314e+05 4.676522e+05 3.585365e+05 3.957669e+05 1.163945e+05 6.677626e+05 7.729362e+05 4.152307e+05 3.655303e+05 4.715336e+05 6.345992e+05 5.646894e+05 3.648038e+05 5.465680e+05 1.621185e+06 2.504705e+05 4.979444e+05 1.217986e+06 5.296436e+05 1.515756e+06 6.664737e+05 4.796801e+05 1.842688e+06 3.782948e+05 7.054081e+05 4.120303e+05 3.053110e+05 2.723234e+05 3.173056e+05 7.356619e+05 6.122662e+05 6.580795e+05 7.635769e+05 9.609464e+05 9.334875e+05 4.887474e+05 1.958279e+06 6.220425e+05 1.297084e+05 4.764434e+05 3.733742e+06 1.035278e+06 1.789360e+06 1.430821e+06 7.590076e+05 1.921031e+06 6.905636e+05 6.256603e+05 1.130982e+05 5.766408e+05 4.111330e+05 9.660512e+05 5.493108e+05 5.462101e+05 1.683678e+06 4.187459e+05 4.184469e+05 8.961035e+05 9.497049e+05 6.169088e+05 2.335752e+05 7.263429e+05 5.998234e+05 5.357219e+05 4.438412e+05 4.878175e+06 7.331988e+05 1.683468e+06 2.677736e+05 3.411527e+05 3.898849e+05 4.014355e+05 6.367780e+05 1.904556e+06 6.134748e+05 2.169120e+05 6.080879e+05 8.899890e+05 3.414718e+05 2.629775e+05 8.178203e+05 7.305822e+05 5.686147e+05 4.842921e+05 5.146512e+05 4.456911e+05 5.289136e+05 5.953026e+05 7.797263e+05 1.763198e+06 2.160777e+06 8.209261e+05 1.348173e+05 3.140486e+05 6.400232e+05 8.065415e+05 6.680531e+05 1.109171e+06 2.103536e+06 4.890624e+05 4.447246e+05 4.391575e+05 4.496943e+05 4.484776e+05 4.396886e+05 4.498932e+05 2.895573e+05 4.725269e+05 7.745484e+05 6.852633e+05 4.756180e+05 1.104386e+06 3.478915e+05 1.152438e+06 1.006749e+06 4.699279e+05 2.270436e+05 2.598020e+05 3.419521e+05 9.017341e+05 2.906678e+05 3.922178e+05 2.395891e+05 2.615021e+05 1.197213e+05 5.197384e+05 3.457253e+05 3.582318e+05 3.933558e+05 3.937239e+05 5.410239e+05 2.762766e+05 6.730249e+05 9.452243e+05 2.665228e+05 2.961093e+05 3.275221e+05 3.863616e+05 3.092742e+05 1.466458e+05 1.692832e+05 5.197144e+05 1.086491e+06 2.163309e+05 6.155450e+06 1.586423e+05 2.884403e+05 1.722416e+05 1.376883e+06 8.517315e+05 3.425037e+05 4.009110e+05 3.158406e+05 2.943673e+05 4.168556e+05 1.870348e+05 6.796833e+05 4.776133e+05 1.033322e+06 7.182666e+05 4.247845e+05 4.419824e+05 1.675487e+05 5.942588e+05 3.893364e+05 5.818266e+05 6.377081e+05 7.691775e+05 2.470350e+05 5.510798e+05 3.423170e+05 8.803741e+05 1.141943e+05 2.109304e+05 4.485210e+05 3.996010e+06 3.084806e+06 1.243956e+06 6.564156e+05 C9 H11 N O P2 S_1.744 1.225457e+05 2.005246e+06 2.057107e+06 1.594580e+06 9.085059e+04 2.413993e+06 1.502916e+06 1.546287e+06 107746.96 2.581186e+06 2.997472e+06 2.118849e+06 87880.88 1.473078e+06 1.197082e+06 3.077980e+06 6.195719e+04 1.336760e+06 2.655523e+06 9.596836e+05 1.458929e+05 2.243345e+06 2.397866e+06 1.339952e+06 63697.862 2.793922e+06 1.906373e+06 2.717422e+06 6.248530e+04 1.289498e+06 1.983085e+06 2.835020e+06 94452.96 1.289487e+06 8.933720e+05 2.225447e+06 1.044344e+05 3.236620e+06 1.032402e+06 2.411116e+06 8.843343e+04 2.679826e+06 1.061851e+06 2.787096e+06 1.220237e+05 1.394026e+06 2.187924e+06 2.010712e+06 2.742663e+06 2.882393e+06 9.662686e+05 6.714960e+05 1.266233e+06 1.920603e+06 3.554179e+06 7.545588e+05 3.067987e+06 1.328421e+06 1.363718e+06 1.343717e+06 9.218988e+05 1.354587e+06 2.792455e+06 2.513471e+06 1.222997e+06 2.914219e+06 1.802454e+06 2.732251e+06 1.323700e+06 2.599651e+06 1.282580e+06 1.024568e+06 2.860413e+06 1.376659e+06 3.851009e+06 2.653018e+06 2.556025e+06 2.364709e+06 9.480306e+04 2.990857e+06 1.770317e+06 3.376126e+06 1.732932e+06 3.187766e+06 2.058924e+06 2.665748e+06 1.365546e+06 4.308780e+06 1.834739e+06 2.656651e+06 9.621643e+05 3.501254e+06 1.112884e+06 1.405027e+06 1.658420e+06 1.746934e+06 2.011055e+06 1.161330e+06 3.055325e+06 1.053087e+06 2.230268e+06 8.835373e+05 3.147499e+06 2.808048e+06 9.691728e+05 3.320764e+06 3.456691e+06 2.416529e+06 1.612812e+06 2.297270e+06 3.326102e+06 1.878694e+06 1.441680e+06 2.256974e+06 4.120416e+06 3.639186e+06 2.937286e+06 3.372161e+06 3.898784e+06 2.116014e+06 2.514997e+06 1.420980e+06 2.043533e+06 1.054131e+06 2.720756e+06 2.457113e+06 3.665374e+06 1.627563e+06 2.763832e+06 3.276656e+06 4.199665e+06 9.548842e+04 1.761163e+06 2.185211e+06 2.618068e+06 2.802484e+06 3.307709e+06 2.728768e+06 2.339466e+06 2.508782e+06 1.226196e+06 1.734556e+06 2.274259e+06 2.878124e+06 4.072188e+06 3.334656e+06 1.539730e+06 2.859907e+06 1.407604e+06 1.823933e+06 2.172124e+06 3.090051e+06 2.411842e+06 1.187594e+06 2.689944e+06 3.805566e+06 1.509742e+06 1.671685e+06 1.568898e+06 3.277511e+06 2.771952e+06 8.885789e+05 3.123476e+06 3.802429e+06 2.621040e+06 1.379800e+06 2.557066e+06 2.923489e+06 2.393197e+06 3.109128e+06 1.530511e+06 3.109512e+06 2.473930e+06 2.615835e+06 1.681001e+06 3.893432e+06 9.687008e+05 1.986267e+06 1.960091e+06 3.451575e+06 1.811973e+06 3.546660e+06 1.317571e+06 1.217944e+06 2.734895e+06 2.418356e+06 3.107252e+06 2.825412e+06 1.305809e+06 1.690438e+06 6.956557e+05 2.563052e+06 3.368177e+06 1.110157e+06 7.323290e+05 3.217035e+06 1.154108e+06 6.999488e+05 6.047190e+05 1.288077e+06 2.867808e+06 1.176154e+06 2.966802e+06 3.017238e+06 2.812441e+06 2.789817e+06 2.470752e+06 1.584929e+06 2.336391e+06 3.262521e+06 2.872764e+06 2.364801e+06 2.240344e+06 2.436293e+06 1.158817e+06 2.455179e+06 1.606071e+06 1.229830e+06 3.484317e+06 1.052253e+06 2.989053e+06 3.055976e+06 6.379195e+05 1.324956e+06 2.332718e+06 1.244545e+06 1.722775e+06 1.883972e+06 2.137551e+06 3.306830e+06 2.929646e+06 9.922391e+05 1.524247e+06 2.937214e+06 2.703614e+06 1.155502e+06 2.934210e+06 1.230902e+06 3.717870e+06 3.972411e+06 1.563135e+06 1.482080e+06 2.786519e+06 1.477209e+06 3.500322e+06 3.278467e+06 8.646944e+05 1.750534e+06 1.458714e+06 1.506464e+06 2.803347e+06 3.014370e+06 1.200851e+06 2.263332e+06 1.509607e+06 2.024052e+06 3.477618e+06 1.430692e+06 1.121485e+06 1.144702e+06 8.071143e+05 2.630278e+06 C12 H20 O4_1.744 1.928943e+05 7.488943e+05 2.595827e+05 2.381756e+05 8.246236e+04 3.451038e+05 3.738800e+05 4.918613e+05 179880.53 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7.795905e+06 4.271059e+06 1.308277e+07 3.168694e+06 4.119838e+06 8.493057e+06 2.109481e+06 5.711136e+06 3.146024e+06 4.755252e+06 C5 H15 N9 O2 P2 S_1.745 9.482855e+04 2.171922e+06 2.277125e+06 2.427599e+06 7.048737e+04 5.891701e+06 2.180065e+06 2.413589e+06 89631.32 4.355374e+06 3.907374e+06 5.072820e+06 84410.23 1.778306e+06 2.794520e+06 2.716837e+06 8.406990e+04 2.574501e+06 2.552376e+06 2.608784e+06 1.972990e+05 3.407990e+06 5.636868e+06 1.500355e+06 72866.424 1.767825e+06 4.918570e+06 4.996074e+06 5.621423e+04 1.108364e+06 3.140240e+06 5.199066e+06 78806.37 1.902124e+06 2.276541e+06 2.788368e+06 9.129997e+04 1.633258e+06 5.811760e+06 4.189256e+06 7.430458e+04 1.572190e+06 2.607368e+06 5.531937e+06 1.145751e+05 1.242061e+06 2.911414e+06 3.465578e+06 2.484391e+06 4.924830e+06 1.284017e+06 1.483583e+06 2.308669e+06 2.653927e+06 5.914712e+06 3.646304e+06 3.107351e+06 3.765587e+06 3.789066e+06 2.097926e+06 5.053443e+06 3.202063e+06 4.694810e+06 2.446840e+06 2.331751e+06 2.322156e+06 6.074867e+06 2.795181e+06 8.485454e+06 2.066143e+06 1.831900e+06 3.479017e+06 5.834174e+06 5.817852e+06 4.476807e+06 4.317600e+06 5.028687e+06 3.640018e+06 1.151434e+05 2.794812e+06 4.454502e+06 6.226052e+06 2.740407e+06 3.124417e+06 5.815249e+06 4.906031e+06 1.996244e+06 4.797392e+06 5.083737e+06 2.688210e+06 1.798479e+06 4.082437e+06 1.982694e+06 4.037437e+06 2.553093e+06 3.286147e+06 4.667419e+06 3.472542e+06 5.875321e+06 2.256234e+06 5.365065e+06 1.312997e+06 4.678390e+06 4.558358e+06 2.008601e+06 2.345391e+06 1.547936e+06 1.369884e+06 3.557216e+06 1.419951e+06 6.216007e+06 3.506711e+06 2.607369e+06 1.700116e+06 2.304443e+06 2.032139e+06 2.196812e+06 5.262701e+06 4.333841e+06 4.977208e+06 4.313626e+06 3.257695e+06 4.774004e+06 1.180089e+06 2.709313e+06 3.454693e+06 2.259534e+06 3.257489e+06 2.630847e+06 4.564720e+06 4.973820e+06 1.360828e+05 4.965561e+06 4.381260e+06 2.340040e+06 3.119315e+06 3.030539e+06 2.069438e+06 2.527671e+06 5.937226e+06 1.153162e+06 2.654059e+06 2.226360e+06 1.786269e+06 4.755980e+06 4.548379e+06 2.477242e+06 6.378892e+06 1.709939e+06 2.674474e+06 2.160481e+06 2.091219e+06 5.086904e+06 1.741488e+06 2.363702e+06 4.616141e+06 2.540817e+06 5.849679e+06 1.508537e+06 5.013493e+06 4.583979e+06 5.133578e+06 5.254372e+06 5.319158e+06 2.017802e+06 4.368119e+06 4.187655e+06 4.698905e+06 2.011195e+06 4.369488e+06 3.806794e+06 5.823422e+06 4.495203e+06 2.153722e+06 5.923395e+06 4.113417e+06 2.026870e+06 2.205582e+06 3.018429e+06 2.743956e+06 1.845033e+06 1.874989e+06 2.897869e+06 1.073702e+06 4.987904e+06 4.693459e+06 2.289825e+06 1.636988e+06 1.471649e+06 3.689616e+06 1.100588e+06 1.568515e+06 2.364864e+06 1.996014e+06 1.605813e+06 2.204835e+06 2.256707e+06 2.237968e+06 1.483027e+06 2.700326e+06 1.677118e+06 2.331136e+06 2.834773e+06 4.117049e+06 5.633511e+06 2.366250e+06 2.328798e+06 1.334487e+06 2.240236e+06 5.026085e+06 1.913431e+06 2.160903e+06 2.486481e+06 1.596835e+06 2.635631e+06 2.832022e+06 2.069828e+06 3.469143e+06 2.643053e+06 5.779045e+06 2.509904e+06 4.404609e+06 2.711315e+06 5.377681e+06 2.212076e+06 2.104383e+06 2.211061e+06 3.369554e+06 5.657050e+06 4.724356e+06 5.577314e+06 2.342080e+06 4.548404e+06 3.359986e+06 2.192137e+06 5.509410e+06 2.494598e+06 7.480540e+06 2.409511e+06 2.768488e+06 3.192446e+06 2.437669e+06 3.005872e+06 2.007835e+06 5.386083e+06 3.329477e+06 2.206185e+06 6.719324e+06 6.570522e+06 1.890951e+06 5.357154e+06 3.879345e+06 2.184513e+06 2.740861e+06 1.794038e+06 5.294645e+06 4.773776e+06 4.914505e+06 2.412117e+06 3.432859e+06 1.991991e+06 3.671664e+06 522.17645_1.745 8.614908e+04 1.844185e+06 1.682809e+06 1.933437e+06 6.425376e+04 1.743161e+06 1.630905e+06 2.202369e+06 78587.11 1.689284e+06 1.849510e+06 2.006875e+06 62392.45 1.835968e+06 1.625708e+06 2.576394e+06 4.848135e+04 1.560883e+06 1.429456e+06 1.654656e+06 1.319028e+05 1.831389e+06 1.640651e+06 2.293477e+06 57147.961 1.621245e+06 2.089654e+06 2.484903e+06 4.927346e+04 1.127528e+06 1.456347e+06 2.415456e+06 72223.78 1.611685e+06 1.680027e+06 1.929110e+06 7.681927e+04 1.581782e+06 1.688056e+06 2.099197e+06 6.977640e+04 2.356509e+06 1.520657e+06 1.798165e+06 1.054382e+05 1.605168e+06 1.931162e+06 1.873817e+06 2.285930e+06 1.764247e+06 1.683648e+06 1.058228e+06 1.615024e+06 1.899785e+06 1.879982e+06 1.624794e+06 1.872962e+06 2.069113e+06 2.260942e+06 8.850706e+05 2.166625e+06 2.079422e+06 1.753856e+06 2.230682e+06 2.053137e+06 1.971514e+06 2.028849e+06 1.951481e+06 2.850790e+06 2.170264e+06 1.686986e+06 2.556315e+06 2.522301e+06 3.080796e+06 1.195905e+06 1.295412e+06 1.663445e+06 2.931685e+06 7.004294e+04 2.705321e+06 2.066994e+06 1.727776e+06 1.412121e+06 2.186727e+06 1.706731e+06 1.867191e+06 1.172558e+06 2.140682e+06 2.354241e+06 2.301318e+06 2.568756e+06 2.187520e+06 1.951980e+06 1.541859e+06 2.662178e+06 1.527387e+06 2.268544e+06 2.466568e+06 1.749841e+06 1.322956e+06 1.656187e+06 1.960732e+06 1.763494e+06 2.009555e+06 1.939876e+06 1.820640e+06 2.276501e+06 2.033314e+06 1.608137e+06 1.220474e+06 1.308707e+06 2.245510e+06 1.833664e+06 1.884407e+06 2.480163e+06 1.806000e+06 2.006711e+06 2.102551e+06 1.044487e+06 2.460325e+06 2.025771e+06 1.002227e+06 1.692480e+06 1.547213e+06 1.792401e+06 1.748115e+06 2.129034e+06 2.040592e+06 1.425761e+06 1.504280e+06 2.072103e+06 7.501326e+04 2.266149e+06 2.325544e+06 1.830958e+06 1.982319e+06 2.164543e+06 1.228853e+06 1.362512e+06 1.803711e+06 1.418274e+06 2.134428e+06 2.284834e+06 1.403040e+06 1.799259e+06 1.533316e+06 2.478734e+06 1.448273e+06 1.506151e+06 1.721794e+06 1.879812e+06 1.977430e+06 1.475227e+06 1.219538e+06 2.158317e+06 1.824126e+06 2.061262e+06 2.870632e+06 2.803531e+06 1.394687e+06 2.215111e+06 1.516547e+06 1.464191e+06 2.290113e+06 1.738915e+06 1.524050e+06 2.328879e+06 2.585993e+06 1.755235e+06 1.476666e+06 2.106644e+06 1.970422e+06 2.142572e+06 2.207237e+06 2.534667e+06 1.743487e+06 1.688067e+06 2.167646e+06 1.879783e+06 2.761979e+06 1.834623e+06 2.598327e+06 1.648451e+06 1.681689e+06 2.415382e+06 1.781165e+06 1.967518e+06 1.669226e+06 1.424029e+06 1.479194e+06 2.038615e+06 1.700184e+06 2.211299e+06 2.023600e+06 1.523460e+06 2.007957e+06 2.013442e+06 1.735126e+06 1.982416e+06 1.978048e+06 2.014019e+06 1.839912e+06 2.344713e+06 1.808072e+06 2.458006e+06 1.759101e+06 1.568178e+06 1.547529e+06 3.190244e+06 2.222587e+06 1.907665e+06 1.589992e+06 1.661141e+06 2.364122e+06 1.939162e+06 1.798472e+06 2.341206e+06 1.910841e+06 1.827433e+06 2.166075e+06 2.511489e+06 1.769632e+06 1.012851e+06 3.396235e+06 2.400800e+06 2.939269e+06 2.158030e+06 2.246697e+06 1.973568e+06 1.548377e+06 2.131823e+06 2.124451e+06 2.096336e+06 2.556781e+06 1.889089e+06 1.559591e+06 2.476061e+06 2.428918e+06 1.994542e+06 2.357871e+06 1.832758e+06 2.172683e+06 2.322286e+06 2.053707e+06 2.222720e+06 2.835895e+06 2.103084e+06 1.928429e+06 1.544328e+06 1.582302e+06 2.035737e+06 1.535868e+06 3.432012e+06 2.185688e+06 1.927758e+06 1.391493e+06 2.090436e+06 1.802882e+06 1.183020e+06 1.545850e+06 1.673310e+06 1.671940e+06 "Phellamurin (mzLogic match, not predicted comp)_1.745" 9.998616e+04 2.848340e+07 2.666504e+07 2.783706e+07 7.347015e+04 2.102144e+07 2.890317e+07 2.888858e+07 87222.46 2.798522e+07 3.310411e+07 2.609773e+07 72779.55 2.737236e+07 2.766772e+07 2.887429e+07 5.652009e+04 2.252969e+07 2.473272e+07 2.387960e+07 1.346432e+05 3.616842e+07 2.466190e+07 2.537200e+07 58669.751 2.927323e+07 3.526182e+07 3.730097e+07 5.214911e+04 1.219113e+07 2.453655e+07 2.664867e+07 70090.32 2.895867e+07 2.416016e+07 2.238269e+07 6.282405e+04 3.447451e+07 3.089879e+07 2.194895e+07 5.954455e+04 3.896930e+07 2.013808e+07 2.585396e+07 1.036187e+05 2.785089e+07 3.205441e+07 2.414494e+07 2.128480e+07 2.165493e+07 1.987514e+07 1.344296e+07 2.089505e+07 2.603258e+07 2.589649e+07 1.615758e+07 2.647871e+07 2.676728e+07 1.608092e+07 2.007809e+07 2.615928e+07 2.391685e+07 2.795271e+07 2.862937e+07 2.511412e+07 2.418996e+07 2.728399e+07 2.376319e+07 2.868691e+07 2.443862e+07 3.051898e+07 2.444092e+07 3.582033e+07 3.077620e+07 2.363540e+07 2.231783e+07 2.436804e+07 3.195816e+07 2.381679e+05 2.490170e+07 3.696855e+07 2.869360e+07 1.825733e+07 3.304812e+07 2.137498e+07 2.593285e+07 1.428315e+07 2.520730e+07 2.999105e+07 3.163230e+07 2.466210e+07 2.420788e+07 2.484916e+07 2.719864e+07 3.046279e+07 2.462772e+07 2.904499e+07 2.308628e+07 2.430285e+07 2.355658e+07 2.286624e+07 1.941603e+07 2.936171e+07 2.565519e+07 2.548659e+07 2.917162e+07 2.424850e+07 2.055724e+07 2.264528e+07 2.385470e+07 2.170220e+07 2.812623e+07 3.006625e+07 1.963080e+07 2.721967e+07 3.244821e+07 2.316091e+07 2.866806e+07 1.568802e+07 2.758920e+07 1.869557e+07 1.664346e+07 2.029393e+07 1.487691e+07 2.457599e+07 2.220086e+07 4.021711e+07 2.513613e+07 1.909853e+07 3.172251e+07 2.246784e+07 6.272872e+04 2.361128e+07 2.702412e+07 2.288654e+07 3.157780e+07 2.884208e+07 2.685974e+07 2.350019e+07 2.680392e+07 1.997661e+07 3.484124e+07 2.149471e+07 2.437212e+07 2.897024e+07 2.367289e+07 2.484245e+07 1.983092e+07 2.513025e+07 3.310445e+07 2.035563e+07 3.830541e+07 2.358492e+07 1.906146e+07 2.520409e+07 3.274243e+07 3.148799e+07 2.876241e+07 3.494833e+07 2.884543e+07 3.128988e+07 2.143226e+07 1.751658e+07 2.944312e+07 1.702099e+07 2.036188e+07 2.129708e+07 2.269654e+07 2.229424e+07 2.217258e+07 2.013912e+07 2.933369e+07 2.446981e+07 2.487080e+07 3.578130e+07 2.971734e+07 2.165561e+07 2.433162e+07 2.364102e+07 2.439815e+07 1.886705e+07 3.952539e+07 2.426632e+07 2.379379e+07 2.753147e+07 3.254210e+07 2.783638e+07 2.480172e+07 2.395384e+07 1.465620e+07 2.694965e+07 3.428938e+07 3.239352e+07 2.679222e+07 2.112269e+07 2.355401e+07 2.387200e+07 2.517595e+07 2.156257e+07 2.594228e+07 3.022353e+07 3.124386e+07 3.392781e+07 2.349504e+07 5.132879e+07 3.070491e+07 2.838954e+07 3.150482e+07 3.353077e+07 3.848138e+07 2.815849e+07 2.298973e+07 2.782588e+07 2.300100e+07 3.687685e+07 2.498687e+07 2.704025e+07 1.253554e+07 3.604112e+07 3.692968e+07 3.039809e+07 2.756742e+07 1.796110e+07 2.491442e+07 2.693417e+07 2.899526e+07 2.329267e+07 2.332916e+07 3.002583e+07 2.863219e+07 3.466163e+07 2.340948e+07 3.406993e+07 2.838528e+07 3.355212e+07 2.645775e+07 3.764768e+07 2.246317e+07 2.136370e+07 3.110199e+07 2.913701e+07 3.263368e+07 3.468216e+07 3.110004e+07 3.376022e+07 4.401000e+07 3.301276e+07 2.977807e+07 2.422553e+07 2.587870e+07 3.071558e+07 1.996791e+07 2.744069e+07 2.998367e+07 3.313551e+07 2.385355e+07 3.111492e+07 2.254513e+07 1.984399e+07 2.229365e+07 2.287146e+07 2.828943e+07 SORBATE 1.261172e+05 6.944526e+06 7.112641e+06 6.253058e+06 1.462847e+05 7.194947e+06 4.272957e+06 1.005745e+07 150747.57 7.706578e+06 4.892168e+06 7.869988e+06 139445.76 7.855689e+06 5.849597e+06 8.226877e+06 1.938239e+05 3.371436e+06 7.000957e+06 6.910463e+06 2.630418e+05 7.785743e+06 7.078081e+06 7.802953e+06 113543.985 6.455661e+06 7.362399e+06 8.853145e+06 1.250138e+05 3.187601e+06 8.696327e+06 2.987725e+06 175311.07 6.447139e+06 1.012076e+07 8.008273e+06 2.433581e+05 5.681913e+06 5.139460e+06 8.596383e+06 1.908386e+05 6.871149e+06 5.236966e+06 9.949271e+06 2.341182e+05 4.037140e+06 1.021562e+07 4.345776e+06 6.378832e+06 8.513190e+06 1.657488e+06 1.028963e+07 8.208269e+06 4.237382e+06 5.245319e+06 4.521277e+06 8.435031e+06 8.401327e+06 1.048124e+07 5.087496e+06 1.156768e+07 4.186532e+06 4.671834e+06 6.701726e+06 5.441419e+06 8.067874e+06 9.464975e+06 8.257514e+06 7.050813e+06 8.709814e+06 7.845352e+06 4.782171e+06 1.532247e+07 1.011778e+07 7.366588e+06 4.577529e+06 3.740990e+06 4.958059e+06 3.400798e+05 9.569762e+06 6.374065e+06 9.221593e+06 5.529558e+06 8.431983e+06 5.512864e+06 8.220767e+06 3.625970e+06 4.094375e+06 7.685728e+06 6.954189e+06 3.582012e+06 6.317634e+06 9.614230e+06 4.656660e+06 6.488229e+06 9.226546e+06 1.246834e+07 6.054823e+06 9.530427e+06 7.773189e+06 7.893277e+06 2.040524e+06 4.847487e+06 1.023442e+07 4.944828e+06 1.085634e+07 5.323100e+06 1.148571e+07 2.518013e+06 7.087770e+06 7.840469e+06 1.332310e+07 1.089095e+07 6.772462e+06 9.466181e+06 3.285366e+06 7.993955e+06 7.998806e+06 7.046186e+06 6.111659e+06 5.011876e+06 2.469288e+06 4.225742e+06 4.589402e+06 4.222580e+06 6.047810e+06 9.697087e+06 4.047688e+06 4.890565e+06 6.010618e+06 6.946232e+06 1.699256e+05 4.865310e+06 2.128574e+06 7.829462e+06 8.213741e+06 1.005255e+07 9.089723e+06 5.603853e+06 6.732323e+06 5.033435e+06 1.034021e+07 1.163255e+07 3.247768e+06 7.513110e+06 8.999800e+06 3.992012e+06 7.549557e+06 9.601531e+06 1.207102e+07 8.798791e+06 1.234742e+07 3.801665e+06 8.936765e+06 7.001217e+06 8.989803e+06 1.229763e+07 1.473524e+07 1.550089e+07 1.009871e+07 9.668051e+06 1.419523e+07 6.756577e+06 8.118299e+06 8.270955e+06 3.730396e+06 5.994418e+06 2.657909e+06 5.876329e+06 7.008458e+06 4.224701e+06 5.625063e+06 6.189475e+06 5.590487e+06 5.226588e+06 8.061831e+06 4.079390e+06 1.016238e+07 1.024489e+07 9.986534e+06 1.402617e+07 2.895879e+06 5.452653e+06 1.302413e+07 5.010996e+06 6.752886e+06 3.315607e+06 5.986080e+06 2.123324e+06 2.697538e+06 1.642688e+07 8.002520e+06 6.860606e+06 4.845358e+06 7.199324e+06 6.764693e+06 9.481596e+06 1.495512e+07 2.360153e+06 7.926813e+06 1.356716e+07 1.257490e+07 6.377773e+06 6.556577e+06 7.287780e+06 3.300543e+06 8.816377e+06 4.460506e+06 7.385393e+06 6.828423e+06 5.984557e+06 2.260865e+06 2.523383e+06 7.493435e+06 3.492312e+06 3.730083e+06 1.518145e+07 4.538398e+06 8.172144e+06 7.354916e+06 7.385042e+06 3.642677e+06 5.941168e+06 5.870634e+06 3.633095e+06 8.472412e+06 4.379931e+06 1.082986e+07 7.632311e+06 6.658228e+06 4.101679e+06 7.587153e+06 8.392185e+06 6.864909e+06 3.554692e+06 7.239391e+06 6.552124e+06 7.932437e+06 3.785516e+06 5.930582e+06 7.927124e+06 5.627745e+06 6.843129e+06 4.552512e+06 6.422050e+06 4.070733e+06 4.780893e+06 8.307703e+06 6.078610e+06 5.272282e+06 3.493881e+06 9.557177e+06 6.865735e+06 6.529991e+06 1.205428e+07 4.878451e+06 3.772944e+06 8.892546e+06 6.081059e+06 7.265917e+06 1.905402e+06 8.153142e+06 521.17881_1.745 5.436476e+04 9.878946e+05 1.170579e+06 1.179147e+06 4.043184e+04 1.160887e+06 1.241353e+06 1.285504e+06 50502.17 1.103169e+06 1.109118e+06 1.445585e+06 42135.65 1.231245e+06 1.010520e+06 1.301409e+06 3.591397e+04 1.065732e+06 1.115427e+06 1.109275e+06 1.004632e+05 1.094680e+06 1.214020e+06 1.112737e+06 48112.924 1.006685e+06 1.731404e+06 1.221401e+06 3.746094e+04 1.016007e+06 9.892615e+05 1.193134e+06 56879.55 9.995199e+05 1.329810e+06 1.206480e+06 6.730208e+04 9.714088e+05 1.286545e+06 1.189382e+06 5.969803e+04 1.235653e+06 1.213665e+06 1.390990e+06 9.534247e+04 9.223294e+05 1.180410e+06 1.140962e+06 1.082431e+06 1.059174e+06 6.631922e+05 8.531468e+05 1.043481e+06 1.399645e+06 1.144823e+06 8.814450e+05 1.550757e+06 1.392334e+06 6.974108e+05 8.917361e+05 8.344437e+05 9.762883e+05 1.188353e+06 1.293949e+06 1.607180e+06 1.592251e+06 2.128226e+06 1.054702e+06 1.926579e+06 1.137546e+06 1.471786e+06 2.003091e+06 1.781363e+06 1.350627e+06 8.644141e+05 8.315718e+05 1.515216e+06 1.088029e+06 5.050988e+04 1.559445e+06 1.444894e+06 1.086370e+06 1.039713e+06 1.867879e+06 1.320920e+06 1.709391e+06 9.986535e+05 1.274526e+06 1.608404e+06 1.296232e+06 1.255344e+06 1.358049e+06 8.539655e+05 1.134188e+06 1.535137e+06 9.714369e+05 1.506320e+06 1.538665e+06 1.201186e+06 9.157136e+05 1.149117e+06 6.452606e+05 1.482581e+06 1.307871e+06 1.440959e+06 7.833535e+05 1.045418e+06 8.343224e+05 1.029140e+06 7.974199e+05 1.049967e+06 1.152374e+06 1.120945e+06 1.514210e+06 1.463984e+06 1.262364e+06 1.490739e+06 1.693417e+06 8.068093e+05 1.583230e+06 9.760196e+05 7.392233e+05 1.477970e+06 7.868188e+05 1.404685e+06 1.141955e+06 1.223833e+06 1.882201e+06 9.697492e+05 9.946425e+05 8.251210e+05 6.594885e+04 1.553965e+06 8.153910e+05 1.627354e+06 1.524255e+06 1.882795e+06 1.204634e+06 1.168421e+06 1.077736e+06 1.427811e+06 1.372216e+06 1.205691e+06 1.019880e+06 1.496555e+06 1.189636e+06 1.492188e+06 9.738405e+05 1.174638e+06 1.234296e+06 1.364518e+06 1.424765e+06 9.740655e+05 1.005545e+06 1.128329e+06 1.169948e+06 1.320709e+06 1.724947e+06 1.621764e+06 9.734850e+05 1.478769e+06 1.038053e+06 9.902742e+05 1.688577e+06 8.270238e+05 8.037599e+05 8.570725e+05 1.300152e+06 1.344812e+06 9.975705e+05 1.320340e+06 1.537842e+06 1.253271e+06 1.271257e+06 2.209468e+06 1.056578e+06 9.345269e+05 1.368990e+06 1.242661e+06 1.249097e+06 1.161024e+06 2.134321e+06 1.240443e+06 1.341133e+06 1.122205e+06 1.238476e+06 1.392557e+06 1.595581e+06 9.376743e+05 9.772902e+05 1.234286e+06 1.323619e+06 1.890554e+06 1.527999e+06 9.870877e+05 1.403521e+06 1.622262e+06 7.134181e+05 9.929704e+05 1.381931e+06 1.182349e+06 1.147256e+06 1.510264e+06 1.313816e+06 1.963200e+06 1.146771e+06 9.300036e+05 1.108489e+06 1.261245e+06 1.646433e+06 1.208506e+06 1.050980e+06 1.394794e+06 8.488563e+05 2.826975e+06 1.609013e+06 1.373980e+06 1.195995e+06 1.617616e+06 1.590588e+06 1.315770e+06 1.013028e+06 6.463838e+05 1.565402e+06 1.138597e+06 1.653974e+06 1.368201e+06 1.623263e+06 1.664007e+06 1.076878e+06 1.535734e+06 1.451653e+06 1.482324e+06 1.929996e+06 1.207180e+06 6.120417e+05 1.533955e+06 1.932569e+06 1.255625e+06 1.518328e+06 1.232713e+06 1.424430e+06 1.580199e+06 1.294896e+06 1.737304e+06 2.283926e+06 2.385206e+06 1.509895e+06 1.371040e+06 1.151040e+06 1.181140e+06 7.046968e+05 1.559173e+06 1.250440e+06 1.372332e+06 8.983430e+05 1.460309e+06 1.153085e+06 1.217195e+06 1.047422e+06 8.560216e+05 1.761889e+06 C30 H64 N5 O2 P3_1.745 7.263925e+04 5.330125e+05 6.447586e+05 5.897141e+05 5.634003e+04 6.378509e+05 4.171439e+05 8.590135e+05 80628.59 5.456353e+05 6.004687e+05 6.779220e+05 72446.03 6.032821e+05 5.897385e+05 6.309478e+05 5.934881e+04 4.632816e+05 5.237982e+05 6.214696e+05 1.323389e+05 4.918103e+05 6.973280e+05 7.988858e+05 52015.620 5.135309e+05 6.160169e+05 5.298214e+05 4.676874e+04 6.522972e+05 6.059893e+05 5.538072e+05 71352.20 4.490154e+05 7.560914e+05 5.766315e+05 8.376828e+04 5.996916e+05 6.309853e+05 5.819670e+05 7.929210e+04 7.571961e+05 4.053494e+05 6.960217e+05 1.167429e+05 4.581058e+05 6.930487e+05 1.565532e+05 1.894460e+05 1.288613e+05 1.622947e+05 1.721449e+05 1.325444e+05 1.374898e+05 1.706302e+05 1.785361e+05 1.405881e+05 1.594544e+05 1.603526e+05 1.376810e+05 1.686659e+05 1.869022e+05 1.651150e+05 1.629851e+05 1.842360e+05 1.444415e+05 1.641671e+05 1.562623e+05 1.475601e+05 1.435401e+05 1.873429e+05 1.609743e+05 1.889050e+05 1.682086e+05 1.299707e+05 1.125588e+05 1.545451e+05 1.688300e+05 8.628015e+04 1.728540e+05 1.234570e+05 1.955049e+06 1.150196e+05 1.549313e+05 1.189786e+05 1.608129e+05 1.361074e+05 1.165245e+05 1.254874e+05 1.234031e+05 1.477864e+05 1.261044e+05 1.306854e+05 1.112184e+05 2.096288e+05 1.506406e+05 1.909120e+05 1.363241e+05 1.333506e+05 1.370477e+05 1.320937e+05 1.115500e+05 1.044575e+05 1.297071e+05 1.374549e+05 1.578453e+05 1.350321e+05 2.890797e+06 8.940816e+04 1.152259e+05 1.198168e+05 1.386403e+05 1.372925e+05 1.344989e+05 1.584606e+05 1.225693e+05 1.340826e+05 1.510780e+05 1.112536e+05 1.497043e+05 1.533740e+05 1.169728e+05 1.277434e+05 1.062873e+05 1.436984e+05 1.392015e+05 1.689134e+05 1.545307e+05 1.122583e+05 1.284856e+05 1.069493e+05 7.453131e+04 1.565449e+05 1.330405e+05 1.212722e+05 1.681204e+05 1.553125e+05 1.341840e+05 1.075767e+05 1.223016e+05 1.509278e+05 1.520880e+05 1.679276e+05 1.017895e+05 1.355626e+05 1.414540e+05 1.517162e+05 1.250434e+05 1.529394e+05 1.659930e+05 1.442034e+05 1.522716e+05 1.227321e+05 1.204821e+05 1.449047e+05 1.364666e+05 1.898563e+05 1.844288e+05 1.784990e+05 1.297428e+05 1.527003e+05 1.409539e+05 1.543254e+05 1.568425e+05 1.393496e+05 1.282446e+05 1.367116e+05 1.525942e+05 1.552569e+05 1.353456e+05 1.624004e+05 1.961323e+05 1.353909e+05 1.157229e+05 1.692508e+05 1.221075e+05 1.457348e+05 1.719745e+05 1.731291e+05 1.635815e+05 2.437835e+05 1.645129e+05 1.528240e+05 1.796974e+05 3.340446e+05 1.748169e+05 1.385409e+05 2.687797e+06 2.054724e+05 1.565417e+05 1.689624e+05 1.670553e+06 1.517347e+05 3.547206e+05 2.211620e+05 1.476259e+05 2.822798e+05 1.836043e+05 1.188790e+05 2.414308e+05 2.071808e+05 2.453679e+05 1.840227e+05 1.302479e+05 1.803924e+05 1.478880e+05 1.263278e+05 1.400051e+08 1.776010e+05 1.857273e+05 2.986719e+06 1.181990e+05 1.103329e+05 1.512301e+05 2.271776e+05 1.870234e+05 2.554455e+05 1.608997e+05 2.258811e+05 1.493735e+05 1.628390e+05 1.301617e+05 2.109301e+05 1.345009e+06 4.643985e+05 7.199692e+05 1.067182e+06 3.744761e+06 2.340348e+06 1.480482e+05 8.434118e+06 1.977057e+05 1.867660e+05 1.640644e+05 1.495709e+05 3.059610e+05 1.035483e+06 7.210967e+05 1.423862e+05 1.552193e+05 1.481327e+05 2.513575e+05 1.164827e+06 1.735474e+05 1.691523e+05 1.962225e+05 1.533421e+05 1.562122e+05 1.386664e+05 1.937804e+05 1.538582e+05 1.304105e+05 1.647399e+05 1.321400e+05 2.081942e+05 1.256937e+05 1.320256e+05 1.200387e+05 1.264014e+05 1.632890e+05 1.590920e+05 1.921071e+05 516.1859_1.745 2.003245e+05 4.260684e+07 3.908230e+07 3.787520e+07 1.382560e+05 3.251049e+07 3.750500e+07 4.007663e+07 126893.80 2.863442e+07 2.772562e+07 4.882701e+07 79864.57 4.714271e+07 4.000649e+07 4.535998e+07 5.647249e+04 2.166685e+07 2.358026e+07 3.516497e+07 1.260351e+05 5.834300e+07 3.523123e+07 4.250602e+07 58357.002 1.891538e+07 5.340986e+07 5.327364e+07 4.729684e+04 1.650171e+07 3.238800e+07 3.758022e+07 57709.65 3.817204e+07 3.415718e+07 3.265651e+07 5.336633e+04 5.053087e+07 3.581121e+07 3.979484e+07 5.700671e+04 5.268760e+07 2.342657e+07 2.160257e+07 1.212395e+05 2.975655e+07 6.270604e+07 3.087261e+07 3.769795e+07 3.733199e+07 1.168157e+07 1.372009e+07 2.845674e+07 3.675257e+07 5.201864e+07 2.963582e+07 3.860626e+07 4.154151e+07 2.902741e+07 3.556443e+07 2.184958e+07 1.602774e+07 4.436123e+07 3.770789e+07 3.018704e+07 4.200018e+07 3.804896e+07 3.526395e+07 4.582411e+07 3.705337e+07 4.000363e+07 4.143864e+07 6.148540e+07 4.811708e+07 4.028147e+07 4.415759e+07 3.870507e+07 4.752399e+07 2.588542e+05 3.956631e+07 3.229695e+07 3.805612e+07 3.030602e+07 4.482011e+07 3.517020e+07 5.226611e+07 2.358735e+07 4.067993e+07 5.396562e+07 3.773054e+07 4.616228e+07 5.385597e+07 3.827043e+07 2.669061e+07 3.466247e+07 3.801283e+07 3.960671e+07 3.694406e+07 3.961677e+07 2.322141e+07 4.241869e+07 3.257025e+07 4.491485e+07 3.125737e+07 2.368670e+07 4.460643e+07 3.265088e+07 3.533057e+07 3.346268e+07 1.706730e+07 2.884399e+07 4.093504e+07 3.646173e+07 2.117969e+07 5.722407e+07 4.194978e+07 4.737409e+07 4.163843e+07 1.403786e+07 3.809638e+07 2.945129e+07 1.197252e+07 2.658771e+07 1.392225e+07 4.082675e+07 3.296885e+07 4.319905e+07 3.729238e+07 3.684688e+07 2.188463e+07 4.104740e+07 5.235071e+04 3.082132e+07 4.723027e+07 4.781221e+07 4.599456e+07 5.235745e+07 4.490668e+07 3.507833e+07 3.867261e+07 2.227242e+07 5.180555e+07 4.575705e+07 4.005275e+07 4.478913e+07 3.366456e+07 2.504722e+07 2.504130e+07 2.424890e+07 3.965299e+07 4.039388e+07 5.921594e+07 3.492663e+07 2.045074e+07 4.384121e+07 3.532303e+07 3.729382e+07 7.446209e+07 6.487042e+07 1.968193e+07 3.759209e+07 2.725814e+07 2.709589e+07 6.043579e+07 2.378704e+07 3.599255e+07 2.971001e+07 2.388791e+07 3.205197e+07 2.455917e+07 2.767235e+07 4.439489e+07 3.146713e+07 3.971547e+07 5.605687e+07 2.696373e+07 2.476348e+07 3.357812e+07 4.276494e+07 4.302565e+07 2.603665e+07 4.453138e+07 3.420776e+07 2.703370e+07 4.065341e+07 4.005272e+07 3.082866e+07 2.837899e+07 2.360860e+07 2.609082e+07 3.908588e+07 3.219356e+07 3.943983e+07 3.451895e+07 2.306004e+07 4.790662e+07 4.113494e+07 3.900045e+07 4.008320e+07 4.927730e+07 2.920208e+07 4.389285e+07 3.273621e+07 4.281068e+07 6.025997e+07 4.919713e+07 3.888039e+07 4.211356e+07 5.314159e+07 5.283855e+07 3.892317e+07 2.834575e+07 4.300955e+07 4.574976e+07 8.422200e+07 3.458461e+07 3.856371e+07 2.134901e+07 4.209251e+07 5.618060e+07 3.025205e+07 2.421267e+07 2.500939e+07 4.974219e+07 4.577326e+07 6.590290e+07 2.497806e+07 5.362038e+07 4.737041e+07 3.801901e+07 5.258174e+07 3.297232e+07 4.419938e+07 3.349601e+07 4.359006e+07 3.359274e+07 4.637947e+07 3.332446e+07 5.609783e+07 4.565462e+07 4.145807e+07 3.600823e+07 5.006186e+07 4.867464e+07 5.477391e+07 4.258022e+07 5.859610e+07 2.098639e+07 4.212252e+07 3.535455e+07 2.414158e+07 3.392923e+07 5.380083e+07 3.499748e+07 4.793821e+07 2.063532e+07 3.884357e+07 3.031166e+07 3.170458e+07 3.001628e+07 3.705318e+07 4.270131e+07 "4-Hydroxy-2,6,6-trimethyl-3-oxo-1,4-cyclohexadiene-1-carbaldehyde_1.745" 1.057346e+06 6.250510e+06 3.761677e+06 5.856874e+06 1.265618e+05 5.452992e+06 5.333194e+06 6.874744e+06 178218.86 5.212485e+06 5.863476e+06 5.374871e+06 156203.12 5.169915e+06 5.076188e+06 5.679715e+06 1.164568e+05 5.711807e+06 5.013780e+06 6.054228e+06 2.842424e+05 5.511816e+06 4.839666e+06 6.397902e+06 127256.961 4.733268e+06 6.112958e+06 5.731256e+06 1.157993e+05 4.905077e+06 5.909726e+06 6.270831e+06 166919.83 4.275618e+06 6.025654e+06 5.617766e+06 2.161274e+05 4.693820e+06 5.394229e+06 5.880427e+06 1.896706e+05 5.049492e+06 6.260132e+06 7.276522e+06 2.600329e+05 2.673434e+06 7.078712e+06 4.763101e+06 2.896144e+06 4.803123e+06 1.554546e+06 5.808525e+06 3.717721e+06 4.058349e+06 3.238957e+06 4.538655e+06 4.673478e+06 5.197338e+06 3.774955e+06 5.004875e+06 6.367551e+06 3.785477e+06 5.260198e+06 4.735839e+06 6.567419e+06 5.392442e+06 7.088014e+06 6.043245e+06 5.412202e+06 4.953450e+06 6.724185e+06 6.515499e+06 6.561466e+06 6.711762e+06 4.006177e+06 4.539405e+06 4.832882e+06 3.884820e+06 3.755073e+05 6.290005e+06 5.704998e+06 5.515396e+06 4.974909e+06 5.536489e+06 4.015106e+06 3.700540e+06 3.217679e+06 3.421404e+06 5.072396e+06 5.187435e+06 8.410898e+06 5.938213e+06 6.383000e+06 5.227780e+06 4.899982e+06 5.861084e+06 9.450939e+06 4.332836e+06 6.298762e+06 5.560742e+06 5.599992e+06 5.337348e+06 3.117788e+06 6.346173e+06 7.920765e+06 7.207855e+06 5.920891e+06 5.349235e+06 3.354741e+06 4.292489e+06 4.957490e+06 9.307092e+06 7.414794e+06 4.709171e+06 7.177240e+06 4.760634e+06 6.962699e+06 6.859736e+06 4.244251e+06 6.948257e+06 3.894677e+06 3.185815e+06 3.578742e+06 4.210247e+06 5.015042e+06 5.265080e+06 7.651191e+06 2.554479e+06 5.116851e+06 5.643113e+06 5.005080e+06 2.658355e+05 5.786036e+06 6.016153e+06 5.690316e+06 5.619140e+06 8.053545e+06 7.269653e+06 4.836056e+06 6.759633e+06 1.704615e+06 8.179828e+06 8.193011e+06 3.922905e+06 5.310999e+06 6.000731e+06 2.906173e+06 5.424390e+06 5.873372e+06 8.582417e+06 6.353596e+06 6.157130e+06 3.755916e+06 6.592470e+06 6.260124e+06 7.710074e+06 1.057940e+07 1.228705e+07 1.442361e+07 8.079744e+06 7.523455e+06 1.038317e+07 5.024596e+06 5.604034e+06 5.864111e+06 5.223841e+06 4.541026e+06 4.945461e+06 4.396635e+06 4.438701e+06 5.040376e+06 4.631459e+06 4.348793e+06 3.963772e+06 6.417365e+06 5.628556e+06 5.611924e+06 3.997944e+06 6.739891e+06 5.610930e+06 9.019581e+06 4.544797e+06 4.642608e+06 8.387979e+06 4.817326e+06 5.672596e+06 4.805589e+06 2.585883e+06 8.761298e+06 4.090547e+06 9.024895e+06 6.290685e+06 3.858523e+06 6.759079e+06 8.289963e+06 4.873048e+06 1.079731e+07 1.046686e+07 4.449976e+06 1.086288e+07 9.508925e+06 8.375986e+06 5.840032e+06 4.804779e+06 6.400721e+06 3.854288e+06 6.041397e+06 3.745673e+06 7.334476e+06 6.635795e+06 5.073248e+06 4.717022e+06 4.782773e+06 5.305101e+06 7.587760e+06 5.553214e+06 5.759291e+06 6.597399e+06 6.447981e+06 6.969609e+06 7.644352e+06 4.787641e+06 4.135293e+06 7.247828e+06 7.088002e+06 1.009586e+07 6.136277e+06 7.528153e+06 6.574477e+06 5.394694e+06 5.923643e+06 5.510038e+06 6.131585e+06 5.116109e+06 4.869617e+06 3.238141e+06 6.084469e+06 4.563776e+06 5.113928e+06 3.145565e+06 6.907146e+06 4.658500e+06 5.203657e+06 6.055154e+06 4.837519e+06 5.411156e+06 6.705015e+06 5.262877e+06 4.798055e+06 6.904426e+06 5.412228e+06 7.398924e+06 5.840630e+06 5.120847e+06 9.275267e+06 3.329817e+06 4.745405e+06 8.017102e+06 3.806011e+06 3.727799e+06 5.391172e+06 5.391194e+06 71.06133_1.745 8.434988e+05 6.083101e+06 3.585161e+06 5.666623e+06 5.776489e+04 5.293863e+06 5.137714e+06 6.676486e+06 81028.50 5.069079e+06 5.708984e+06 5.218533e+06 71356.95 5.025542e+06 4.844604e+06 5.519637e+06 5.345918e+04 5.448172e+06 4.892126e+06 5.916793e+06 1.297880e+05 5.302089e+06 4.690466e+06 6.213786e+06 57902.825 4.570833e+06 5.927488e+06 5.553902e+06 5.273882e+04 4.731130e+06 5.731684e+06 6.092493e+06 76249.16 4.108381e+06 5.855130e+06 5.421727e+06 9.910980e+04 4.545093e+06 5.223373e+06 5.715435e+06 8.717469e+04 4.879381e+06 6.104304e+06 7.008482e+06 1.195282e+05 2.517145e+06 6.937189e+06 4.593938e+06 2.709752e+06 4.685226e+06 6.235477e+05 5.640694e+06 3.569542e+06 3.903503e+06 2.988030e+06 4.344750e+06 4.515273e+06 5.013882e+06 3.536955e+06 4.882764e+06 6.179648e+06 3.604684e+06 5.126356e+06 4.557950e+06 6.384358e+06 5.266261e+06 6.941152e+06 5.812644e+06 5.284077e+06 4.769709e+06 6.504649e+06 6.322089e+06 6.353634e+06 6.512303e+06 3.844380e+06 4.397912e+06 4.694162e+06 3.651436e+06 2.549887e+05 6.116516e+06 5.552447e+06 5.384412e+06 4.858224e+06 5.418817e+06 3.900991e+06 3.554671e+06 3.088093e+06 3.316490e+06 4.928724e+06 5.030399e+06 8.245911e+06 5.782432e+06 6.175681e+06 5.093734e+06 3.407203e+06 5.742770e+06 9.287307e+06 4.210892e+06 6.197378e+06 5.445750e+06 5.503176e+06 5.203513e+06 2.984751e+06 6.149752e+06 7.780038e+06 7.027863e+06 5.773879e+06 5.207161e+06 3.241752e+06 4.162559e+06 4.821696e+06 9.118929e+06 7.154275e+06 4.493725e+06 6.893071e+06 4.620303e+06 6.784925e+06 6.653544e+06 4.120638e+06 6.708319e+06 3.744176e+06 3.081046e+06 3.299356e+06 4.084666e+06 4.896907e+06 5.121927e+06 7.350158e+06 2.381627e+06 4.853843e+06 5.505847e+06 4.819235e+06 1.833296e+05 5.647167e+06 5.812667e+06 5.542397e+06 5.473542e+06 7.872281e+06 7.070107e+06 4.694782e+06 6.476962e+06 1.490944e+06 7.978693e+06 8.061009e+06 3.791999e+06 5.122650e+06 5.841594e+06 2.758073e+06 5.236124e+06 5.697684e+06 8.410044e+06 6.216810e+06 5.960017e+06 3.614862e+06 6.464250e+06 6.138419e+06 7.538503e+06 1.037991e+07 1.204535e+07 1.418253e+07 7.964907e+06 7.215941e+06 1.024539e+07 4.905243e+06 5.438008e+06 5.714400e+06 4.952839e+06 4.395865e+06 4.817909e+06 4.249979e+06 4.292624e+06 4.853945e+06 4.232112e+06 4.210128e+06 3.815029e+06 6.251226e+06 5.487763e+06 5.450405e+06 3.809689e+06 6.610227e+06 5.481947e+06 8.818240e+06 4.377763e+06 4.521895e+06 8.167009e+06 4.677683e+06 5.478049e+06 4.643063e+06 2.424997e+06 8.509266e+06 3.942628e+06 8.800700e+06 6.112178e+06 3.692098e+06 6.591239e+06 8.074632e+06 4.700161e+06 1.057355e+07 1.018507e+07 4.310506e+06 1.068285e+07 9.281163e+06 8.103155e+06 5.638796e+06 4.660945e+06 6.198480e+06 3.728361e+06 5.878819e+06 3.603526e+06 7.117046e+06 6.429967e+06 4.589442e+06 4.564440e+06 4.637803e+06 4.955576e+06 7.408970e+06 5.321382e+06 5.517876e+06 6.396973e+06 6.265427e+06 6.711377e+06 5.869183e+06 4.642458e+06 4.005500e+06 7.093962e+06 6.884985e+06 9.821593e+06 5.950965e+06 7.364894e+06 6.436031e+06 5.224946e+06 5.743446e+06 5.338178e+06 5.924698e+06 4.962459e+06 4.685983e+06 3.069648e+06 5.896678e+06 4.402536e+06 4.945111e+06 2.922045e+06 6.715946e+06 4.471175e+06 4.999895e+06 5.836787e+06 4.680371e+06 5.218081e+06 6.431203e+06 5.089689e+06 4.655545e+06 6.747509e+06 5.211891e+06 7.247718e+06 5.645640e+06 4.921572e+06 8.959973e+06 3.228274e+06 4.589429e+06 7.915709e+06 3.706720e+06 3.546761e+06 5.162488e+06 5.156547e+06 wine lactone_1.745 6.919274e+04 4.718009e+06 4.004191e+06 4.084854e+06 5.372606e+04 4.197559e+06 4.131060e+06 5.511301e+06 78140.29 3.960529e+06 4.705570e+06 4.307401e+06 69470.74 4.037807e+06 4.237609e+06 4.875291e+06 5.499841e+04 4.421822e+06 4.726914e+06 2.189372e+06 1.447190e+05 4.604353e+06 4.486550e+06 5.949927e+06 60900.936 3.880790e+06 4.134769e+06 4.774052e+06 5.811346e+04 3.813313e+06 5.188163e+06 6.476577e+06 98374.06 2.128116e+06 2.929029e+06 3.226902e+06 1.557779e+05 5.275973e+06 6.389922e+06 2.962283e+06 1.124801e+05 2.624060e+06 5.781747e+06 7.280883e+06 1.384015e+05 1.175506e+06 6.851384e+06 2.497520e+06 4.440115e+06 4.994776e+06 1.704269e+06 1.024237e+07 6.816114e+06 6.126796e+06 5.475312e+06 6.407783e+06 7.118782e+06 7.320682e+06 9.536216e+06 4.793689e+06 7.824108e+06 3.727923e+06 5.771873e+06 5.027339e+06 9.715290e+06 1.970722e+06 4.109127e+06 8.239962e+06 5.891427e+06 5.404243e+06 8.450620e+06 7.516093e+06 1.052335e+07 8.300621e+06 4.060431e+06 2.852196e+06 1.688830e+06 1.847229e+06 2.062763e+06 7.024351e+06 3.912205e+06 5.351708e+06 4.786925e+06 4.366354e+06 3.940140e+06 2.920074e+06 9.658088e+05 2.192866e+06 3.725591e+06 3.984297e+06 5.307998e+06 4.529000e+06 4.339488e+06 2.715492e+06 2.658067e+06 3.596671e+06 2.162269e+06 1.825282e+06 4.641920e+06 3.241025e+06 3.582087e+06 3.867309e+06 1.007191e+06 5.963036e+06 1.884751e+06 3.990229e+06 2.009677e+06 1.262127e+06 2.236987e+06 3.091664e+06 1.756889e+06 4.849756e+06 3.889798e+06 3.969858e+06 1.751616e+06 2.738739e+06 4.316822e+06 4.810395e+06 3.513086e+06 3.238968e+06 1.188530e+06 2.851916e+06 1.086543e+06 1.161209e+06 1.616705e+06 1.538326e+06 4.114207e+06 1.632880e+06 1.183206e+06 3.264024e+06 2.915857e+06 2.258072e+05 1.812458e+06 1.303953e+06 3.136667e+06 3.510882e+06 4.687298e+06 1.817218e+06 1.223512e+06 3.849038e+06 1.594703e+06 3.882857e+06 4.113463e+06 2.306035e+06 1.086054e+06 1.328059e+06 1.960592e+06 1.110311e+06 3.452497e+06 6.408890e+06 1.278992e+06 4.169237e+06 1.283647e+06 4.736764e+06 3.682023e+06 1.609851e+06 2.863996e+06 5.696532e+06 2.166259e+06 3.573121e+06 1.727721e+06 6.330672e+06 4.987734e+06 5.200350e+06 7.822118e+06 3.809792e+06 5.085317e+06 5.299736e+06 2.350946e+06 6.331076e+06 4.317935e+06 4.480541e+06 6.386999e+06 3.860177e+06 6.345745e+06 5.400111e+06 8.575381e+06 4.890691e+06 7.784397e+06 6.877527e+06 8.924097e+06 3.425375e+06 4.105377e+06 1.487775e+06 5.234544e+06 8.023237e+06 4.479387e+06 4.315794e+06 4.129615e+06 3.239942e+06 1.718311e+06 4.537075e+06 6.286845e+06 3.864217e+06 1.290096e+07 4.298750e+06 6.359264e+06 5.134914e+06 1.670905e+06 1.576565e+06 1.225361e+06 1.794077e+06 4.127204e+06 4.596540e+06 3.463973e+06 4.643883e+06 5.968008e+06 4.899942e+06 7.175350e+06 6.491930e+06 6.946787e+06 4.975502e+06 2.222036e+06 5.999670e+06 9.530674e+06 6.544240e+06 1.557088e+06 5.229604e+06 7.283866e+06 6.372934e+06 5.945075e+06 4.269504e+06 3.721819e+06 3.964011e+06 3.320443e+06 9.922057e+06 6.617973e+06 1.085228e+07 6.008080e+06 5.327875e+06 6.019155e+06 8.115967e+06 5.279309e+06 5.835454e+06 5.278066e+06 2.806993e+06 2.030474e+06 2.249278e+06 4.878383e+06 4.322251e+06 5.542356e+06 4.633572e+06 4.857392e+06 4.933685e+06 3.629830e+06 6.257838e+06 5.448455e+06 5.342421e+06 4.079295e+06 6.274191e+06 5.130689e+06 1.955452e+06 4.962056e+06 4.363630e+06 7.205274e+06 3.079651e+06 3.669167e+06 6.769100e+06 3.536623e+06 7.125746e+06 2.240803e+06 4.297192e+06 "6-Hydroxy-5-methyl-4,11-dioxoundecanoic acid_1.745" 3.622619e+05 1.380897e+07 1.101813e+07 1.265754e+07 1.079890e+05 1.242425e+07 1.316345e+07 1.442766e+07 165174.75 1.204126e+07 1.203216e+07 1.336882e+07 142196.64 1.362094e+07 1.053894e+07 1.412745e+07 1.063412e+05 1.336300e+07 1.181651e+07 1.198667e+07 2.733721e+05 1.326381e+07 1.278470e+07 1.424775e+07 129997.311 1.125106e+07 1.380525e+07 1.322521e+07 1.218779e+05 1.089178e+07 1.225736e+07 1.613334e+07 163135.93 9.746179e+06 1.407776e+07 1.359537e+07 2.002677e+05 1.053770e+07 1.237337e+07 1.354294e+07 1.844699e+05 1.189005e+07 1.400804e+07 1.929950e+07 2.932631e+05 4.635380e+06 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3.521635e+05 5.302225e+05 5.072403e+05 C18 H27 N5 O4_1.746 5.442928e+04 2.558318e+07 3.854718e+07 3.632503e+07 4.514617e+04 3.318510e+07 2.101041e+07 2.726797e+07 84639.94 2.940896e+07 3.851938e+07 3.640791e+07 73135.35 3.518078e+07 2.695451e+07 3.873652e+07 6.000831e+04 2.353497e+07 3.168550e+07 3.109129e+07 1.579495e+05 3.088758e+07 2.659677e+07 3.126924e+07 65877.349 3.544380e+07 3.525289e+07 3.253978e+07 5.652295e+04 2.980604e+07 3.341327e+07 3.663772e+07 79451.80 1.951456e+07 3.621521e+07 3.315317e+07 9.591342e+04 2.764786e+07 3.383004e+07 3.081437e+07 8.320592e+04 2.776192e+07 3.309002e+07 4.417344e+07 1.149164e+05 2.100092e+07 3.703393e+07 2.668860e+07 2.703910e+07 2.985701e+07 6.608749e+06 4.564053e+07 2.898027e+07 2.649274e+07 3.056381e+07 2.961854e+07 2.854561e+07 3.157101e+07 2.978249e+07 2.711214e+07 3.849344e+07 2.267630e+07 2.721481e+07 2.883833e+07 4.172682e+07 3.101092e+07 3.453023e+07 2.367593e+07 2.197970e+07 2.616706e+07 6.806747e+07 3.295330e+07 3.222835e+07 4.642599e+07 1.949626e+07 2.458519e+07 1.981042e+07 4.322950e+07 9.285110e+04 3.665564e+07 3.243980e+07 3.983146e+07 1.919455e+07 2.900020e+07 2.258098e+07 3.391690e+07 1.497344e+07 8.971369e+06 2.599593e+07 2.326278e+07 2.041697e+07 3.553964e+07 2.099692e+07 2.400303e+07 2.336302e+07 2.143327e+07 4.000540e+07 2.162981e+07 3.581565e+07 1.796571e+07 2.385598e+07 2.513867e+07 1.748269e+07 2.418108e+07 2.531232e+07 2.975497e+07 1.208867e+07 2.738673e+07 7.832815e+06 2.654240e+07 2.142141e+07 3.304291e+07 2.936416e+07 3.362041e+07 5.716895e+07 1.943862e+07 3.722903e+07 3.334128e+07 1.858658e+07 2.297609e+07 1.772645e+07 6.222719e+06 1.397982e+07 1.799508e+07 1.316479e+07 1.907873e+07 4.032385e+07 2.029710e+07 1.155832e+07 2.745907e+07 2.234449e+07 8.552024e+04 2.697851e+07 2.400285e+07 3.121328e+07 2.957811e+07 2.677553e+07 3.209225e+07 2.070573e+07 2.577236e+07 1.278055e+07 2.720560e+07 3.602006e+07 1.782020e+07 3.315639e+07 3.526526e+07 1.033940e+07 2.564084e+07 2.135679e+07 3.534514e+07 3.084403e+07 3.129414e+07 1.891756e+07 2.506869e+07 2.581177e+07 3.377972e+07 2.523039e+07 4.697338e+07 4.186199e+07 2.880673e+07 2.543694e+07 2.981547e+07 2.938575e+07 3.289670e+07 2.581750e+07 2.165155e+07 2.193321e+07 2.646506e+07 2.377414e+07 1.673945e+07 2.992961e+07 2.379779e+07 1.916359e+07 1.993459e+07 2.979456e+07 3.341606e+07 1.542307e+07 3.355141e+07 3.442732e+07 3.455939e+07 8.930361e+07 1.569756e+07 3.187282e+07 8.027126e+07 3.582976e+07 2.973697e+07 3.341972e+07 2.002066e+07 9.471949e+07 1.326580e+07 7.340363e+07 4.298000e+07 2.365506e+07 4.207468e+07 2.804416e+07 2.240159e+07 1.017238e+08 7.587206e+07 2.200176e+07 9.007494e+07 8.014003e+07 7.908396e+07 2.929816e+07 2.570456e+07 4.389081e+07 3.403103e+07 2.862417e+07 1.873931e+07 3.212326e+07 3.873155e+07 2.829402e+07 2.282945e+07 2.553618e+07 3.547437e+07 4.076668e+07 4.435242e+07 6.852895e+07 3.756323e+07 5.160683e+07 3.109848e+07 3.759227e+07 2.115841e+07 2.602453e+07 3.943524e+07 4.738462e+07 6.289140e+07 2.812092e+07 4.620064e+07 4.073810e+07 3.574780e+07 3.400486e+07 2.970958e+07 4.040084e+07 4.284883e+07 2.374149e+07 3.799538e+07 4.471353e+07 3.109662e+07 3.103913e+07 3.245009e+07 3.511888e+07 4.276878e+07 4.269181e+07 3.304453e+07 4.278930e+07 4.877761e+07 4.406279e+07 4.313739e+07 3.140426e+07 3.130569e+07 4.963971e+07 2.417595e+07 5.881004e+07 1.826352e+07 7.836487e+07 2.620501e+07 2.872115e+07 1.996089e+07 1.460026e+07 2.564479e+07 4.023623e+07 3.737811e+07 C8 H13 N P2_1.746 9.138984e+04 1.157491e+06 1.153126e+06 9.069853e+05 7.092322e+04 1.136059e+06 9.830285e+05 1.188971e+06 101620.04 1.198894e+06 1.279761e+06 9.696793e+05 88030.54 1.095181e+06 1.129394e+06 1.163560e+06 6.494225e+04 8.947689e+05 1.046678e+06 1.149427e+06 1.499714e+05 1.156551e+06 1.153560e+06 9.781025e+05 70399.429 1.329739e+06 1.348133e+06 9.624412e+05 7.836930e+04 8.420480e+05 8.956569e+05 1.183977e+06 108172.31 1.102445e+06 1.132658e+06 1.494832e+06 1.152518e+05 7.689761e+05 1.135940e+06 7.267753e+05 9.632976e+04 1.516405e+06 1.176979e+06 1.159637e+06 1.356830e+05 9.602439e+05 1.022374e+06 1.175713e+06 1.780213e+06 1.129697e+06 6.356544e+05 9.467440e+05 1.241345e+06 1.277229e+06 1.224637e+06 6.649257e+05 1.585835e+06 1.017702e+06 9.722199e+05 9.818252e+05 1.587463e+06 1.327453e+06 1.096372e+06 9.788814e+05 1.366876e+06 9.256504e+05 1.053051e+06 1.228739e+06 1.068268e+06 9.199429e+05 1.091099e+06 1.159273e+06 1.566529e+06 1.042570e+06 9.920638e+05 8.130204e+05 1.037878e+06 1.063806e+06 1.551291e+05 1.520051e+06 1.101129e+06 9.107946e+05 1.329662e+06 1.158357e+06 8.315845e+05 1.351959e+06 1.254229e+06 1.184931e+06 1.120324e+06 1.058738e+06 1.075658e+06 1.014411e+06 1.299676e+06 8.705392e+05 1.202000e+06 1.001769e+06 1.192491e+06 1.041957e+06 6.845971e+05 1.251087e+06 1.098503e+06 8.146142e+05 1.025401e+06 9.792941e+05 1.186288e+06 2.357170e+06 1.128918e+06 7.609321e+05 1.075141e+06 1.199325e+06 9.770421e+05 1.362977e+06 1.256688e+06 1.166739e+06 1.418630e+06 1.219630e+06 1.373841e+06 1.541343e+06 8.175237e+05 1.844789e+06 1.095622e+06 1.057456e+06 1.345349e+06 9.590911e+05 1.191192e+06 9.148437e+05 1.172982e+06 1.396795e+06 1.203977e+06 1.091705e+06 1.853599e+06 1.043672e+05 1.134053e+06 8.340910e+05 1.365749e+06 1.180158e+06 1.060354e+06 8.614694e+05 1.127535e+06 1.332653e+06 1.213310e+06 1.060173e+06 1.235614e+06 9.847914e+05 1.199180e+06 1.227637e+06 1.316542e+06 9.122342e+05 1.139397e+06 1.145509e+06 9.864039e+05 9.377393e+05 9.918550e+05 1.231283e+06 1.052454e+06 1.496540e+06 1.180201e+06 9.300890e+05 8.358141e+05 1.034140e+06 1.110494e+06 8.854992e+05 1.035042e+06 1.367642e+06 1.260881e+06 1.047527e+06 1.193227e+06 1.132467e+06 1.153818e+06 1.195380e+06 1.404314e+06 1.069124e+06 1.209833e+06 1.077185e+06 1.045543e+06 1.302987e+06 1.077456e+06 1.119759e+06 1.064380e+06 1.440182e+06 1.033755e+06 1.736053e+06 1.012754e+06 1.120926e+06 9.067808e+05 1.155125e+06 1.115374e+06 1.125104e+06 9.771254e+05 1.060027e+06 1.224023e+06 1.086378e+06 1.322819e+06 1.694454e+06 8.774961e+05 1.214681e+06 9.702762e+05 7.360523e+05 1.105811e+06 8.331087e+05 9.602994e+05 6.233484e+05 1.302910e+06 1.142621e+06 1.206817e+06 9.305223e+05 1.074933e+06 1.258754e+06 7.184647e+05 1.026335e+06 1.488534e+06 1.120700e+06 1.073219e+06 1.142328e+06 1.483378e+06 1.070875e+06 1.018968e+06 1.013110e+06 1.140936e+06 8.622943e+05 1.085544e+06 7.405381e+05 6.918401e+05 1.170234e+06 7.002506e+05 1.197261e+06 1.346533e+06 8.273270e+05 1.015036e+06 9.280319e+05 9.978535e+05 1.303623e+06 9.842184e+05 1.179540e+06 1.368348e+06 1.074836e+06 1.373783e+06 1.268385e+06 1.362407e+06 1.348054e+06 8.062013e+05 1.126344e+06 1.120791e+06 1.358776e+06 8.399977e+05 1.334986e+06 1.240314e+06 9.873148e+05 1.049960e+06 1.198326e+06 1.285624e+06 1.035498e+06 1.387223e+06 8.613553e+05 1.212727e+06 1.030097e+06 1.115331e+06 1.592844e+06 1.192690e+06 1.044856e+06 8.937388e+05 9.984976e+05 C22 H41 N P2_1.746 3.319798e+04 2.353539e+05 2.631206e+05 1.805150e+05 2.654890e+04 3.620561e+05 2.190080e+05 3.038180e+05 44043.75 1.779213e+05 3.252606e+05 3.237597e+05 40700.27 2.196022e+05 1.620442e+05 3.258911e+05 2.651335e+04 2.198529e+05 3.134526e+05 2.748840e+05 9.791258e+04 1.683035e+05 3.022387e+05 2.743122e+05 49658.583 2.101172e+05 1.917767e+05 2.668923e+05 2.880373e+04 1.859013e+05 3.824445e+05 3.069949e+05 34498.73 8.406875e+04 1.978475e+05 2.146809e+05 5.029327e+04 2.834422e+05 2.177583e+05 2.944718e+05 4.759180e+04 2.013195e+05 1.057703e+05 3.102723e+05 6.563346e+04 8.774950e+04 3.221274e+05 1.737296e+05 1.936941e+05 2.903017e+05 3.293710e+05 2.276925e+05 2.522404e+05 1.257683e+05 2.386219e+05 3.437948e+05 2.758015e+05 1.157784e+05 3.030140e+05 1.879915e+05 1.659914e+05 3.080415e+05 1.329575e+05 2.351964e+05 1.526021e+05 2.527168e+05 2.276195e+05 9.207871e+04 9.722672e+04 1.687790e+05 9.718673e+04 1.500409e+05 1.051751e+05 2.069747e+05 2.928101e+05 1.588185e+05 2.612703e+05 3.675519e+05 1.123772e+05 2.357072e+05 1.612910e+05 3.006064e+05 1.233019e+05 2.028935e+05 8.513618e+04 1.490830e+05 2.425344e+05 7.445237e+04 1.322146e+05 2.333068e+05 1.162304e+05 1.802521e+05 4.085789e+05 6.155574e+04 1.588286e+05 1.747000e+05 1.515329e+05 3.326286e+05 1.916227e+05 1.983833e+05 1.234168e+05 1.083660e+05 3.279596e+05 9.782220e+04 2.299549e+05 1.343339e+05 1.331222e+05 9.032248e+04 7.523661e+04 2.599328e+05 2.390942e+05 2.624490e+05 1.171062e+05 5.320055e+05 4.727908e+05 1.855986e+05 5.065970e+05 3.923088e+05 1.951042e+05 2.690580e+05 1.297098e+05 1.811690e+05 1.676990e+05 3.693047e+05 1.653120e+05 2.758060e+05 3.872033e+05 2.009147e+05 1.881958e+05 1.128932e+05 2.284127e+05 4.741938e+04 1.691259e+05 3.200533e+05 1.914646e+05 3.037003e+05 2.081584e+05 2.283240e+05 1.855060e+05 3.249494e+05 9.508209e+04 4.944804e+05 1.495877e+05 1.323892e+05 1.729556e+05 1.243203e+05 1.079112e+05 7.036930e+04 8.488505e+04 1.950910e+05 1.250914e+05 2.199349e+05 1.702986e+05 2.448233e+05 1.765165e+05 2.356493e+05 3.809809e+05 1.845403e+05 8.529454e+05 2.306203e+05 2.570328e+05 1.676755e+05 3.473953e+05 3.884151e+05 1.706471e+05 8.633439e+04 2.295068e+05 1.931628e+05 1.798510e+05 2.168967e+05 1.483739e+05 3.756645e+05 2.691965e+05 3.401764e+05 3.643150e+05 2.152354e+05 9.327199e+04 1.124429e+05 1.552696e+05 1.272709e+05 2.827522e+05 2.203201e+05 3.165077e+05 1.316421e+05 4.937455e+05 3.642653e+05 3.459859e+05 2.831949e+05 1.115272e+05 1.689284e+05 2.764835e+05 9.664674e+04 2.169175e+05 3.817164e+05 1.427265e+05 3.579898e+05 1.573559e+05 1.366761e+05 2.223424e+05 2.349652e+05 1.413614e+05 4.956471e+05 4.778660e+05 1.304686e+05 3.077912e+05 1.370007e+05 2.615567e+05 2.315019e+05 6.190816e+05 2.964292e+05 4.605612e+05 2.822354e+05 3.356478e+05 2.846907e+05 7.955730e+05 3.606951e+05 2.948441e+05 1.541884e+05 4.533616e+05 5.062548e+05 1.824254e+05 1.745302e+05 2.800351e+05 4.379768e+05 8.506041e+05 5.523153e+05 4.197308e+05 7.285643e+05 7.654355e+05 3.619895e+05 5.598881e+05 1.961844e+05 1.245937e+05 4.292013e+05 4.750064e+05 2.055549e+05 2.956289e+05 9.307594e+04 1.714686e+05 3.263556e+05 5.105644e+05 3.060756e+05 6.730571e+05 3.753842e+05 4.882495e+05 3.644642e+05 5.448462e+05 3.556351e+05 4.041351e+05 3.250227e+05 6.107210e+05 1.054867e+05 5.223301e+05 2.233110e+05 1.414992e+06 1.809589e+05 2.097284e+05 1.171502e+05 1.984174e+05 4.165060e+05 2.680444e+05 4.335429e+05 C14 H29 N O6_1.746 3.639761e+04 2.179392e+06 2.037143e+06 2.083358e+06 3.053979e+04 2.071380e+06 1.713105e+06 2.972263e+06 67277.39 2.043523e+06 2.028938e+06 1.620437e+06 77245.23 1.513268e+06 2.302978e+06 2.634780e+06 5.827398e+04 1.356337e+06 2.569002e+06 2.353612e+06 1.508942e+05 2.463103e+06 2.300171e+06 9.745990e+05 87146.549 1.335863e+06 1.430152e+06 3.147413e+06 6.935701e+04 3.549718e+06 1.723393e+06 1.617876e+06 106078.96 1.238278e+06 1.336959e+06 3.170384e+06 1.093871e+05 2.239209e+06 1.659176e+06 2.997102e+06 9.092079e+04 6.770082e+05 2.757875e+06 3.222048e+06 1.497364e+05 1.565199e+06 1.457601e+06 1.853063e+06 1.041509e+06 6.255681e+05 8.166336e+05 5.436144e+05 1.810284e+06 7.817760e+05 4.648373e+05 1.113733e+06 4.348844e+05 4.472215e+05 1.652699e+06 1.248040e+06 3.378925e+06 1.645284e+06 7.209189e+05 7.134604e+05 1.431581e+06 8.252951e+05 1.119257e+06 8.537580e+05 1.867928e+06 1.043585e+06 8.717073e+05 1.186382e+06 2.252216e+06 8.555083e+05 7.443651e+05 1.134757e+06 7.254723e+05 1.108020e+06 8.765701e+04 3.185901e+05 4.792577e+05 4.511176e+05 4.027575e+05 3.682680e+05 6.758896e+05 1.418036e+06 1.699711e+06 3.271187e+05 6.974385e+05 8.708438e+05 4.621330e+05 1.245432e+06 4.198314e+05 4.547171e+05 8.823916e+05 5.526034e+05 8.689392e+05 8.435314e+05 2.202915e+06 9.477939e+05 6.635149e+05 1.878165e+06 7.500915e+05 5.790117e+05 7.180520e+05 9.523362e+05 7.818340e+05 3.803180e+06 1.378319e+05 2.659381e+05 4.541934e+05 4.795422e+05 7.400039e+05 3.740219e+05 6.507961e+05 4.599911e+05 4.054852e+05 6.423412e+05 4.405248e+05 8.914271e+05 3.313569e+05 5.239124e+05 6.964610e+05 8.524868e+06 1.614953e+05 4.861603e+05 2.914214e+05 1.989983e+06 1.200632e+06 3.578017e+05 5.666143e+05 1.009199e+05 8.118971e+05 9.491213e+05 5.228383e+05 3.685248e+05 3.485759e+06 8.592389e+05 7.351463e+05 5.721505e+05 3.879009e+05 3.681952e+06 8.028244e+05 3.231756e+05 1.841532e+05 6.611174e+05 1.061030e+06 8.123995e+05 8.393986e+06 8.752304e+05 1.917339e+05 6.386995e+05 4.967077e+05 8.939771e+05 1.640708e+06 7.094802e+05 7.556246e+05 4.728785e+05 3.486287e+05 2.336707e+06 3.050199e+06 8.327335e+05 5.789643e+05 1.301983e+06 4.401272e+05 5.080336e+05 4.404402e+05 1.528354e+06 4.362701e+05 8.499380e+05 7.404355e+05 1.000525e+06 8.581666e+05 6.074891e+05 6.414609e+05 5.676037e+05 7.592850e+05 1.129184e+06 3.817985e+05 2.861366e+06 7.823590e+06 8.084570e+06 3.927987e+06 1.498545e+06 1.439917e+06 4.207347e+06 2.842639e+06 1.747174e+06 4.115151e+06 1.599057e+06 8.979193e+06 2.917437e+06 4.546861e+06 5.396266e+06 9.347577e+06 2.771289e+06 6.245365e+06 9.946338e+06 1.715708e+06 6.020648e+06 6.035751e+06 4.974554e+06 1.180481e+06 3.611353e+06 3.116823e+06 3.403855e+06 4.577584e+06 1.140446e+06 2.740415e+06 3.487395e+06 4.577127e+06 2.907087e+06 3.793725e+06 5.985147e+06 8.233179e+06 2.979659e+06 7.644256e+06 4.043950e+06 5.373676e+06 4.877106e+06 3.597405e+06 1.780242e+06 2.571880e+06 1.945663e+06 4.393717e+06 5.670037e+06 4.345907e+06 3.012214e+06 3.585982e+06 3.025381e+06 2.391200e+06 5.016944e+06 4.947421e+06 3.792800e+06 3.632783e+06 4.106218e+06 3.222907e+06 3.625863e+06 2.049184e+06 1.461344e+06 6.945888e+05 6.167320e+05 1.290365e+06 7.475476e+05 8.103425e+05 9.955302e+05 6.762406e+05 3.929122e+05 4.742737e+05 5.715310e+05 2.788897e+05 3.325694e+06 1.006659e+06 6.167186e+05 6.594470e+05 4.948114e+05 2.386668e+05 8.398499e+05 6.954041e+06 1.746512e+07 9.485272e+05 2.612757e+06 517.18439_1.746 2.643304e+05 7.524583e+06 2.903716e+07 3.002571e+07 2.104721e+05 1.254693e+07 1.377981e+07 1.072917e+07 288645.48 2.054539e+07 7.944052e+06 3.149637e+07 162270.97 5.036862e+06 2.934533e+07 3.059248e+07 1.076529e+05 1.123586e+07 1.624946e+07 4.846943e+06 3.052115e+05 5.196458e+06 2.948475e+07 2.598238e+07 104334.102 5.927414e+06 2.728922e+07 2.811137e+07 6.407020e+04 3.533213e+06 1.753518e+07 1.633424e+07 77948.35 1.945204e+07 1.533033e+07 1.375914e+07 6.880637e+04 2.257707e+07 1.858283e+07 1.324880e+07 6.163667e+04 2.825884e+07 1.504701e+07 1.729388e+07 1.273996e+05 1.322912e+07 2.691127e+07 9.721587e+06 1.732262e+07 2.314949e+07 5.158198e+06 1.177718e+07 1.543486e+07 1.705425e+07 2.744346e+07 1.353428e+07 3.372743e+07 3.452836e+07 1.068793e+07 2.251150e+07 8.720162e+06 1.916048e+07 3.943249e+06 1.739449e+07 1.487821e+07 1.853666e+07 3.449702e+06 1.522157e+07 3.698939e+07 2.533366e+07 1.545499e+07 3.098177e+07 2.847496e+07 3.719086e+07 1.958561e+07 1.883645e+07 3.070419e+07 4.063909e+07 2.924876e+05 1.498303e+07 1.184718e+07 2.868478e+07 1.116789e+07 3.447820e+07 3.872507e+06 1.704416e+07 9.922285e+06 2.844423e+07 3.802475e+07 2.698316e+07 1.707414e+07 7.533887e+06 2.135334e+07 1.063215e+07 1.959154e+07 2.909371e+07 1.711334e+07 1.431901e+07 5.155355e+06 9.341774e+06 2.469900e+07 1.322615e+07 2.836564e+07 1.627125e+07 1.685204e+07 1.918634e+07 1.563888e+07 1.597062e+07 1.959054e+07 8.970716e+06 1.518959e+07 3.016164e+07 2.647101e+07 1.613523e+07 6.421137e+06 2.000026e+07 2.814968e+07 1.695624e+07 2.262676e+07 1.730016e+07 1.130419e+07 3.410901e+06 1.313020e+07 2.202784e+07 1.562957e+07 1.340123e+07 1.332184e+07 3.268865e+07 2.492259e+07 7.296878e+06 1.945935e+07 6.942539e+04 4.361334e+06 1.977551e+07 2.733352e+07 5.265663e+06 2.356720e+07 2.561578e+07 2.211559e+07 4.385868e+06 1.160752e+07 3.079237e+07 2.402040e+07 2.135714e+07 1.703954e+07 1.658567e+07 1.515229e+07 1.387562e+07 1.067414e+07 2.059404e+07 4.604398e+06 2.095481e+07 2.926199e+07 1.204228e+07 3.088620e+07 1.282516e+07 1.999422e+07 1.497792e+07 5.594814e+06 6.707818e+06 2.058546e+07 1.373877e+07 2.364542e+07 2.336006e+07 1.017944e+07 2.204972e+07 1.301427e+07 1.273555e+07 1.329232e+07 1.356955e+07 1.427482e+07 3.859874e+07 1.462642e+07 2.409421e+07 3.240073e+07 1.026745e+07 1.497638e+07 1.625491e+07 2.620502e+07 2.259858e+07 1.145175e+07 2.734163e+07 2.701996e+07 5.644527e+06 3.411160e+07 2.080024e+07 8.118096e+06 7.043115e+06 6.972297e+06 1.022488e+07 1.950008e+07 1.177396e+07 2.035507e+07 1.616267e+07 1.277645e+07 4.084241e+07 1.542723e+07 2.016417e+07 1.630660e+07 3.222347e+07 9.283080e+06 3.871990e+07 2.071900e+07 3.353869e+07 1.227817e+07 3.221860e+07 2.231591e+07 1.673001e+07 3.766064e+07 1.195303e+07 1.738569e+07 2.404925e+07 2.705645e+07 1.656030e+07 3.537573e+07 3.223183e+07 1.975945e+07 5.972927e+06 3.938919e+07 4.661903e+06 1.220457e+07 9.249864e+06 1.491928e+07 1.574793e+07 3.168412e+07 1.090802e+07 1.388702e+07 1.409649e+07 3.593033e+07 1.619253e+07 3.872644e+07 1.521960e+07 2.162675e+07 3.662719e+07 2.844470e+07 1.739433e+06 1.596967e+07 1.649381e+07 3.894963e+07 2.326047e+07 3.116057e+07 1.071878e+07 3.135156e+07 1.300600e+07 4.962295e+06 2.729379e+07 2.605479e+07 6.226277e+06 2.946508e+07 2.526092e+07 7.123451e+06 1.442570e+07 4.382423e+07 1.045612e+07 2.093881e+07 9.412058e+06 1.491491e+07 1.390991e+07 2.149557e+07 1.338424e+07 1.747054e+07 3.048253e+07 C4 H8 N2_1.746 1.749516e+05 4.641101e+06 4.046808e+06 3.255457e+06 6.128450e+04 3.323905e+06 2.990240e+06 4.009148e+06 63274.76 3.990678e+06 3.989328e+06 4.641079e+06 48768.08 4.315121e+06 4.104900e+06 4.798715e+06 4.356476e+04 1.470547e+06 4.910926e+06 2.010172e+06 1.158987e+05 2.572356e+06 5.304392e+06 5.362039e+06 47160.044 3.801399e+06 2.096767e+06 4.988277e+06 3.502278e+04 4.313450e+06 1.780721e+06 6.702552e+06 62114.76 4.146859e+06 3.675633e+06 1.732954e+06 7.927604e+04 9.529966e+05 5.205162e+06 5.120317e+06 5.681458e+04 3.272635e+06 4.685254e+06 6.630653e+06 9.613151e+04 1.598614e+06 2.702416e+06 3.592083e+06 1.351853e+06 4.657244e+06 7.983265e+05 3.447795e+06 1.851665e+06 2.853472e+06 6.791902e+06 9.620424e+06 6.452724e+06 7.202304e+06 3.775474e+06 2.395401e+06 7.845160e+06 2.755528e+06 6.522981e+06 4.354439e+06 2.931075e+06 6.087883e+06 4.998245e+06 1.587185e+06 6.631055e+06 5.423876e+06 8.111538e+06 6.582612e+06 3.419181e+06 8.160153e+06 1.478904e+06 2.937943e+06 2.591832e+06 2.939647e+06 8.445879e+04 3.052435e+06 2.178721e+06 3.077226e+06 2.642128e+06 5.409455e+06 2.178522e+06 2.280130e+06 1.264904e+05 2.340791e+06 5.713798e+06 3.230260e+06 2.014763e+06 5.042455e+06 1.688512e+06 4.880431e+06 7.104445e+06 6.926388e+06 5.718613e+06 3.267505e+06 6.612806e+06 2.274308e+06 6.710571e+06 1.585958e+06 9.177104e+05 5.818713e+06 3.114991e+06 6.809392e+06 3.798399e+05 3.420586e+06 2.621421e+06 3.385852e+06 3.349586e+06 4.250813e+06 5.976876e+06 3.599180e+06 2.933338e+06 4.605258e+06 3.180957e+06 2.561688e+06 2.813148e+05 3.970748e+06 1.475831e+06 1.521679e+06 2.681262e+06 1.827146e+05 1.724354e+06 1.757441e+06 7.225916e+06 2.409718e+06 1.684320e+05 3.455415e+06 3.137518e+06 7.849002e+04 2.551846e+06 3.524302e+05 4.242234e+06 2.078369e+06 8.457211e+06 5.615337e+06 3.904358e+06 2.560698e+06 2.284071e+06 3.809222e+06 1.487832e+06 2.707894e+06 5.208416e+06 2.307892e+06 1.638565e+06 4.096799e+06 2.474499e+06 3.531364e+06 4.270090e+06 5.356102e+06 2.911761e+06 2.499536e+06 6.038858e+06 6.255373e+06 4.792257e+06 8.480225e+06 9.533569e+06 4.967371e+06 6.200277e+06 7.866124e+06 5.469839e+06 8.690299e+06 3.311392e+06 2.022557e+06 2.218713e+06 4.585752e+06 2.022837e+06 4.659021e+06 1.999362e+06 4.768158e+06 1.922813e+06 3.351400e+06 8.811919e+06 4.772004e+06 7.019129e+06 3.150181e+06 8.537418e+06 6.473767e+06 3.078884e+06 5.382040e+06 4.942329e+06 7.334121e+06 4.067016e+06 6.064188e+06 2.495183e+06 2.068236e+06 7.932422e+06 1.088278e+06 8.561857e+06 4.647146e+06 2.950276e+06 5.287834e+06 6.389023e+06 3.836711e+06 5.445028e+06 9.373462e+06 3.922351e+06 1.088342e+07 4.626327e+06 8.561259e+06 4.936448e+06 3.594390e+06 6.776961e+06 3.242902e+06 4.677544e+06 4.599438e+06 5.715671e+06 6.403849e+06 2.406681e+06 7.030273e+05 2.207752e+06 1.243400e+06 1.147510e+07 4.449059e+06 3.963967e+06 1.058666e+06 5.830330e+06 4.968293e+06 4.764134e+06 4.034167e+06 1.391880e+06 6.616578e+06 2.039653e+06 6.329912e+06 1.696565e+06 1.949129e+06 5.090218e+06 6.442358e+06 6.072300e+06 1.052421e+06 2.877552e+06 6.075182e+06 1.707546e+06 2.262040e+06 6.960971e+06 1.056128e+06 4.526872e+06 6.544378e+06 6.773855e+06 4.844279e+06 5.565703e+06 7.264742e+06 3.824953e+06 3.768421e+06 4.308052e+06 4.935760e+06 5.501715e+06 5.482822e+06 1.496314e+06 5.759559e+06 1.597592e+06 5.198721e+06 9.690681e+06 3.044025e+06 4.070837e+06 4.763836e+06 3.300995e+06 1.472082e+06 4.958122e+06 2.602209e+06 C11 H14 O3_1.746 1.896982e+05 1.408706e+06 1.295364e+06 2.363352e+06 8.730544e+04 2.186719e+06 2.672550e+06 1.477824e+06 340912.56 1.968897e+06 8.554078e+05 1.588828e+06 358455.57 3.004889e+06 1.070858e+06 2.574104e+06 3.014887e+05 2.190674e+06 1.869888e+06 1.173645e+06 2.657167e+05 2.465841e+06 1.456763e+06 1.977523e+06 144387.567 1.684620e+06 1.723487e+06 1.968661e+06 2.833347e+05 1.460398e+06 1.893016e+06 2.599333e+06 158204.51 1.238668e+06 2.693954e+06 2.141742e+06 2.697370e+05 1.092068e+06 1.573207e+06 1.824354e+06 2.015558e+05 2.105955e+06 2.308839e+06 2.039043e+06 3.295744e+05 1.180120e+06 4.280066e+06 2.035775e+06 1.734002e+06 2.686787e+06 2.482354e+06 4.509714e+06 1.078153e+06 1.425072e+06 2.188553e+06 2.882586e+06 3.232621e+06 3.036996e+06 4.745374e+06 2.163000e+06 2.386112e+06 4.568674e+06 2.197772e+06 4.342104e+06 4.344997e+06 4.064660e+06 3.966186e+06 1.612790e+06 8.330758e+05 4.322532e+06 3.426108e+06 4.070818e+06 3.236597e+06 5.038785e+06 3.710997e+06 3.454674e+06 2.528869e+06 2.765304e+06 2.766824e+05 2.149785e+06 2.511851e+06 8.488228e+05 2.489080e+06 2.426317e+06 1.652730e+06 1.409801e+06 1.690781e+06 7.217919e+05 1.125016e+06 1.707480e+06 4.018963e+06 2.179243e+06 2.300929e+06 4.108866e+06 6.620259e+06 2.393569e+06 2.465180e+06 2.976996e+06 9.015984e+05 2.587929e+06 2.530066e+06 2.582285e+06 2.510658e+06 3.493237e+06 1.290179e+06 6.195890e+06 2.999372e+06 1.940413e+06 2.145912e+06 2.714928e+06 1.301033e+06 6.352832e+06 2.146140e+06 4.001129e+06 1.077495e+06 7.662983e+05 5.797983e+06 3.676076e+06 1.003505e+06 3.599554e+06 1.021389e+06 9.888334e+05 1.299220e+06 1.525147e+06 1.451641e+06 1.386824e+06 3.795440e+06 1.907328e+06 7.182109e+05 6.950422e+05 1.455076e+06 2.162657e+05 3.509952e+06 4.372693e+06 1.671608e+06 2.193712e+06 6.438346e+06 4.548611e+06 4.055605e+06 4.540463e+06 1.775143e+06 2.302118e+06 3.996374e+06 1.837395e+06 1.638805e+06 1.211745e+06 1.939647e+06 1.122382e+06 1.017638e+06 1.790035e+06 3.498974e+06 2.920055e+06 1.718066e+06 4.014587e+06 2.033288e+06 1.169230e+06 4.112550e+06 5.713938e+06 8.122401e+06 2.395133e+06 5.082347e+06 4.217817e+06 2.700332e+06 1.689282e+06 1.466189e+06 6.159550e+05 1.405343e+06 1.784817e+06 1.377540e+06 1.372149e+06 1.907490e+06 1.166183e+06 1.489203e+06 1.462388e+06 4.405296e+06 9.825519e+05 1.280214e+06 2.576324e+06 3.508428e+06 1.040951e+06 2.707852e+06 2.347322e+06 1.678612e+06 1.616156e+06 1.185745e+06 1.651990e+06 1.111423e+06 1.475815e+06 5.177395e+06 1.792404e+06 2.557385e+06 1.346910e+06 3.412505e+06 2.733490e+06 2.757581e+06 1.142546e+06 1.308808e+07 2.864118e+06 1.176027e+06 5.149232e+06 5.367183e+06 2.401545e+06 1.896835e+06 1.118427e+06 1.228766e+06 7.266729e+05 1.723495e+06 8.988893e+05 1.888195e+06 3.162448e+06 1.287155e+06 1.511294e+06 3.597479e+06 1.352791e+06 1.851403e+06 1.008424e+06 6.546240e+06 3.988302e+06 1.641638e+06 3.147734e+06 1.409483e+06 1.699727e+06 2.325259e+06 3.342440e+06 1.611232e+06 4.133734e+06 4.477071e+06 2.802799e+06 8.758254e+05 9.128640e+05 1.536342e+06 5.019285e+06 3.094786e+06 2.564054e+06 1.962064e+06 1.582274e+06 2.033287e+06 1.303858e+06 2.596855e+06 2.461020e+06 4.764730e+06 2.457564e+06 4.199091e+06 2.955633e+06 8.370832e+05 4.870921e+06 4.778262e+06 2.731379e+06 7.878517e+05 1.419660e+06 9.349380e+05 1.574798e+06 1.000464e+06 2.312331e+06 1.529606e+06 5.445011e+05 1.843422e+06 4.734297e+06 1.846122e+06 2.831188e+06 1.559807e+06 2.580524e+06 C7 H21 N8 P_1.746 1.175113e+05 2.515989e+06 2.380816e+06 2.651139e+06 9.376916e+04 2.394922e+06 2.643741e+06 3.127233e+06 155682.42 2.112924e+06 2.856863e+06 2.547732e+06 143629.37 2.129014e+06 2.396204e+06 2.675406e+06 1.056762e+05 2.881609e+06 2.186855e+06 2.036237e+06 2.453273e+05 2.980153e+06 2.527458e+06 2.494436e+06 105514.699 2.536283e+06 3.225953e+06 2.354258e+06 9.433765e+04 2.324323e+06 2.877884e+06 1.911968e+06 162358.89 2.324795e+06 3.302005e+06 2.274657e+06 1.990594e+05 1.872451e+06 2.978310e+06 1.893741e+06 1.689055e+05 3.259790e+06 2.774760e+06 2.446254e+06 2.396622e+05 2.645310e+06 2.107221e+06 2.752921e+06 2.358475e+06 2.774951e+06 1.713163e+06 2.012787e+06 2.343312e+06 2.240375e+06 2.527795e+06 2.198371e+06 2.684808e+06 2.728216e+06 2.090996e+06 2.135419e+06 1.951594e+06 1.611232e+06 2.256980e+06 2.526120e+06 1.810961e+06 2.496914e+06 2.519535e+06 1.220953e+06 2.228952e+06 2.288880e+06 2.572161e+06 2.745249e+06 2.357430e+06 2.464828e+06 1.459494e+06 1.613456e+06 2.036870e+06 2.777750e+06 4.066098e+05 2.040759e+06 1.491504e+06 2.787771e+06 2.521270e+06 2.403582e+06 2.012024e+06 3.052374e+06 2.091825e+06 1.817434e+06 2.676484e+06 2.317720e+06 2.792423e+06 2.002390e+06 1.347285e+06 2.217523e+06 2.871852e+06 2.169537e+06 2.753799e+06 2.656632e+06 2.254642e+06 1.845347e+06 2.367034e+06 1.594817e+06 2.083519e+06 2.046070e+06 2.091053e+06 1.872036e+06 1.398680e+06 1.457468e+06 1.506840e+06 1.855168e+06 1.911305e+06 2.020297e+06 2.281931e+06 2.596347e+06 3.349299e+06 2.073254e+06 3.026277e+06 2.846746e+06 1.738023e+06 3.199519e+06 1.293466e+06 1.766587e+06 2.071105e+06 1.362025e+06 1.113434e+06 1.956207e+06 2.729846e+06 1.341496e+06 2.131241e+06 2.394989e+06 1.468070e+06 1.834594e+05 2.273839e+06 1.631292e+06 2.043051e+06 2.682068e+06 2.374596e+06 2.554990e+06 2.043214e+06 2.306822e+06 1.994174e+06 3.029885e+06 3.266413e+06 1.698507e+06 2.116925e+06 2.674005e+06 2.387515e+06 1.657074e+06 2.667557e+06 3.749279e+06 2.418773e+06 1.986222e+06 2.091330e+06 2.065186e+06 2.031462e+06 1.917388e+06 3.336825e+06 4.269551e+06 2.709449e+06 2.414462e+06 2.610615e+06 2.839521e+06 2.314784e+06 3.378810e+06 2.161216e+06 2.152830e+06 2.236642e+06 2.015337e+06 2.112129e+06 2.281456e+06 2.684008e+06 2.681685e+06 2.495010e+06 2.085722e+06 2.567950e+06 2.554957e+06 2.294630e+06 2.616610e+06 2.666898e+06 2.572946e+06 3.072617e+06 2.484857e+06 2.660003e+06 2.624421e+06 2.508011e+06 2.664268e+06 2.530646e+06 2.334935e+06 3.091087e+06 2.316108e+06 1.971789e+06 2.545710e+06 2.394410e+06 3.455331e+06 2.854655e+06 3.251255e+06 2.856971e+06 1.548879e+06 1.849696e+06 3.452397e+06 3.046780e+06 2.902755e+06 3.008051e+06 2.176182e+06 2.713560e+06 2.116191e+06 1.774468e+06 1.605081e+06 2.852509e+06 3.282426e+06 2.781751e+06 2.061434e+06 1.909787e+06 1.874094e+06 3.407292e+06 2.958998e+06 3.095555e+06 2.249660e+06 2.651430e+06 3.079260e+06 2.853491e+06 2.555341e+06 1.567002e+06 3.311743e+06 2.360786e+06 4.367275e+06 3.007527e+06 3.258881e+06 2.994539e+06 2.426664e+06 2.433242e+06 2.912822e+06 3.237785e+06 3.121608e+06 2.688838e+06 2.462431e+06 2.327407e+06 2.568115e+06 2.350593e+06 2.929196e+06 2.463062e+06 3.507210e+06 6.704102e+06 6.844215e+06 4.316453e+06 4.546254e+06 6.656910e+06 2.297570e+06 5.960462e+06 4.880520e+06 3.612009e+06 1.725166e+06 4.710549e+06 2.167250e+06 1.022176e+07 1.891998e+06 2.121081e+06 2.458498e+06 2.042295e+06 3.842236e+06 6.240616e+06 2.662496e+06 "4-(1,2-Dihydroxy-2-propanyl)-1-methyl-1,2-cyclohexanediol_1.747" 2.544682e+05 4.479896e+06 5.065604e+06 2.775066e+06 2.026330e+05 3.600208e+06 4.552599e+06 4.592631e+06 323160.81 3.480669e+06 3.721891e+06 4.302369e+06 269274.40 4.407024e+06 3.708893e+06 4.343811e+06 1.930701e+05 4.193906e+06 3.922978e+06 4.387983e+06 4.663646e+05 3.599848e+06 3.974897e+06 4.295927e+06 219852.068 3.773570e+06 4.893136e+06 4.678215e+06 1.976617e+05 2.807634e+06 4.009803e+06 4.585564e+06 282299.89 3.364662e+06 4.618273e+06 3.826409e+06 3.209264e+05 3.668602e+06 5.424529e+06 4.482053e+06 3.410350e+05 2.770995e+06 2.855686e+06 6.253111e+06 5.489204e+05 3.069087e+06 4.859819e+06 3.365542e+06 4.550819e+06 4.547628e+06 2.026967e+06 1.610935e+06 9.943240e+05 3.810730e+06 1.035455e+06 2.100338e+06 1.313963e+06 1.274158e+06 1.150834e+06 4.919517e+06 2.847467e+06 2.152532e+06 1.876602e+06 1.506774e+06 1.677880e+06 5.072561e+06 4.456312e+06 8.401739e+05 1.192452e+06 1.177594e+06 1.645996e+06 1.604660e+06 2.635717e+06 1.557858e+06 3.659176e+06 3.508105e+06 3.805253e+06 4.953972e+06 3.037044e+05 5.537410e+06 4.958613e+06 4.847445e+06 2.660748e+06 4.748115e+06 2.755232e+06 4.287861e+06 2.215700e+06 1.632703e+06 3.192534e+06 3.866096e+06 3.763287e+06 5.002198e+06 2.861657e+06 1.951961e+06 5.516665e+06 2.751964e+06 3.522958e+06 5.330853e+06 2.009443e+06 2.022924e+06 1.944879e+06 1.956584e+06 3.189999e+06 2.278825e+06 1.895203e+06 3.181941e+06 1.572261e+06 2.866378e+06 1.566814e+06 2.073821e+06 4.010326e+06 4.732903e+06 3.656491e+06 4.197527e+06 7.824578e+06 2.846306e+06 7.564609e+06 5.963578e+06 3.302466e+06 5.530403e+06 2.855180e+06 2.345825e+06 3.367360e+06 4.890394e+06 5.661571e+06 4.776709e+06 9.654091e+06 4.122872e+06 4.071954e+06 5.721097e+06 4.100534e+06 3.702244e+05 4.797431e+06 4.819568e+06 4.417979e+06 5.924516e+06 7.710317e+06 5.798438e+06 3.945398e+06 5.250407e+06 1.204713e+06 7.290177e+06 7.208016e+06 8.806240e+05 1.072808e+06 1.295865e+06 1.533863e+06 7.302042e+05 1.403062e+06 1.608433e+06 1.254674e+06 1.735241e+06 1.166924e+06 2.692056e+06 2.302539e+06 2.322386e+06 5.582227e+06 8.094316e+06 7.431380e+06 4.443026e+06 3.032514e+06 4.411057e+06 2.216982e+06 5.070572e+06 5.054256e+06 3.497371e+06 2.196805e+06 2.844429e+06 3.144680e+06 2.928506e+06 4.565531e+06 3.707438e+06 4.800150e+06 3.695401e+06 8.063245e+06 5.301401e+06 1.062314e+06 1.599582e+06 1.408930e+06 1.310773e+06 2.295103e+06 3.415549e+06 3.018061e+06 1.953725e+06 4.461072e+06 4.229431e+06 4.125002e+06 3.598746e+06 1.531189e+06 2.537740e+06 1.704053e+06 2.355883e+06 1.809378e+06 6.216301e+06 4.786998e+06 4.828942e+06 3.686274e+06 2.304032e+06 1.921344e+06 1.867480e+06 3.400398e+06 3.118211e+06 4.427367e+06 3.923523e+06 4.582912e+06 1.997360e+06 4.360570e+06 1.719614e+06 4.609621e+06 4.687124e+06 2.539229e+06 3.724192e+06 3.666122e+06 4.462717e+06 8.897057e+06 3.599290e+06 5.990579e+06 5.859259e+06 5.064232e+06 6.390581e+06 6.414577e+06 3.322479e+06 2.186111e+06 6.147323e+06 6.506996e+06 7.563104e+06 7.524234e+06 9.175653e+06 6.079173e+06 3.836110e+06 4.925093e+06 6.348102e+06 2.451942e+06 5.588788e+06 5.343137e+06 2.183073e+06 2.184497e+06 2.266635e+06 4.279848e+06 3.512628e+06 4.698026e+06 1.160733e+07 1.255092e+07 1.455775e+07 7.407118e+06 1.212383e+07 1.229202e+07 1.044016e+07 8.953498e+06 1.447327e+07 1.293273e+07 1.285455e+06 1.269940e+07 2.938127e+06 2.169649e+07 1.221560e+06 1.436894e+06 1.093723e+06 1.726196e+06 1.056097e+07 9.391722e+06 1.026334e+07 C10 H15 N7 O2 P2_1.747 4.519062e+05 3.306012e+07 3.237019e+07 3.127799e+07 3.253332e+05 3.129294e+07 3.869116e+07 3.720512e+07 364553.58 3.440574e+07 3.264518e+07 3.336103e+07 279305.79 3.804127e+07 3.142188e+07 3.463421e+07 1.902693e+05 2.919015e+07 3.143004e+07 2.957180e+07 4.357399e+05 5.375911e+07 2.960616e+07 3.476110e+07 213938.300 2.460187e+07 3.855693e+07 4.104763e+07 1.784639e+05 2.512931e+07 2.777601e+07 3.064775e+07 189568.28 4.539202e+07 2.816366e+07 2.761491e+07 1.974964e+05 5.382608e+07 2.404328e+07 2.986109e+07 2.106177e+05 4.586089e+07 2.800466e+07 3.671822e+07 3.930650e+05 2.410497e+07 4.380409e+07 3.087429e+07 3.083189e+07 3.457961e+07 1.846975e+07 2.526194e+07 3.021297e+07 3.229158e+07 3.825223e+07 3.179568e+07 3.547865e+07 3.561374e+07 2.201097e+07 3.806673e+07 2.504213e+07 3.941213e+07 3.362198e+07 2.686441e+07 2.616854e+07 2.946195e+07 3.402514e+07 3.157888e+07 3.232028e+07 3.269316e+07 2.487631e+07 2.918146e+07 4.315668e+07 3.169696e+07 3.189224e+07 4.258724e+07 2.861179e+07 3.413306e+07 8.025604e+05 3.113144e+07 3.795254e+07 3.092934e+07 2.818484e+07 3.879389e+07 3.008645e+07 3.185351e+07 2.884640e+07 4.741764e+07 4.279238e+07 3.936471e+07 2.730057e+07 3.562841e+07 3.652659e+07 3.183145e+07 3.610367e+07 2.892983e+07 2.925915e+07 2.886447e+07 2.935140e+07 3.295991e+07 3.657901e+07 2.985107e+07 3.299048e+07 2.976389e+07 2.520562e+07 3.639742e+07 3.003470e+07 3.489441e+07 4.899783e+07 3.028843e+07 2.637909e+07 3.339775e+07 4.110373e+07 2.667238e+07 3.747527e+07 4.509207e+07 3.513209e+07 4.006261e+07 3.111584e+07 2.838702e+07 2.628618e+07 2.035284e+07 3.524815e+07 2.431599e+07 3.428906e+07 3.030595e+07 3.852049e+07 3.965451e+07 3.344283e+07 3.043595e+07 3.633696e+07 4.485218e+05 3.638864e+07 3.872635e+07 3.304492e+07 3.988402e+07 4.517211e+07 3.188611e+07 3.574527e+07 3.898071e+07 2.218591e+07 3.733476e+07 4.093750e+07 4.873913e+07 4.126108e+07 3.501153e+07 3.092041e+07 3.066808e+07 2.943013e+07 2.799187e+07 3.172366e+07 3.004952e+07 3.651595e+07 2.517218e+07 4.020417e+07 3.652431e+07 2.684887e+07 4.356006e+07 3.924015e+07 2.283993e+07 2.747392e+07 2.304716e+07 3.413795e+07 5.549543e+07 2.311713e+07 2.834870e+07 2.762256e+07 3.378582e+07 3.156829e+07 3.157000e+07 3.196384e+07 4.223078e+07 3.053426e+07 3.943063e+07 4.181298e+07 2.718273e+07 2.719375e+07 2.565566e+07 2.989238e+07 2.808702e+07 2.453479e+07 4.216268e+07 2.664085e+07 2.042709e+07 2.810150e+07 2.521522e+07 3.218811e+07 3.586282e+07 2.538259e+07 1.847576e+07 3.091365e+07 3.069282e+07 3.143764e+07 2.453085e+07 1.859798e+07 3.162741e+07 2.025646e+07 3.914672e+07 3.149965e+07 1.725477e+07 2.679261e+07 2.495339e+07 3.151646e+07 3.248162e+07 3.625359e+07 4.338722e+07 3.771339e+07 3.858788e+07 3.253801e+07 3.306986e+07 3.261824e+07 3.837519e+07 3.410611e+07 3.012126e+07 5.256744e+07 2.372863e+07 2.355683e+07 2.157299e+07 3.920005e+07 3.379137e+07 3.209090e+07 2.968766e+07 4.296789e+07 3.350249e+07 3.276932e+07 3.488622e+07 2.310309e+07 2.714078e+07 3.198618e+07 3.622001e+07 3.426903e+07 2.785781e+07 2.635690e+07 3.247587e+07 3.945540e+07 3.148497e+07 3.980229e+07 3.196383e+07 3.391308e+07 4.322214e+07 3.953340e+07 3.232777e+07 4.439127e+07 3.599026e+07 3.917884e+07 4.286645e+07 3.314349e+07 2.960577e+07 2.903789e+07 2.473779e+07 2.554203e+07 2.612926e+07 2.830312e+07 2.844857e+07 3.078305e+07 3.102835e+07 3.719241e+07 3.801425e+07 3.216062e+07 2.572403e+07 3.301293e+07 3.064898e+07 C6 H19 N4 O3 P_1.747 2.411153e+05 1.963513e+06 3.275306e+06 2.765028e+06 1.075278e+05 3.595776e+06 5.356568e+06 3.630912e+06 173345.67 1.515905e+06 2.953228e+06 2.196204e+06 154080.88 4.486177e+06 2.056942e+06 3.296871e+06 1.366019e+05 4.052062e+06 3.368698e+06 1.999718e+06 3.093581e+05 5.127268e+06 2.345790e+06 2.544996e+06 213027.292 2.731850e+06 2.502155e+06 5.064350e+06 2.014841e+05 2.281523e+06 3.220528e+06 4.443695e+06 288000.79 2.017505e+06 3.169601e+06 4.350065e+06 3.441348e+05 2.169711e+06 2.522819e+06 2.996008e+06 2.803568e+05 2.642528e+06 4.572819e+06 3.766676e+06 3.470084e+05 1.813155e+06 4.221564e+06 2.464018e+06 1.669717e+06 2.603447e+06 2.748543e+06 6.400973e+06 2.125149e+06 2.112808e+06 2.255389e+06 4.374498e+06 5.116362e+06 5.103781e+06 9.042698e+06 3.439788e+06 8.033723e+06 4.474542e+06 3.692078e+06 7.579189e+06 6.478634e+06 5.747986e+06 4.139140e+06 2.313042e+06 2.008788e+06 7.850311e+06 3.848269e+06 4.204834e+06 6.976599e+06 7.938037e+06 5.260168e+06 5.027955e+06 2.546277e+06 3.986639e+06 3.532413e+05 4.244439e+06 4.715907e+06 1.783089e+06 4.567987e+06 2.664564e+06 2.558120e+06 2.585538e+06 1.653648e+06 1.066144e+06 1.576719e+06 2.402977e+06 6.977668e+06 4.541963e+06 3.072106e+06 3.449535e+06 8.321159e+06 3.747178e+06 7.292119e+06 3.352139e+06 2.673080e+06 2.717360e+06 2.665952e+06 3.345200e+06 2.883816e+06 5.438238e+06 3.204087e+06 7.569608e+06 5.509834e+06 3.938669e+06 2.771723e+06 3.973695e+06 2.773446e+06 5.787612e+06 2.727685e+06 3.714026e+06 3.528397e+06 8.720205e+05 6.791816e+06 6.075128e+06 2.046773e+06 4.999141e+06 1.241436e+06 1.647523e+06 1.557188e+06 2.053495e+06 1.909955e+06 2.248251e+06 6.556700e+06 2.024079e+06 3.272898e+06 1.271167e+06 5.131876e+06 5.699695e+05 3.227454e+06 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2.627659e+06 2.061708e+06 6.474602e+06 2.548997e+06 2.056091e+06 1.599806e+06 5.919331e+06 3.571344e+06 3.280629e+06 3.125100e+06 3.049145e+06 1.736501e+06 1.640088e+06 4.151787e+06 2.591006e+06 7.329031e+06 5.568325e+06 3.789871e+06 1.397647e+06 3.474780e+06 5.082415e+06 7.906634e+06 6.740305e+06 3.399746e+06 3.742657e+06 3.271482e+06 2.356962e+06 2.697143e+06 3.164437e+06 3.604894e+06 9.549813e+06 2.852554e+06 9.231226e+06 4.016079e+06 1.451973e+06 4.022941e+06 1.051540e+07 3.860271e+06 1.943574e+06 4.685039e+06 1.789246e+06 3.541373e+06 4.406581e+06 2.594351e+06 6.403485e+06 7.788708e+05 1.972794e+06 8.675523e+06 2.561846e+06 4.721391e+06 3.255654e+06 3.077982e+06 C7 H22 N5 O3 P_1.747 6.678744e+04 2.889196e+06 3.042758e+06 1.636719e+06 5.309154e+04 2.358647e+06 6.863195e+05 2.977894e+06 75993.15 2.172534e+06 2.859043e+06 2.697790e+06 62394.85 2.643722e+06 1.728706e+06 1.556784e+06 5.240344e+04 2.755656e+06 2.555820e+06 2.771861e+06 1.390952e+05 2.765198e+06 1.015466e+06 1.713369e+06 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3.032917e+06 3.155470e+06 4.871352e+06 2.371408e+06 2.434215e+06 3.669436e+06 1.614493e+06 3.008710e+06 2.310173e+06 3.041083e+06 3.689979e+06 9.476039e+05 2.272229e+06 2.977996e+06 2.255704e+06 1.912821e+06 5.264088e+06 2.641566e+06 8.771509e+06 1.817893e+06 2.067018e+06 2.490906e+06 3.479088e+06 4.871626e+06 2.602967e+06 1.948983e+06 3.204957e+06 2.138015e+06 1.244709e+06 1.329436e+06 1.394724e+06 2.734347e+06 2.384257e+06 2.479719e+06 2.247689e+06 1.157987e+06 3.433414e+06 3.272071e+06 3.901549e+06 4.271471e+06 3.098978e+06 1.582699e+06 9.479664e+05 2.299257e+06 2.155291e+06 4.698343e+06 3.385265e+06 4.057888e+06 3.857687e+06 2.915766e+06 2.747152e+06 1.697042e+06 1.892468e+06 4.265943e+06 2.723979e+06 2.873802e+06 1.276731e+06 2.829633e+06 3.470720e+06 2.470108e+06 2.675026e+06 3.077361e+06 2.425792e+06 2.492113e+06 3.193747e+06 4.378340e+06 2.425297e+06 3.366240e+06 3.452882e+06 1.737017e+06 1.028320e+06 1.596135e+06 3.040334e+06 1.284803e+06 3.058892e+06 1.619480e+06 5.123708e+06 5.671082e+05 2.075032e+06 2.561956e+06 9.214138e+05 1.470611e+06 3.008269e+06 3.042517e+06 C12 H11 N8 O2 P_1.747 5.699237e+04 5.629001e+05 5.780557e+05 6.126920e+05 4.376831e+04 6.764459e+05 5.568057e+05 6.525324e+05 61295.39 6.726925e+05 6.500821e+05 7.088784e+05 55391.09 6.415108e+05 5.190101e+05 5.966875e+05 4.833808e+04 5.956653e+05 5.308823e+05 5.859160e+05 1.242481e+05 6.937776e+05 7.491615e+05 5.610494e+05 62961.770 6.077731e+05 6.236685e+05 6.732737e+05 6.119680e+04 5.642332e+05 5.448405e+05 5.800179e+05 81175.14 7.445484e+05 5.792595e+05 6.181157e+05 8.781871e+04 6.444531e+05 7.150433e+05 6.335064e+05 8.225072e+04 3.827001e+05 6.202641e+05 8.544599e+05 1.088629e+05 5.817463e+05 5.130772e+05 6.468638e+05 6.255307e+05 4.758442e+05 5.877130e+05 4.705050e+05 6.428410e+05 6.979055e+05 5.966721e+05 6.405618e+05 7.356171e+05 7.845167e+05 5.705165e+05 4.390714e+05 3.956885e+05 8.820535e+05 6.732824e+05 6.490261e+05 6.978384e+05 8.511444e+05 6.822169e+05 6.350982e+05 6.952708e+05 5.674265e+05 6.179169e+05 7.093449e+05 7.188209e+05 4.190091e+05 4.473617e+05 4.222208e+05 6.723044e+05 6.640485e+05 1.287311e+05 3.042831e+05 5.403983e+05 7.567133e+05 5.870276e+05 5.808508e+05 7.105759e+05 6.903056e+05 4.928960e+05 4.979040e+05 8.179489e+05 6.913716e+05 5.090677e+05 6.379204e+05 4.759409e+05 5.906093e+05 5.940937e+05 6.137276e+05 7.638489e+05 7.019250e+05 8.263170e+05 5.562106e+05 6.640472e+05 3.765923e+05 7.462196e+05 7.012607e+05 5.947189e+05 4.701440e+05 3.443494e+05 4.918378e+05 5.314480e+05 4.552139e+05 3.998682e+05 5.214571e+05 7.191704e+05 7.116411e+05 1.186452e+06 5.579112e+05 5.443678e+05 6.666014e+05 5.472516e+05 7.346167e+05 6.985521e+05 4.059302e+05 6.240303e+05 3.996830e+05 5.821163e+05 4.389374e+05 7.961885e+05 4.820796e+05 6.615863e+05 7.002538e+05 5.362796e+05 8.475317e+04 7.358653e+05 4.126443e+05 4.933915e+05 8.528116e+05 8.599914e+05 6.659956e+05 6.116487e+05 6.174597e+05 8.335855e+05 7.248899e+05 6.516750e+05 5.981535e+05 5.814320e+05 5.798307e+05 8.335858e+05 4.236800e+05 4.639876e+05 4.497408e+05 5.474575e+05 3.854494e+05 6.050279e+05 5.232032e+05 5.712981e+05 6.486723e+05 7.719711e+05 8.488678e+05 7.335889e+05 5.444095e+05 8.067105e+05 6.645973e+05 5.650552e+05 1.079055e+06 5.345836e+05 6.620560e+05 8.654220e+05 5.852847e+05 6.127849e+05 1.011539e+06 8.806250e+05 5.988831e+05 7.992980e+05 6.411369e+05 7.750712e+05 6.222700e+05 6.026995e+05 8.174836e+05 6.676360e+05 6.515650e+05 5.782517e+05 7.324920e+05 6.354237e+05 5.060282e+05 5.311870e+05 7.957329e+05 9.225118e+05 6.100767e+05 4.448779e+05 6.037232e+05 6.825562e+05 5.950124e+05 6.849244e+05 5.262670e+05 4.829135e+05 9.134597e+05 6.094656e+05 6.207177e+05 5.481380e+05 1.210389e+06 5.035585e+05 5.306524e+05 7.807842e+05 5.800614e+05 7.423390e+05 6.452008e+05 5.414278e+05 5.095797e+05 5.926874e+05 6.809360e+05 6.593617e+05 5.722737e+05 6.914094e+05 4.893863e+05 7.762112e+05 6.592600e+05 5.206360e+05 3.553121e+05 7.357460e+05 5.356441e+05 6.871126e+05 5.293668e+05 4.990266e+05 9.519277e+05 4.417003e+05 6.873880e+05 5.422945e+05 6.813415e+05 7.259511e+05 5.216902e+05 4.888594e+05 7.278144e+05 6.889499e+05 7.613077e+05 5.142531e+05 6.457753e+05 8.027640e+05 5.764113e+05 6.770732e+05 7.615405e+05 5.547966e+05 6.247280e+05 7.222325e+05 5.048110e+05 6.073742e+05 8.887164e+05 6.642294e+05 5.548341e+05 6.260755e+05 5.413876e+05 4.606441e+05 4.431159e+05 1.126490e+06 5.658405e+05 5.554618e+05 6.691182e+05 1.367681e+06 7.094073e+05 5.929081e+05 6.569025e+05 3.619592e+05 1.080490e+06 "[3-(3,4-methylenedioxyphenyl)-2-(mercaptomethyl)-1-oxoprolyl]alanine_1.747" 1.203749e+05 5.241400e+06 6.056278e+06 6.164633e+06 8.957496e+04 6.252361e+06 6.022986e+06 7.984029e+06 111015.06 5.571314e+06 5.698766e+06 5.097874e+06 86215.54 7.154217e+06 6.569029e+06 5.706692e+06 5.659079e+04 5.061707e+06 5.435943e+06 5.130111e+06 1.180134e+05 9.672066e+06 6.346676e+06 5.922539e+06 60526.091 4.570582e+06 6.844333e+06 7.860740e+06 5.507454e+04 4.549371e+06 4.050091e+06 4.887862e+06 55807.13 8.182522e+06 4.522208e+06 4.218802e+06 4.704105e+04 1.160071e+07 4.988654e+06 4.108391e+06 5.054214e+04 8.923007e+06 4.651025e+06 5.329532e+06 9.724804e+04 5.754123e+06 6.352770e+06 6.774433e+06 6.275906e+06 5.323247e+06 3.520054e+06 4.296600e+06 5.763789e+06 5.324794e+06 6.370450e+06 4.265268e+06 4.980400e+06 6.357188e+06 2.577680e+06 7.162056e+06 3.910091e+06 7.948501e+06 5.941417e+06 4.333214e+06 3.582379e+06 3.828622e+06 5.487481e+06 4.977716e+06 4.953026e+06 5.874342e+06 5.811251e+06 4.277279e+06 6.587823e+06 5.946174e+06 7.388299e+06 7.515024e+06 4.207484e+06 6.391727e+06 1.528547e+05 4.326540e+06 6.419479e+06 5.089830e+06 5.347915e+06 5.966677e+06 3.722316e+06 5.999227e+06 6.658858e+06 1.476758e+07 5.725445e+06 5.438844e+06 5.022901e+06 6.529711e+06 6.725986e+06 5.837402e+06 6.442320e+06 5.251576e+06 4.596785e+06 5.033111e+06 4.637129e+06 6.564749e+06 6.236675e+06 4.271156e+06 6.875728e+06 4.847639e+06 5.368590e+06 4.915426e+06 4.454804e+06 4.656252e+06 1.516358e+07 4.088097e+06 3.976692e+06 7.833425e+06 7.578765e+06 4.168596e+06 6.735308e+06 8.431144e+06 6.160518e+06 6.258670e+06 3.345520e+06 5.751989e+06 4.126869e+06 4.054274e+06 8.639383e+06 3.594987e+06 4.895790e+06 4.468117e+06 5.610043e+06 7.259302e+06 6.397158e+06 4.972017e+06 5.812053e+06 1.487682e+05 6.761458e+06 5.034284e+06 6.453960e+06 7.104070e+06 7.411245e+06 8.741112e+06 6.781983e+06 6.133230e+06 3.934703e+06 6.168525e+06 7.426986e+06 1.386415e+07 6.871017e+06 5.372677e+06 6.419680e+06 4.797881e+06 5.546907e+06 4.518854e+06 5.704176e+06 6.109078e+06 6.739175e+06 6.077669e+06 6.878940e+06 7.402928e+06 4.224476e+06 5.975668e+06 5.538443e+06 5.297512e+06 5.034685e+06 3.974845e+06 5.202075e+06 7.632724e+06 4.296966e+06 6.027320e+06 4.527613e+06 4.424727e+06 4.712723e+06 4.731451e+06 7.222615e+06 7.066286e+06 4.616133e+06 6.043574e+06 6.346057e+06 5.513610e+06 4.565288e+06 4.277781e+06 4.853633e+06 5.708832e+06 4.531880e+06 1.097712e+07 5.525627e+06 5.111467e+06 4.442599e+06 4.432102e+06 6.407963e+06 7.669951e+06 4.883378e+06 3.951125e+06 4.290107e+06 5.686126e+06 6.065362e+06 4.663518e+06 3.402540e+06 6.875632e+06 3.607149e+06 4.950152e+06 6.282292e+06 4.444528e+06 5.397853e+06 4.680575e+06 5.798165e+06 6.090688e+06 7.807740e+06 7.601070e+06 7.270697e+06 6.506903e+06 5.383494e+06 6.285316e+06 5.832872e+06 6.650367e+06 4.982624e+06 4.106175e+06 7.663944e+06 3.956885e+06 4.959605e+06 5.058587e+06 6.318395e+06 5.929442e+06 5.493341e+06 4.852469e+06 5.745209e+06 4.863630e+06 6.671389e+06 6.230904e+06 4.811827e+06 4.298975e+06 5.394374e+06 6.509725e+06 6.611642e+06 4.903257e+06 4.039429e+06 5.526155e+06 8.350342e+06 3.982343e+06 7.460905e+06 4.271557e+06 6.174197e+06 7.119559e+06 4.794941e+06 5.177468e+06 8.869368e+06 8.670405e+06 6.157142e+06 7.087896e+06 6.064589e+06 3.547001e+06 4.424862e+06 4.946286e+06 5.416059e+06 5.252633e+06 5.708005e+06 5.167241e+06 5.817289e+06 5.074322e+06 5.927010e+06 8.698978e+06 8.228529e+06 4.323994e+06 4.041484e+06 5.433468e+06 2-Methyl-5-propionylfuran_1.747 1.986393e+06 5.911308e+07 5.195683e+07 5.926049e+07 8.979765e+05 5.674600e+07 5.519656e+07 7.025218e+07 1381048.91 5.232424e+07 5.933616e+07 6.203523e+07 432535.95 5.624792e+07 5.314474e+07 5.904640e+07 4.769699e+06 5.540635e+07 5.817340e+07 5.680121e+07 2.514980e+06 5.544169e+07 5.695403e+07 6.996813e+07 846915.210 5.265991e+07 5.615057e+07 6.414557e+07 1.842509e+07 4.805622e+07 7.040081e+07 8.184760e+07 20300780.65 6.986005e+06 7.418533e+07 7.069088e+07 4.334800e+06 2.927893e+07 6.955133e+07 7.069704e+07 1.939408e+07 6.797077e+07 3.126508e+07 9.226303e+07 3.210381e+05 1.312991e+07 7.208693e+07 5.891042e+07 7.215681e+07 7.194990e+07 5.956353e+07 1.312601e+08 8.535522e+07 3.793993e+07 8.320380e+07 9.312700e+07 9.040770e+07 8.457485e+07 1.104844e+08 7.701554e+07 1.164754e+08 8.958944e+07 8.881266e+07 1.202717e+08 4.870086e+07 6.276031e+07 6.386701e+07 1.069259e+08 8.995563e+07 8.286348e+07 1.180453e+08 9.790433e+07 1.443839e+08 1.012695e+08 2.792300e+07 5.787376e+07 5.177528e+07 6.204389e+07 3.004222e+07 5.223950e+07 5.437214e+07 5.669802e+07 5.484551e+07 5.869319e+07 4.906945e+07 6.765635e+07 1.101338e+07 3.561862e+07 4.963382e+07 5.490542e+07 7.743961e+07 5.046218e+07 7.056055e+07 4.404241e+07 8.009943e+07 6.056039e+07 7.744182e+07 4.760640e+07 6.329255e+07 5.468476e+07 5.417701e+07 5.346396e+07 3.412531e+07 6.874713e+07 8.674655e+07 6.692424e+07 5.719924e+07 5.720559e+07 1.803513e+07 3.928064e+07 6.192647e+07 7.658497e+07 5.615853e+07 2.137749e+07 5.778229e+07 3.992982e+07 5.537874e+07 5.834406e+07 5.246536e+07 3.488515e+07 4.338746e+07 1.608046e+07 4.379958e+07 4.768923e+07 5.393501e+07 4.570149e+07 6.171129e+07 3.778876e+07 4.939663e+07 4.398260e+07 4.201424e+07 6.745539e+06 6.270451e+07 4.967168e+07 4.528065e+07 2.407530e+07 6.827415e+07 5.587895e+07 4.544333e+07 5.595561e+07 1.224625e+07 7.057673e+07 6.042144e+07 3.469987e+07 4.642076e+07 6.085743e+07 6.855219e+07 5.724656e+07 6.390523e+07 9.191336e+07 5.348956e+07 8.010855e+07 4.503213e+07 5.367898e+07 4.451757e+07 4.929655e+07 7.625795e+07 7.791901e+07 7.965795e+07 4.999513e+07 2.602656e+07 7.250662e+07 5.665367e+07 7.851077e+07 9.183303e+07 5.752158e+07 6.876622e+07 7.855909e+07 3.468049e+07 6.496697e+07 7.041612e+07 6.033315e+07 8.420852e+07 6.471056e+07 1.051864e+08 7.432475e+07 1.151748e+08 1.153250e+08 9.904784e+07 1.020271e+08 3.218547e+07 6.232549e+07 4.683600e+07 4.880379e+07 5.497750e+07 6.880017e+07 5.220290e+07 4.720084e+07 4.566053e+07 2.371509e+07 2.230939e+07 6.170968e+07 2.534535e+07 6.301329e+07 5.298115e+07 4.501757e+07 6.467848e+07 5.696950e+07 5.068205e+07 5.561514e+07 5.116534e+07 5.276702e+07 2.820050e+07 5.177320e+07 5.483860e+07 4.952346e+07 6.542162e+07 4.451776e+07 6.717597e+07 6.383609e+07 2.171013e+07 5.121144e+07 4.637532e+07 5.870093e+07 8.119463e+07 6.581252e+07 1.771371e+07 2.523669e+07 6.602604e+07 5.796464e+07 5.808456e+07 5.338383e+07 4.233630e+07 8.475882e+07 6.174538e+07 7.173998e+07 6.770063e+07 1.787771e+07 6.480077e+07 5.582045e+07 5.491343e+07 9.115409e+07 2.906345e+07 5.327517e+07 2.526359e+07 5.374399e+07 5.040925e+07 5.816628e+07 6.433979e+07 5.023615e+07 6.851167e+07 5.289354e+07 5.848146e+07 7.078489e+07 4.820173e+07 7.320102e+07 6.087048e+07 6.269156e+07 5.073405e+07 7.060011e+07 6.262622e+07 5.452880e+07 5.609268e+07 4.728068e+07 8.073210e+07 3.961302e+07 4.380347e+07 5.779531e+07 4.515452e+07 8.010639e+07 6.217141e+07 5.935831e+07 519.18441_1.747 1.461119e+05 4.216098e+06 4.588514e+06 4.150646e+06 1.038484e+05 5.022697e+06 5.070275e+06 5.569669e+06 112021.06 4.525928e+06 4.130643e+06 5.013682e+06 84789.65 5.238214e+06 4.831794e+06 5.489508e+06 6.157542e+04 3.704143e+06 3.898322e+06 4.041173e+06 1.445999e+05 6.654073e+06 4.784680e+06 4.694139e+06 68492.152 3.146323e+06 6.392593e+06 5.969797e+06 5.901812e+04 3.193923e+06 4.196206e+06 4.668592e+06 71318.60 5.242284e+06 4.272601e+06 3.687925e+06 6.736654e+04 6.025427e+06 4.487773e+06 3.895218e+06 6.188547e+04 6.823997e+06 4.854715e+06 4.523745e+06 1.152760e+05 3.366927e+06 5.676023e+06 4.374063e+06 5.333043e+06 3.905272e+06 1.765220e+06 3.792168e+06 3.581886e+06 4.516268e+06 5.146043e+06 4.596336e+06 4.858189e+06 4.991202e+06 2.916327e+06 4.026302e+06 4.483229e+06 5.037628e+06 5.390588e+06 5.240633e+06 4.821849e+06 4.608160e+06 4.397440e+06 4.232816e+06 5.316994e+06 4.955915e+06 5.402383e+06 4.782536e+06 6.751195e+06 5.974693e+06 3.928863e+06 3.955898e+06 4.190216e+06 6.062864e+06 9.135262e+04 6.503388e+06 4.886282e+06 4.434333e+06 4.102654e+06 7.364890e+06 4.117705e+06 4.872791e+06 3.387025e+06 4.834508e+06 5.817700e+06 6.332630e+06 3.861637e+06 5.441313e+06 4.367511e+06 4.127297e+06 5.742563e+06 4.306514e+06 5.100414e+06 4.022407e+06 4.085021e+06 3.761647e+06 3.922687e+06 2.938509e+06 5.514265e+06 4.989411e+06 4.756163e+06 4.428469e+06 4.036006e+06 3.394228e+06 4.230427e+06 3.189363e+06 3.486281e+06 4.763591e+06 5.443025e+06 3.367644e+06 5.592488e+06 6.461551e+06 3.969460e+06 5.211549e+06 3.297503e+06 5.280116e+06 2.999285e+06 1.534495e+06 3.504921e+06 2.642288e+06 4.560984e+06 3.634044e+06 5.834492e+06 5.114428e+06 3.927850e+06 4.383061e+06 3.736074e+06 6.666810e+04 3.796366e+06 4.241782e+06 5.293117e+06 6.651464e+06 5.423951e+06 5.408857e+06 4.622110e+06 4.987528e+06 4.078140e+06 6.959217e+06 4.027322e+06 4.594596e+06 5.823475e+06 4.103359e+06 4.783552e+06 3.153090e+06 3.995458e+06 5.893895e+06 4.035903e+06 4.953107e+06 4.408265e+06 3.777569e+06 4.723302e+06 5.050735e+06 5.798979e+06 7.153325e+06 6.196518e+06 3.717415e+06 5.438597e+06 3.659742e+06 3.866410e+06 5.449210e+06 3.027763e+06 4.148039e+06 3.883821e+06 4.084453e+06 4.043207e+06 5.222516e+06 4.617155e+06 5.838659e+06 4.310740e+06 4.815610e+06 7.029596e+06 4.706874e+06 3.481529e+06 4.268741e+06 4.342783e+06 4.364224e+06 3.575029e+06 6.297650e+06 4.600595e+06 3.855718e+06 5.264482e+06 5.583577e+06 4.960941e+06 4.858712e+06 3.648981e+06 2.612138e+06 5.069225e+06 4.779595e+06 6.222143e+06 4.516168e+06 3.472958e+06 5.337769e+06 4.502610e+06 4.551835e+06 3.635844e+06 5.196218e+06 4.600685e+06 5.218019e+06 5.861343e+06 5.385431e+06 8.392601e+06 6.005125e+06 4.803294e+06 5.077262e+06 5.913889e+06 6.954836e+06 4.795689e+06 4.703929e+06 5.514206e+06 4.124523e+06 7.346649e+06 4.965912e+06 5.147526e+06 3.395591e+06 5.950131e+06 7.139872e+06 5.719473e+06 3.940512e+06 3.477776e+06 4.333945e+06 5.364655e+06 6.090065e+06 4.641634e+06 4.019115e+06 5.738349e+06 5.250041e+06 6.919892e+06 5.086071e+06 6.225195e+06 4.654708e+06 6.133543e+06 4.181370e+06 6.117156e+06 3.975907e+06 4.794960e+06 7.414164e+06 5.638652e+06 5.279808e+06 6.634149e+06 5.671267e+06 6.964804e+06 6.038580e+06 6.308715e+06 4.188887e+06 4.441049e+06 4.468201e+06 3.536609e+06 3.371978e+06 5.228283e+06 4.966122e+06 6.541029e+06 3.517092e+06 5.777858e+06 3.764224e+06 3.745462e+06 4.203667e+06 4.048328e+06 5.307176e+06 AZELATE 1.317312e+05 5.175741e+05 6.507253e+05 6.483861e+05 9.662121e+04 1.428491e+06 7.266395e+05 9.038800e+05 135237.87 6.913742e+05 6.832352e+05 7.147826e+05 115368.53 6.988840e+05 1.132279e+06 6.894301e+05 1.791097e+06 8.086228e+05 8.741121e+05 5.291225e+05 2.097420e+05 6.756776e+05 9.065630e+05 1.111678e+06 96823.234 6.216306e+05 7.002621e+05 9.604720e+05 7.630647e+04 5.565415e+05 9.906286e+05 7.689360e+05 128873.01 4.479682e+05 9.730021e+05 9.547442e+05 1.466952e+05 8.011720e+05 4.417870e+05 5.835900e+05 1.544790e+05 6.019377e+05 7.918147e+05 1.061268e+06 2.152197e+05 1.001817e+06 9.490940e+05 5.527912e+05 6.997475e+05 1.950239e+06 3.579397e+05 5.000317e+05 7.718036e+05 3.670657e+05 3.510623e+05 5.772750e+05 7.602470e+05 6.873802e+05 4.610394e+05 3.692157e+05 8.576270e+05 8.155501e+05 4.453686e+05 6.802375e+05 1.387932e+06 3.651731e+05 8.447363e+05 6.309290e+05 1.401681e+06 3.279542e+05 6.221443e+05 1.608878e+06 6.664465e+05 9.442022e+05 8.474676e+05 3.855232e+05 7.609806e+05 5.471846e+05 4.196235e+07 6.756586e+05 2.090856e+05 5.808684e+05 2.707494e+05 7.591792e+05 6.761693e+05 7.622332e+05 9.947961e+05 5.302576e+05 5.158514e+05 5.774036e+05 4.566964e+05 1.024804e+06 7.692413e+05 5.749039e+05 8.452826e+05 2.219379e+06 8.296487e+05 6.797398e+05 9.467508e+05 7.103173e+05 5.935581e+05 6.198879e+05 2.429966e+05 6.463945e+05 7.865685e+05 5.734184e+05 6.811938e+05 5.604269e+05 4.156703e+05 2.882684e+05 4.939779e+05 9.230356e+05 2.978850e+06 7.529463e+05 1.351073e+06 4.860627e+05 1.069391e+06 4.150405e+05 4.794456e+05 1.200772e+06 5.656707e+05 5.124856e+05 3.612306e+05 1.113797e+06 9.940735e+05 3.632005e+05 2.505983e+06 3.714673e+05 4.198213e+05 4.362904e+05 1.209009e+06 7.662555e+06 5.820719e+05 4.926662e+05 4.308091e+05 9.145734e+05 6.088769e+05 9.025201e+05 1.943655e+06 7.098703e+05 7.398298e+05 7.072222e+05 7.011099e+05 7.858596e+05 8.889326e+05 9.611688e+05 6.955784e+05 8.419780e+05 3.775318e+05 1.310019e+06 1.771560e+06 7.255557e+05 6.055757e+05 6.584705e+05 6.515001e+05 6.953434e+05 6.673357e+05 1.896870e+06 8.987645e+05 6.349753e+05 9.748953e+05 8.356705e+05 5.978787e+05 7.050918e+05 8.241188e+05 4.122748e+05 6.573762e+05 8.663860e+05 7.856323e+05 9.254308e+05 7.369409e+05 7.387831e+05 7.957575e+05 6.991991e+05 9.643609e+05 7.395424e+05 5.601981e+05 6.255498e+05 5.254482e+05 3.383520e+05 1.274000e+06 3.821235e+05 5.970545e+05 8.308227e+05 6.794852e+05 8.816597e+05 6.955259e+05 4.013782e+05 2.991606e+06 6.899229e+05 6.130936e+05 5.483572e+05 3.800824e+05 7.896787e+05 1.307082e+06 6.013078e+05 1.119596e+06 6.391595e+05 4.400687e+05 8.331647e+05 6.788421e+05 9.934844e+05 6.831032e+05 1.777647e+06 6.012812e+05 7.385291e+05 6.089051e+05 2.677894e+05 9.386273e+05 6.749460e+05 4.900264e+05 5.668789e+05 5.032527e+05 6.797674e+05 6.547775e+05 5.157639e+05 6.501767e+05 7.754995e+05 1.105457e+06 1.202446e+06 7.387379e+05 6.994640e+05 4.620649e+05 7.736538e+05 9.514540e+05 1.332748e+06 1.153092e+06 8.940384e+05 7.422867e+05 7.812352e+05 5.019786e+05 8.918529e+05 8.249356e+05 4.985863e+05 5.782226e+05 4.352166e+05 3.879337e+05 5.075266e+05 1.088144e+06 7.545706e+05 1.276692e+06 4.633387e+05 7.936146e+05 5.843735e+05 6.377746e+05 5.439317e+05 6.990179e+05 2.816184e+05 5.987228e+05 7.030456e+05 8.440437e+05 7.506556e+05 1.362710e+06 7.677951e+05 6.577781e+05 7.521355e+05 6.447031e+05 8.946255e+05 3.649590e+05 5.700955e+05 8.004514e+05 7.323760e+05 Indole-3-carboxilic acid-O-sulphate (1)_1.747 1.662695e+05 2.512964e+06 1.654987e+06 2.145988e+06 1.225796e+05 3.871732e+06 2.605935e+06 2.135940e+06 146745.30 2.876787e+06 2.502647e+06 2.896381e+06 109882.24 2.346065e+06 3.929551e+06 1.572610e+06 7.802123e+04 1.854126e+06 1.783607e+06 2.014358e+06 1.616826e+05 4.742977e+06 2.588223e+06 2.263980e+06 74208.470 1.950379e+06 3.474143e+06 3.362845e+06 6.806134e+04 1.073083e+06 1.639985e+06 6.454953e+06 76471.76 4.279749e+06 1.873664e+06 1.774974e+06 8.125194e+04 3.071909e+06 2.835787e+06 2.486514e+06 6.999223e+04 2.839768e+06 1.857813e+06 2.022088e+06 1.119329e+05 4.108416e+06 3.298079e+06 1.080485e+06 8.848631e+05 2.301800e+06 2.608520e+06 4.604378e+06 6.338461e+05 6.172075e+06 3.617555e+06 5.537656e+06 2.996376e+06 3.157895e+06 5.196484e+06 5.741392e+06 1.689592e+06 2.090928e+06 3.539848e+06 2.850548e+06 3.151666e+06 2.356523e+06 1.379307e+06 1.896438e+06 2.443463e+06 3.932474e+06 1.897947e+06 5.450966e+06 1.416514e+06 2.547478e+06 1.504450e+06 1.992705e+06 2.470918e+06 4.242995e+06 1.171581e+05 1.277635e+06 6.577921e+06 2.753875e+06 2.390773e+06 3.088423e+06 2.439278e+06 7.576000e+05 1.599573e+06 3.861510e+06 2.760210e+06 2.710489e+06 5.711704e+05 2.147892e+06 2.214122e+06 2.663466e+06 8.811772e+05 2.288869e+06 2.427415e+06 1.164905e+07 2.639553e+06 9.611237e+05 9.323373e+05 3.349328e+06 3.421459e+06 3.540124e+06 4.739049e+05 3.618656e+06 2.108646e+06 1.533559e+06 4.607932e+06 1.459536e+06 1.866987e+06 2.027429e+06 3.876939e+06 1.944597e+06 2.097157e+06 3.246766e+06 5.761191e+06 2.769333e+06 1.830847e+06 2.413429e+06 2.309456e+06 8.117191e+05 2.896567e+06 1.313570e+06 7.472155e+05 8.441918e+05 2.639248e+06 2.803930e+06 1.342153e+06 2.315866e+06 3.295622e+06 7.394977e+04 3.671469e+06 7.197240e+06 2.890842e+06 6.221009e+05 3.021222e+06 3.472005e+06 3.985392e+06 7.667465e+06 1.961999e+06 2.712200e+06 2.853411e+06 2.278314e+06 3.225688e+06 1.240147e+06 1.701140e+06 9.846129e+05 1.702314e+06 1.985233e+06 1.833490e+06 1.005657e+06 2.205727e+06 1.675229e+06 2.280824e+06 2.851055e+06 1.919998e+06 7.268315e+05 7.297519e+06 1.941932e+06 2.155960e+06 1.992158e+06 1.791132e+06 1.958432e+06 6.483404e+05 1.622986e+06 2.169565e+06 1.649199e+06 1.467717e+06 3.058416e+06 1.271435e+06 2.989066e+06 1.549606e+06 2.821149e+06 2.195663e+06 2.027152e+06 1.837210e+06 2.970955e+06 6.860916e+06 2.444431e+06 1.951180e+06 2.711547e+06 2.237837e+06 1.620983e+06 2.544019e+06 2.275082e+06 1.918165e+06 5.194361e+06 1.083716e+06 1.340704e+06 1.368415e+06 2.758346e+06 3.479714e+06 5.812254e+06 1.016470e+06 2.611170e+06 2.084701e+06 1.197482e+06 6.872473e+05 1.996487e+06 5.952412e+06 2.453420e+06 3.784138e+06 2.073182e+06 2.584407e+06 1.001409e+07 2.183084e+06 2.509244e+06 2.128260e+06 3.016718e+06 3.579905e+06 1.946758e+06 2.912728e+06 1.826841e+06 3.277745e+06 1.802262e+06 1.146513e+06 1.633844e+06 2.921096e+06 9.532103e+06 2.424500e+06 1.770938e+06 2.920251e+06 1.725391e+06 1.863602e+06 1.947789e+06 1.543180e+06 1.826558e+06 2.494137e+06 2.093143e+06 2.179856e+06 6.894729e+06 6.361990e+06 1.936021e+06 2.599136e+06 9.795354e+06 2.643629e+06 2.246901e+06 2.562400e+06 2.873165e+06 1.484218e+06 1.737047e+06 4.112479e+06 2.615418e+06 3.157296e+06 2.808532e+06 2.645150e+06 5.246620e+06 2.219148e+06 2.721109e+06 2.358716e+06 1.202682e+06 2.491813e+06 2.544740e+06 7.822022e+06 1.438722e+06 3.243739e+06 1.098210e+06 2.488759e+06 1.355724e+06 1.478653e+06 1.714260e+06 "5,8,12-Trihydroxy-2-oxododecanoic acid_1.747" 4.059603e+05 2.884271e+07 2.784630e+07 2.599699e+07 2.334975e+05 2.554721e+07 2.572460e+07 3.315389e+07 350630.99 2.664564e+07 2.938772e+07 2.789087e+07 313212.88 2.782748e+07 2.373824e+07 2.866294e+07 2.627542e+05 2.798684e+07 2.720572e+07 2.724685e+07 5.942386e+05 2.659268e+07 2.729576e+07 3.057006e+07 266308.290 2.637160e+07 3.028903e+07 2.814735e+07 2.482770e+05 2.418385e+07 2.837219e+07 3.149504e+07 349016.14 2.178114e+07 3.072655e+07 2.892400e+07 4.142787e+05 2.243409e+07 2.829696e+07 2.883521e+07 3.773062e+05 2.460327e+07 3.016719e+07 3.769717e+07 5.789325e+05 1.855746e+07 3.472913e+07 1.972410e+07 2.003458e+07 1.302331e+07 1.209035e+07 2.243503e+07 1.957579e+07 1.869080e+07 1.687745e+07 1.990838e+07 1.743374e+07 2.165349e+07 2.019910e+07 1.840607e+07 3.027986e+07 1.845455e+07 2.031836e+07 1.646364e+07 1.797368e+07 1.344953e+07 2.370957e+07 2.229647e+07 2.139433e+07 2.167076e+07 2.903092e+07 3.404659e+07 4.200790e+07 2.312688e+07 1.643320e+07 2.060210e+07 1.864078e+07 2.457917e+07 2.079948e+07 1.833508e+07 1.915839e+07 1.794050e+07 8.673214e+06 1.350814e+07 1.408075e+07 2.329447e+07 1.420746e+07 9.129811e+06 1.427637e+07 2.061618e+07 1.935323e+07 1.904596e+07 1.930311e+07 1.885550e+07 1.516555e+07 1.688940e+07 2.146710e+07 1.650269e+07 2.643377e+07 2.182845e+07 1.884792e+07 1.818181e+07 1.336251e+07 2.083964e+07 1.668022e+07 1.955153e+07 1.512372e+07 2.207665e+07 5.048006e+06 8.964739e+06 1.284562e+07 2.441814e+07 2.736260e+07 1.004333e+07 2.285944e+07 1.501297e+07 1.808019e+07 1.842771e+07 1.252710e+07 1.598977e+07 8.855735e+06 8.847002e+06 1.071213e+07 7.469711e+07 1.257543e+07 1.488353e+07 2.150038e+07 1.445548e+07 1.598190e+07 1.428189e+07 1.659615e+07 1.589383e+06 1.540146e+07 1.398304e+07 1.354667e+07 1.496568e+07 2.883444e+07 2.008583e+07 1.500522e+07 1.492860e+07 6.647369e+06 4.058175e+07 1.968390e+07 7.380431e+06 1.290614e+07 1.737255e+07 9.291215e+06 1.522586e+07 1.429618e+08 1.970525e+07 1.465749e+07 1.851718e+07 1.384657e+07 2.176172e+07 1.875262e+07 2.505972e+07 2.118350e+07 1.966253e+07 2.242028e+07 2.901498e+07 2.224673e+07 2.259687e+07 1.343470e+07 2.446224e+07 1.299774e+07 1.583789e+07 1.178504e+07 1.584317e+07 1.250904e+07 1.633627e+07 2.085390e+07 1.712303e+07 1.131167e+07 1.493602e+07 2.725080e+07 2.233436e+07 1.987032e+07 2.092410e+07 1.850029e+07 3.324481e+07 7.446961e+07 9.356785e+07 3.161809e+07 5.874093e+07 3.640087e+07 3.883494e+07 3.551111e+07 2.785568e+07 6.926761e+07 1.516696e+07 6.568697e+07 4.115457e+07 3.457724e+07 3.403065e+07 1.128953e+08 3.173035e+07 8.715069e+07 7.101790e+07 3.027164e+07 7.113397e+07 6.442351e+07 6.540047e+07 1.762339e+07 3.311637e+07 4.119966e+07 2.980144e+07 3.883768e+07 2.572736e+07 4.655522e+07 4.190214e+07 2.613574e+07 3.033848e+07 2.754203e+07 3.476532e+07 4.520515e+07 4.115117e+07 9.227137e+07 3.819594e+07 5.273296e+07 4.175527e+07 4.531493e+07 3.170552e+07 2.391079e+07 4.418546e+07 4.766880e+07 6.233238e+07 3.394938e+07 7.972890e+07 4.132156e+07 3.699457e+07 3.753918e+07 4.457359e+07 3.809936e+07 3.871164e+07 3.385053e+07 2.988497e+07 3.264717e+07 3.355489e+07 3.470128e+07 2.010068e+07 2.587449e+07 1.971374e+07 2.280596e+07 2.614575e+07 1.529159e+07 1.602614e+07 1.681305e+07 1.207348e+07 1.509965e+07 2.337324e+07 1.833570e+07 2.319586e+07 2.498656e+07 1.686318e+07 3.292763e+07 1.049955e+07 1.183731e+07 1.966588e+07 9.397170e+07 2.372916e+08 1.649967e+07 2.402389e+07 C11 H28 N8 O P2 S_1.748 3.500077e+04 1.773074e+06 1.816752e+06 9.474631e+05 2.958877e+04 1.308177e+06 1.682430e+06 1.297265e+06 68943.41 1.839840e+06 1.483830e+06 2.209856e+06 87195.36 5.303967e+05 1.191397e+06 2.374298e+06 8.171546e+04 9.900490e+05 1.943662e+06 1.370263e+06 2.162532e+05 6.966939e+05 1.858486e+06 1.779160e+06 79621.022 8.239283e+05 2.240280e+06 2.036568e+06 6.100427e+04 4.947114e+05 1.627650e+06 2.154123e+06 77073.07 5.963022e+05 2.160958e+06 1.730503e+06 9.115298e+04 6.116182e+05 2.456352e+06 9.683848e+05 9.584301e+04 5.148874e+05 2.018385e+06 2.780988e+06 1.266187e+05 6.143673e+05 1.471724e+06 1.401049e+06 1.910838e+06 8.940658e+05 4.776747e+05 1.554094e+06 1.167267e+06 1.522874e+06 1.102260e+06 8.430139e+05 1.018041e+06 1.907644e+06 7.806975e+05 1.979845e+06 1.206470e+06 1.279833e+06 1.594435e+06 1.508482e+06 1.329681e+06 1.345092e+06 1.438276e+06 6.432163e+05 1.342043e+06 1.442557e+06 3.243497e+06 1.182285e+06 1.959111e+06 3.080081e+06 6.103302e+05 2.127833e+06 9.458746e+05 2.931972e+06 1.156042e+05 2.253612e+06 2.101102e+06 2.553793e+06 7.919729e+05 2.502456e+06 1.952884e+06 1.072542e+06 6.696997e+05 8.063881e+05 1.970377e+06 1.353360e+06 1.019327e+06 2.255451e+06 6.936892e+05 1.876676e+06 2.652387e+06 2.302528e+06 2.593260e+06 1.347815e+06 2.052146e+06 7.048276e+05 5.858632e+05 7.142350e+05 7.472466e+05 1.349683e+06 6.520329e+05 1.898225e+06 8.778253e+05 8.784132e+05 4.995484e+05 2.091524e+06 7.983997e+05 8.567996e+05 9.448859e+05 1.043840e+06 4.648180e+06 1.187737e+06 2.534514e+06 1.765357e+06 5.464229e+05 6.495929e+05 6.897176e+05 5.005293e+05 6.526358e+05 3.269363e+05 9.209026e+05 1.489654e+06 2.259410e+06 9.739416e+05 1.638132e+06 3.003028e+06 7.340682e+05 8.565209e+04 1.734090e+06 1.542011e+06 1.862365e+06 1.281840e+06 1.688090e+06 6.659789e+05 9.628158e+05 1.885382e+06 4.483931e+05 1.529993e+06 2.547671e+06 9.888926e+05 2.107154e+06 8.464949e+05 1.172426e+06 9.384646e+05 8.277941e+05 2.551644e+06 1.965331e+06 1.356596e+06 8.180904e+05 7.660971e+05 8.332744e+05 1.722166e+06 1.531398e+06 3.234028e+06 1.828552e+06 5.025701e+05 1.474731e+06 1.441925e+06 1.127319e+06 2.278543e+06 5.891074e+05 6.830318e+05 2.163557e+06 7.286546e+05 8.154408e+05 1.109476e+06 2.328317e+06 1.047269e+06 6.989613e+05 8.943221e+05 2.140784e+06 2.836766e+06 5.362972e+05 1.535973e+06 9.777405e+05 1.179644e+06 2.547094e+06 8.010359e+05 2.244703e+06 2.931208e+06 2.630505e+06 1.395806e+06 9.664020e+05 1.865405e+06 3.348699e+06 9.541408e+05 2.055787e+06 2.722099e+06 1.040775e+06 1.884917e+06 1.169244e+06 1.397938e+06 2.985934e+06 4.518650e+06 7.379906e+05 5.364000e+06 5.822442e+06 4.711180e+06 1.318819e+06 2.279838e+06 1.963470e+06 2.864538e+06 9.282062e+05 4.705710e+05 2.333951e+06 2.164749e+06 1.931738e+06 6.696378e+05 1.547078e+06 1.558865e+06 2.647625e+06 2.042611e+06 3.844643e+06 1.062172e+06 3.620390e+06 2.350484e+06 2.738346e+06 9.585097e+05 7.065439e+05 2.600770e+06 3.099681e+06 2.384606e+06 1.140937e+06 1.818802e+06 1.680186e+06 2.166893e+06 2.506435e+06 1.259772e+06 1.951591e+06 2.852273e+06 1.629593e+06 2.041743e+06 1.226088e+06 1.726682e+06 1.529268e+06 8.278586e+05 9.407214e+05 2.100121e+06 2.931365e+06 1.114940e+06 2.964914e+06 1.780893e+06 1.338240e+06 2.747346e+06 2.203473e+06 1.993636e+06 4.373815e+06 6.026188e+05 4.256969e+06 1.211659e+06 2.951204e+06 7.260706e+05 2.019084e+06 1.881424e+06 3.978158e+05 9.839768e+05 2.479498e+06 2.617338e+06 C25 H22 N6 O4_1.748 5.181110e+04 1.257409e+05 2.448090e+05 3.450435e+05 3.989171e+04 2.520645e+05 2.331736e+05 4.931824e+05 60254.45 1.292743e+05 2.339601e+05 2.758963e+05 62985.67 3.362862e+05 1.453309e+05 3.278357e+05 5.307573e+04 2.598586e+05 1.372967e+05 2.617491e+05 1.116939e+05 1.245887e+05 3.384495e+05 3.181734e+05 48167.412 1.832498e+05 2.674194e+05 2.871635e+05 4.777986e+04 1.527136e+05 3.134937e+05 2.494140e+05 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9.882230e+04 1.015315e+05 1.517649e+05 1.397340e+05 1.552096e+05 1.204912e+05 1.488468e+05 1.641963e+05 2.118943e+05 1.162554e+05 2.341757e+05 1.761089e+05 1.138469e+05 2.143727e+05 1.741998e+05 2.148499e+05 1.867005e+05 3.214546e+05 1.769664e+05 2.242799e+05 1.387208e+05 8.872355e+04 1.579293e+05 2.186272e+05 1.408560e+05 1.080471e+05 1.029483e+05 1.441618e+05 1.428054e+05 1.413682e+05 2.087105e+05 1.388576e+05 5.470408e+05 4.935459e+05 1.231349e+05 1.080915e+05 1.164733e+05 1.608961e+05 1.322000e+05 1.995999e+05 1.780164e+05 1.732681e+05 1.513693e+05 1.043908e+05 1.295040e+05 1.650936e+05 1.837860e+05 1.440183e+05 1.912116e+05 1.491510e+05 1.186947e+05 1.440982e+05 1.386703e+05 1.215834e+05 1.998184e+05 2.313466e+05 2.280797e+05 1.228717e+05 2.080760e+05 2.194146e+05 2.268245e+05 1.748481e+05 1.227345e+05 1.753714e+05 2.366228e+05 1.636108e+05 1.288568e+05 9.657618e+04 2.302607e+05 3.775437e+05 9.447987e+04 2.141014e+05 1.135327e+05 1.612902e+05 2.197856e+05 1.722879e+05 C20 H43 N O8_1.748 6.793871e+04 2.341770e+06 2.456375e+06 1.221742e+06 5.467490e+04 2.051445e+06 1.975314e+06 1.647520e+06 89590.59 2.224498e+06 2.172607e+06 2.153074e+06 74856.79 2.019803e+06 1.833834e+06 2.268732e+06 5.441098e+04 1.933050e+06 1.857295e+06 2.367673e+06 1.282019e+05 1.626197e+06 1.914191e+06 2.118606e+06 57250.167 2.028615e+06 2.276647e+06 2.213633e+06 5.134126e+04 1.356658e+06 2.396271e+06 2.049158e+06 71308.70 1.767241e+06 2.204414e+06 1.539992e+06 8.615713e+04 2.081207e+06 2.862813e+06 2.266810e+06 9.598558e+04 1.301048e+06 9.628614e+05 3.120671e+06 1.507695e+05 1.594182e+06 2.795770e+06 1.440584e+06 2.017675e+06 2.196787e+06 3.420685e+05 8.575739e+05 3.713782e+05 1.525230e+06 6.050830e+05 1.076936e+06 7.310217e+05 6.119226e+05 4.275418e+05 2.262089e+06 1.554091e+06 1.282281e+06 9.264571e+05 8.982879e+05 8.115651e+05 3.018849e+06 2.294671e+06 2.681142e+05 6.141438e+05 4.997473e+05 7.903915e+05 6.470092e+05 1.246774e+06 7.241296e+05 1.503052e+06 1.530598e+06 1.772610e+06 2.495333e+06 8.127748e+04 2.801014e+06 2.747972e+06 2.527293e+06 1.103424e+06 2.184864e+06 1.605112e+06 3.011064e+06 8.120582e+05 6.663277e+05 1.226486e+06 2.083851e+06 2.365130e+06 2.497448e+06 1.566326e+06 9.194401e+05 3.864778e+06 1.604056e+06 1.979985e+06 2.857605e+06 6.730938e+05 8.444309e+05 9.575465e+05 6.505868e+05 1.557416e+06 1.037319e+06 8.316041e+05 1.883427e+06 5.001191e+05 1.611604e+06 5.409294e+05 5.530140e+05 1.767111e+06 2.485203e+06 2.007731e+06 1.838350e+06 2.995969e+06 8.889963e+05 3.645814e+06 2.427362e+06 7.455973e+05 2.370331e+06 1.043827e+06 6.689076e+05 1.117936e+06 2.308618e+06 2.923005e+06 2.217162e+06 4.564336e+06 1.579099e+06 1.134143e+06 2.334829e+06 1.897883e+06 1.481399e+05 2.077330e+06 2.117743e+06 2.187914e+06 2.426012e+06 3.320602e+06 2.761496e+06 1.669386e+06 2.472441e+06 4.727120e+05 3.261053e+06 3.248115e+06 3.327805e+05 5.993723e+05 4.683334e+05 6.265085e+05 2.089133e+05 5.868294e+05 6.976123e+05 4.896233e+05 6.712077e+05 5.283125e+05 1.479982e+06 1.340514e+06 9.213216e+05 2.654343e+06 3.815640e+06 3.564357e+06 2.508317e+06 1.396325e+06 2.157361e+06 7.552470e+05 3.205517e+06 2.219096e+06 1.697783e+06 1.095884e+06 1.683650e+06 1.933119e+06 1.423264e+06 2.114728e+06 1.449230e+06 2.312723e+06 1.518905e+06 3.923899e+06 2.196991e+06 4.744616e+05 7.182275e+05 7.809066e+05 5.629167e+05 6.611542e+05 1.292089e+06 1.681417e+06 1.058804e+06 2.010857e+06 2.528073e+06 1.646986e+06 1.738498e+06 7.470057e+05 1.241492e+06 9.495271e+05 1.065300e+06 8.673481e+05 3.160166e+06 3.096104e+06 2.405349e+06 2.435920e+06 1.134272e+06 6.928709e+05 1.069751e+06 2.502937e+06 2.163455e+06 1.579370e+06 1.729496e+06 1.838010e+06 6.935873e+05 1.676349e+06 8.340548e+05 2.995247e+06 2.335463e+06 8.235286e+05 1.654911e+06 1.869687e+06 1.865517e+06 4.555779e+06 1.331653e+06 4.406607e+06 3.455551e+06 1.768002e+06 3.366628e+06 2.725849e+06 1.739337e+06 7.164023e+05 4.079591e+06 3.324609e+06 4.969588e+06 3.680057e+06 5.443567e+06 3.384075e+06 1.955671e+06 2.840711e+06 3.098607e+06 1.211004e+06 2.903784e+06 2.282477e+06 9.390429e+05 9.157028e+05 1.120326e+06 2.165376e+06 2.023498e+06 2.443397e+06 5.120050e+06 5.717044e+06 7.685031e+06 2.072410e+06 3.586103e+06 6.168167e+06 4.464083e+06 4.334714e+06 6.851571e+06 5.397458e+06 5.723090e+05 6.318832e+06 1.735350e+06 1.143917e+07 6.916933e+05 7.516482e+05 6.392088e+05 5.572616e+05 5.260179e+06 3.989516e+06 4.876809e+06 C35 H36 Cl N O3 S_1.748 7.572387e+04 3.010961e+05 5.514463e+05 3.063394e+05 5.913253e+04 3.365343e+05 3.057468e+05 3.550187e+05 83753.84 2.963250e+05 5.108953e+05 4.910988e+05 71658.97 3.112563e+05 3.923495e+05 3.790710e+05 1.091446e+05 2.508166e+05 3.027155e+05 3.822026e+05 1.949827e+05 3.683698e+05 3.492346e+05 4.043464e+05 77014.666 3.468534e+05 3.760145e+05 5.357082e+05 6.282577e+04 3.063120e+05 3.141273e+05 4.400674e+05 87385.61 2.225973e+05 4.611898e+05 3.146632e+05 1.002997e+05 3.464640e+05 3.800310e+05 3.980056e+05 8.585324e+04 1.913772e+05 3.893142e+05 4.069383e+05 1.381223e+05 1.919493e+05 3.242279e+05 3.573860e+05 2.420642e+05 1.297782e+05 2.191562e+05 1.897206e+05 1.624832e+05 1.683015e+05 1.905678e+05 2.951573e+05 2.145373e+05 2.257484e+05 1.940050e+05 1.399026e+05 2.068592e+05 2.331960e+05 1.765492e+05 1.895668e+05 2.062926e+05 1.857368e+05 2.286010e+05 1.915526e+05 2.000207e+05 2.016667e+05 1.982817e+05 2.314336e+05 2.893314e+05 3.308904e+05 1.671925e+05 1.479399e+05 2.114305e+05 2.543770e+05 9.300214e+04 3.143078e+07 1.268298e+05 2.059813e+05 1.343221e+05 1.714302e+05 1.697714e+05 1.769643e+05 1.723548e+05 1.190011e+05 1.921358e+05 1.894768e+05 3.841484e+06 1.290318e+05 1.728062e+05 1.115805e+05 2.322884e+05 1.923675e+05 2.096347e+05 1.457696e+05 1.720594e+05 1.407185e+05 9.184411e+05 1.395082e+05 1.508223e+05 1.589688e+05 1.676730e+05 1.945837e+05 1.654867e+05 1.481973e+05 1.197359e+05 1.417614e+05 1.475525e+05 2.110200e+05 1.850794e+05 1.442508e+05 1.559977e+05 1.296988e+05 2.071828e+05 1.671376e+05 1.363713e+05 1.823835e+05 1.638514e+05 1.251376e+05 1.397019e+05 1.326627e+05 1.549163e+05 1.605630e+05 1.779700e+05 2.458258e+05 1.105940e+05 1.265104e+05 1.471522e+05 9.035613e+04 2.045180e+05 1.647625e+05 1.216595e+05 2.257463e+05 2.210141e+05 1.281155e+06 1.521924e+05 1.131091e+07 1.612689e+05 2.078205e+05 1.734266e+05 1.410295e+05 1.435559e+05 1.738724e+05 7.024386e+06 1.535735e+05 1.516052e+05 2.019349e+05 3.454048e+06 1.888301e+05 1.884576e+05 1.477085e+05 1.667312e+05 1.439780e+05 2.326191e+05 1.932146e+05 2.747081e+05 1.296976e+05 1.871075e+05 1.722926e+05 1.766131e+05 2.154565e+05 1.692458e+05 1.332643e+05 1.583531e+05 1.659631e+05 2.015074e+06 1.586876e+05 1.618458e+05 2.025760e+05 1.522334e+05 1.659739e+05 2.544281e+05 1.207889e+05 2.119910e+07 1.950152e+05 2.119673e+05 2.045568e+05 2.389920e+05 2.427722e+05 1.851385e+05 1.831236e+05 1.832055e+05 3.673713e+07 1.465579e+05 2.310472e+05 7.481462e+05 1.676091e+05 2.098280e+05 1.509085e+05 3.324057e+06 1.909472e+05 2.466248e+05 1.486567e+05 3.207149e+05 2.351183e+05 1.481085e+05 3.051005e+05 2.040029e+05 3.730073e+05 2.174047e+05 1.283251e+05 1.559535e+06 1.569150e+05 1.680923e+05 1.856765e+07 2.745121e+05 1.957319e+05 1.685131e+05 1.790030e+05 1.603537e+05 1.870567e+05 5.603686e+06 2.217572e+05 3.142130e+05 1.724495e+05 2.476874e+05 2.279773e+05 6.829892e+06 1.283636e+05 2.104578e+07 2.176831e+05 2.307071e+05 2.388703e+05 1.412226e+06 1.287130e+06 6.793546e+06 1.567214e+05 2.235797e+05 4.738756e+06 2.289237e+05 2.303905e+05 1.943656e+05 1.739310e+05 1.776490e+05 1.952944e+05 1.503902e+05 1.641601e+05 1.186774e+07 1.680008e+05 5.955566e+06 1.837739e+05 1.710857e+05 8.832798e+06 8.728056e+06 1.913365e+05 1.825869e+05 2.041054e+05 1.517201e+05 1.611159e+05 1.665348e+05 1.387381e+05 2.204463e+05 1.506752e+05 1.395707e+05 1.199591e+07 1.425280e+05 1.867548e+05 1.978762e+05 2.187492e+05 Bilirubin_1.749 1.751567e+07 7.372369e+06 5.397733e+06 5.304028e+06 1.180231e+05 4.304461e+06 2.575423e+06 4.987833e+06 178408.94 6.093775e+06 5.511535e+06 5.457911e+06 133569.35 6.309438e+06 4.278903e+06 5.218842e+06 9.707145e+04 5.906934e+06 5.604739e+06 5.157588e+06 2.613332e+05 5.342714e+06 5.844218e+06 1.931812e+06 138489.195 6.316521e+06 6.044271e+06 5.858111e+06 1.138021e+05 4.712296e+06 6.074643e+06 5.555924e+06 152284.70 4.846027e+06 5.931330e+06 3.553594e+06 1.793247e+05 4.841885e+06 5.863861e+06 5.348745e+06 1.628841e+05 5.403941e+06 5.689031e+06 8.098098e+06 2.711001e+05 2.881107e+06 4.467298e+06 5.469580e+06 4.615376e+06 5.007052e+06 5.187278e+06 4.079027e+06 2.292841e+06 2.024498e+06 8.333495e+06 8.054363e+06 2.381973e+06 4.309992e+06 1.530942e+06 4.591104e+06 2.273922e+07 1.824870e+07 6.572189e+06 5.209727e+06 1.298884e+07 4.171140e+06 1.790539e+06 2.004909e+07 5.810505e+06 1.252713e+07 1.936382e+07 1.737656e+07 1.252047e+07 6.718223e+06 5.092021e+06 6.246777e+06 7.157002e+06 5.315804e+06 2.919063e+07 9.833337e+06 5.868340e+06 3.676136e+06 3.890611e+06 4.272013e+06 1.951051e+07 3.347372e+06 3.583071e+06 8.753777e+05 6.582883e+06 1.046333e+07 6.254014e+06 4.652912e+06 1.831672e+06 4.294944e+06 2.930223e+06 5.463610e+06 1.320271e+06 2.561546e+07 3.375668e+06 9.223921e+06 1.311015e+06 3.209792e+06 2.345226e+07 2.133107e+06 6.315499e+06 6.744959e+06 4.809258e+06 4.436520e+06 3.404712e+07 5.834021e+06 2.829982e+06 2.144573e+06 2.225154e+06 7.270125e+06 2.399834e+06 7.138119e+06 9.481928e+06 2.950531e+06 5.115918e+06 2.824121e+07 4.801556e+06 3.060392e+06 1.321207e+06 2.695158e+06 2.493216e+06 3.557404e+06 4.919843e+06 4.805573e+06 4.740286e+06 9.357620e+06 1.069108e+07 1.407405e+06 1.360343e+07 1.651051e+07 1.231751e+07 3.280304e+06 1.567541e+07 4.376361e+06 3.882821e+06 2.498713e+07 2.938218e+06 6.718101e+06 4.390259e+06 6.529756e+06 5.443749e+06 2.453699e+06 1.178119e+06 2.154828e+06 4.759520e+06 3.487154e+06 4.277360e+06 2.091086e+06 7.843379e+05 8.761686e+06 4.849869e+06 5.045006e+06 6.127872e+06 3.917445e+06 6.720390e+06 1.164831e+07 2.431964e+06 1.136820e+07 4.308254e+06 4.034850e+06 1.734213e+06 1.995506e+07 2.000333e+07 6.613865e+06 2.086094e+06 6.383360e+06 1.203610e+07 1.003753e+07 8.986961e+06 8.704541e+06 7.546948e+06 1.457453e+06 6.025476e+06 3.375431e+06 4.450168e+06 3.134140e+06 1.800680e+06 3.675488e+06 1.861338e+06 6.625410e+05 8.131147e+06 2.874785e+06 8.636350e+06 2.053210e+06 9.528880e+06 5.835408e+06 8.120048e+06 3.343303e+06 1.586520e+06 1.597823e+06 1.022023e+07 4.976212e+06 6.559309e+06 3.653421e+06 3.843719e+06 9.542715e+06 2.256692e+06 2.867993e+06 5.459407e+06 9.577598e+06 4.461915e+06 2.629492e+06 6.885551e+06 4.354710e+06 1.566028e+07 2.869344e+06 2.334294e+07 4.355699e+06 7.131906e+06 3.913857e+06 8.093915e+06 3.895605e+06 5.481292e+06 3.822648e+06 2.072517e+06 2.037703e+07 6.240160e+06 2.998935e+06 3.792295e+06 3.546980e+06 3.411498e+06 6.758583e+06 1.799508e+06 4.805799e+06 2.704917e+06 3.395445e+06 8.611626e+06 1.039790e+07 5.556742e+06 3.792176e+06 6.752151e+06 3.221068e+06 4.783633e+06 1.733939e+07 4.204372e+06 1.427737e+07 1.060753e+07 2.276949e+07 4.406904e+06 1.332351e+07 4.921329e+06 1.745836e+07 7.897663e+06 1.206197e+07 5.743031e+06 1.324078e+06 5.826790e+06 1.629781e+07 6.491781e+06 5.512180e+06 1.958932e+07 4.139631e+07 1.731398e+07 1.489639e+07 1.923066e+06 2.016985e+06 1.409592e+07 1.846600e+07 C13 H31 N4 O7 P_1.749 1.263022e+05 8.707364e+05 9.693907e+05 7.654447e+05 9.725810e+04 5.685486e+05 6.561925e+05 1.502851e+06 135413.13 4.999847e+05 5.973421e+05 1.070804e+06 123803.25 9.839228e+05 5.558745e+05 9.335503e+05 1.499319e+05 7.435498e+05 6.597981e+05 8.290690e+05 3.021768e+05 7.941171e+05 8.654284e+05 8.895935e+05 135400.352 7.716291e+05 1.000740e+06 1.002540e+06 1.241082e+05 4.201426e+05 8.842901e+05 1.016607e+06 172532.67 7.257761e+05 8.332084e+05 9.927952e+05 1.979471e+05 5.451566e+05 7.203114e+05 9.175919e+05 1.586786e+05 7.153611e+05 7.219020e+05 1.351731e+06 1.970184e+05 6.406515e+05 7.948018e+05 7.236217e+05 6.200779e+05 4.688020e+05 5.488485e+05 6.904200e+05 4.568828e+05 1.107601e+06 8.950105e+05 6.344602e+05 6.905558e+05 8.213053e+05 9.446830e+05 7.032193e+05 1.516138e+06 1.312769e+06 8.595544e+05 1.003387e+06 8.236147e+05 4.178500e+05 1.139049e+06 9.190514e+05 7.140952e+05 7.908029e+05 7.966946e+05 8.471741e+05 1.278354e+06 9.268183e+05 6.253323e+05 5.708710e+05 8.841056e+05 1.215181e+06 3.167470e+06 1.455478e+06 6.949876e+05 7.741028e+05 4.006272e+05 5.123406e+05 5.064541e+05 5.094159e+05 4.113589e+05 2.049993e+05 6.390055e+05 8.161149e+05 8.202353e+05 4.559697e+05 7.368818e+05 5.933181e+05 8.050368e+05 5.280375e+05 9.236474e+05 8.260360e+05 4.452695e+05 1.028562e+06 8.423330e+05 5.388504e+05 6.273015e+05 7.694206e+05 8.368550e+05 9.499644e+05 3.302621e+05 7.181983e+05 2.611440e+05 4.620209e+05 3.624502e+05 1.082047e+06 1.541633e+06 5.561956e+05 9.332503e+05 5.855688e+05 8.880356e+05 8.972994e+05 4.629283e+05 1.679559e+06 5.026815e+05 2.336231e+05 3.246659e+05 1.838683e+06 7.168963e+05 1.283172e+06 1.446538e+06 8.408555e+05 4.996490e+05 5.975964e+05 6.821195e+05 3.178122e+05 7.060407e+05 6.657009e+05 7.005497e+05 7.925087e+05 8.871950e+05 1.168214e+06 5.828500e+05 6.860652e+05 8.347159e+05 1.937721e+06 6.820039e+05 4.757621e+05 7.739444e+05 1.470929e+06 9.515102e+05 8.935300e+05 2.679506e+06 1.794656e+06 1.241233e+06 8.442712e+05 7.368196e+05 6.191208e+05 4.338366e+05 1.043104e+06 1.141718e+06 9.848424e+05 1.111015e+06 7.505100e+05 1.019507e+06 8.724254e+05 4.982639e+05 7.899054e+05 9.430629e+05 5.171056e+05 7.449219e+05 6.814297e+05 4.707482e+05 9.718224e+05 9.023593e+05 5.295713e+05 8.301978e+05 1.286934e+06 8.065369e+05 6.118294e+05 5.322113e+05 8.855208e+05 8.362832e+05 8.359081e+05 2.526796e+06 2.509719e+06 7.284488e+05 1.323921e+06 1.012866e+06 9.970447e+05 5.830380e+05 6.998206e+05 2.082787e+06 5.716489e+05 1.890811e+06 1.399111e+06 9.636980e+05 8.445042e+05 4.534274e+06 5.362834e+05 4.066205e+06 2.707823e+06 5.577438e+05 2.405324e+06 1.173118e+06 2.140280e+06 8.847761e+05 3.249811e+05 5.992613e+05 3.636571e+05 3.628594e+05 2.802284e+05 1.032663e+06 8.040491e+05 6.033245e+05 5.641030e+05 5.359158e+05 5.842791e+05 8.010933e+05 1.071638e+06 1.626113e+06 4.291948e+05 7.860571e+05 9.650910e+05 5.022263e+05 4.317118e+05 3.588835e+05 3.275344e+05 8.978305e+05 2.137393e+06 4.309627e+05 4.379091e+06 4.161220e+05 6.121140e+05 4.434755e+05 1.625184e+06 1.617727e+06 5.149226e+05 8.743803e+05 6.271198e+05 7.805234e+05 1.106526e+06 4.093496e+05 6.485972e+05 7.091376e+05 1.587181e+06 1.140756e+06 7.410410e+05 5.778712e+05 3.852236e+05 1.007521e+06 5.749047e+05 5.651521e+05 1.417792e+06 8.951504e+05 4.243569e+05 8.176975e+05 6.227215e+05 2.299373e+06 3.223506e+05 4.859936e+05 3.068953e+05 1.895090e+06 2.916961e+06 1.023901e+06 1.244539e+06 C18 H30 O5_1.749 1.771941e+05 6.094205e+05 6.829716e+05 5.754468e+05 6.176623e+04 5.228112e+05 4.148515e+05 9.084641e+05 100936.37 5.408927e+05 5.353983e+05 8.122125e+05 96996.04 5.291039e+05 4.953869e+05 5.181470e+05 1.255587e+05 5.986434e+05 3.977766e+05 8.448085e+05 1.709091e+05 4.278577e+05 8.414523e+05 6.912700e+05 77076.484 4.571983e+05 5.841011e+05 6.014274e+05 7.925142e+04 5.160821e+05 5.275618e+05 6.989412e+05 103674.12 4.954209e+05 8.341111e+05 6.538805e+05 1.214916e+05 3.332962e+05 5.778421e+05 6.964667e+05 1.026148e+05 5.306402e+05 7.351089e+05 6.936209e+05 1.459278e+05 3.791894e+05 7.005406e+05 5.463837e+05 1.123451e+06 2.374345e+06 2.133983e+05 4.962504e+05 1.906173e+05 3.802132e+05 5.336459e+05 4.233393e+05 4.040794e+05 3.300046e+05 2.608938e+05 1.200525e+06 4.022868e+05 5.424070e+05 5.625975e+05 5.661897e+05 2.519567e+05 1.864125e+05 2.209056e+06 2.243723e+05 2.169931e+05 3.272747e+05 2.686805e+05 4.579006e+05 3.497413e+05 5.356288e+05 8.315969e+05 1.786491e+05 5.016206e+05 6.660082e+05 2.145431e+05 5.364405e+05 2.163671e+05 4.571431e+05 5.348787e+05 4.063103e+05 5.835937e+05 2.179571e+05 5.529530e+05 1.913894e+05 3.594698e+05 3.159815e+05 7.902189e+05 2.704869e+05 5.524944e+05 6.008309e+05 1.840188e+06 6.774745e+05 5.526611e+05 4.029746e+05 3.423243e+05 8.289256e+05 7.324216e+05 9.945360e+05 3.550717e+05 4.706554e+05 8.938835e+05 4.829693e+05 1.948609e+05 9.542043e+05 1.877421e+05 4.597856e+05 5.520675e+05 1.076316e+06 7.315251e+05 6.992126e+05 7.312110e+05 2.836211e+05 2.998972e+05 3.822889e+05 1.648193e+05 1.146754e+06 5.137862e+05 5.627835e+05 4.295546e+05 1.956850e+05 4.551558e+05 1.970810e+05 2.490872e+06 1.397052e+06 6.856823e+05 5.480974e+05 5.697356e+05 1.139925e+05 8.476431e+05 1.142910e+06 9.173464e+05 9.965675e+05 2.034399e+06 2.808662e+06 2.303071e+05 9.137150e+05 4.803141e+05 2.640886e+06 2.426557e+06 6.261635e+05 5.594304e+05 9.206753e+05 4.962385e+05 7.028799e+05 6.572156e+05 1.211391e+06 3.946439e+05 1.225514e+06 6.838090e+05 4.566937e+05 1.598592e+05 1.660614e+05 2.788193e+05 6.107919e+05 5.844388e+05 2.706726e+05 3.413228e+05 6.257928e+05 1.935645e+06 3.436564e+05 7.533518e+05 3.031984e+05 8.085908e+05 3.138219e+05 1.974631e+05 4.377122e+05 4.093807e+05 5.625900e+05 5.779201e+05 2.715358e+05 6.140345e+05 1.885972e+05 3.923423e+05 2.390203e+05 4.017992e+05 3.296374e+05 1.532348e+06 7.713077e+05 6.489081e+05 5.437395e+06 4.226239e+05 7.151399e+05 7.262343e+05 5.542997e+05 2.319784e+06 3.163394e+05 1.038651e+07 7.723229e+05 4.396762e+05 6.279462e+05 2.078990e+06 7.133283e+05 3.758264e+06 7.124564e+06 7.646686e+05 2.676314e+06 4.432191e+06 4.829427e+06 7.433068e+05 7.887710e+05 8.599329e+05 5.512112e+05 3.938201e+05 3.075491e+05 1.295556e+06 1.062679e+06 3.752360e+05 4.680824e+05 5.377663e+05 5.442939e+05 4.188112e+05 5.850944e+05 4.863103e+06 5.346277e+05 8.467361e+05 4.175856e+05 9.931356e+05 3.841324e+05 4.517240e+05 5.540640e+05 1.039569e+06 2.387193e+06 5.390707e+05 1.029952e+06 1.218546e+06 5.433385e+05 5.956709e+05 6.443934e+05 5.469362e+05 2.790785e+06 7.736830e+05 1.107025e+06 7.771967e+05 5.814668e+05 1.134994e+06 1.927685e+05 7.631117e+05 3.591038e+05 2.819763e+05 2.821023e+05 2.289728e+05 3.231371e+05 5.417965e+05 4.859594e+05 4.691779e+05 9.497740e+05 5.347055e+05 5.838556e+05 4.694826e+05 4.861407e+05 1.410141e+06 1.668624e+05 2.691353e+05 5.275216e+05 2.785062e+05 4.016652e+05 4.816027e+05 5.610685e+05 "(3Z,5Z)-6-(3,4-Dihydroxyphenyl)-4-hydroxy-3,5-hexadien-2-one_1.749" 8.867915e+04 7.420621e+06 1.008847e+07 8.714560e+06 6.739623e+04 8.524127e+06 8.302011e+06 1.179428e+07 90603.75 8.110074e+06 9.080323e+06 9.268543e+06 78306.33 9.136970e+06 7.722202e+06 9.524969e+06 9.514667e+04 8.772057e+06 8.868200e+06 8.889881e+06 1.429568e+05 7.892815e+06 8.942836e+06 1.141979e+07 65471.277 8.055121e+06 9.359186e+06 9.174131e+06 6.413889e+04 8.067249e+06 8.510333e+06 1.077463e+07 92306.47 6.643545e+06 1.027090e+07 8.989497e+06 1.018471e+05 7.417809e+06 9.354760e+06 9.480296e+06 8.967932e+04 7.340235e+06 9.749773e+06 1.308884e+07 1.350174e+05 6.189587e+06 1.082547e+07 6.191209e+06 7.838801e+06 8.359366e+06 2.648186e+06 8.996236e+06 4.412849e+06 7.740629e+06 6.791809e+06 1.075238e+07 7.273339e+06 8.073349e+06 7.237538e+06 8.845806e+06 1.152397e+07 5.215974e+06 8.341070e+06 5.775331e+06 6.024977e+06 8.017014e+06 1.849523e+07 6.910542e+06 7.035726e+06 7.123264e+06 1.263378e+07 9.389582e+06 1.404923e+07 1.122387e+07 6.788161e+06 8.285252e+06 7.494835e+06 9.238084e+06 8.872067e+04 9.920118e+06 8.560564e+06 5.489170e+06 6.279373e+06 9.402588e+06 6.070774e+06 8.326183e+06 4.746239e+06 3.728422e+06 7.487629e+06 7.927464e+06 1.719670e+07 8.918479e+06 1.343178e+07 1.078930e+07 1.608631e+07 1.348163e+07 1.612658e+07 7.029365e+06 1.233644e+07 1.161112e+07 1.045779e+07 1.299290e+07 5.747616e+06 1.345066e+07 1.371080e+07 1.367917e+07 9.253431e+06 1.196046e+07 4.099722e+06 7.381108e+06 8.031810e+06 1.940755e+07 1.507171e+07 8.100690e+06 1.174121e+07 6.516696e+06 1.261991e+07 1.038572e+07 6.544742e+06 9.919416e+06 3.776551e+06 4.612709e+06 4.343699e+06 8.437837e+06 7.448999e+06 5.501021e+06 1.640799e+07 1.165813e+07 7.770702e+06 9.939164e+06 9.839956e+06 9.865755e+04 7.163639e+06 1.066249e+07 1.183176e+07 1.181247e+07 1.520451e+07 1.486208e+07 9.833622e+06 1.253957e+07 3.867453e+06 1.775162e+07 1.769146e+07 5.351731e+06 9.298371e+06 1.085238e+07 9.730916e+06 1.007400e+07 1.197117e+07 1.603478e+07 1.362908e+07 1.343791e+07 5.571664e+06 1.076982e+07 9.037813e+06 1.264058e+07 1.946110e+07 2.498070e+07 2.488870e+07 1.334731e+07 1.323839e+07 1.686938e+07 7.564819e+06 7.722164e+06 9.559641e+06 6.001239e+06 5.861499e+06 5.446436e+06 4.965891e+06 7.150286e+06 7.423452e+06 5.949761e+06 5.620100e+06 5.822445e+06 1.159929e+07 1.090947e+07 7.987226e+06 5.667360e+06 9.951486e+06 1.009046e+07 3.171001e+07 5.072486e+06 4.660811e+06 2.440560e+07 5.597087e+06 6.120611e+06 6.055608e+06 3.484960e+06 2.521514e+07 1.982474e+06 2.243821e+07 9.890790e+06 5.350409e+06 7.117958e+06 2.151637e+07 5.163146e+06 2.795730e+07 2.602523e+07 3.939966e+06 2.722882e+07 2.615393e+07 2.916820e+07 4.388244e+06 3.906009e+06 4.666699e+06 4.309001e+06 6.052020e+06 3.728341e+06 7.715698e+06 6.818951e+06 4.585469e+06 3.770135e+06 4.536309e+06 3.650567e+06 9.221277e+06 6.419384e+06 2.867340e+07 5.807130e+06 7.846220e+06 6.094541e+06 6.095158e+06 4.709664e+06 3.696651e+06 6.942212e+06 7.934802e+06 1.283599e+07 7.516844e+06 7.114775e+06 7.465482e+06 5.959292e+06 6.957402e+06 6.932192e+06 7.933248e+06 6.932895e+06 6.950728e+06 7.436656e+06 8.503485e+06 7.283207e+06 7.184788e+06 6.481925e+06 1.557138e+07 8.961563e+06 1.228671e+07 1.357846e+07 8.932247e+06 1.112754e+07 1.416605e+07 8.199189e+06 9.234695e+06 1.795672e+07 1.223429e+07 7.613723e+06 1.218265e+07 4.606780e+06 2.357767e+07 5.526669e+06 6.429054e+06 6.507836e+06 4.004951e+06 1.039531e+07 1.054129e+07 1.296191e+07 C4 H14 N5 O2 P_1.75 2.827495e+06 1.040948e+06 1.115989e+06 9.807308e+05 1.226036e+05 9.240286e+05 7.498060e+05 1.290092e+06 183876.42 9.548408e+05 9.974557e+05 1.123873e+06 154913.38 9.285488e+05 1.006174e+06 8.908241e+05 1.589578e+05 1.150819e+06 9.897053e+05 9.717892e+05 2.907543e+05 8.158287e+05 1.095679e+06 1.353133e+06 132920.681 8.085098e+05 1.076785e+06 1.058619e+06 1.283407e+05 7.139266e+05 9.818840e+05 1.039998e+06 169230.67 1.191722e+06 1.019350e+06 9.790686e+05 2.019760e+05 9.167837e+05 8.953015e+05 1.252975e+06 1.768974e+05 7.607322e+05 1.099440e+06 1.205908e+06 2.451761e+05 8.754130e+05 1.078967e+06 9.004437e+05 4.823766e+05 7.678163e+05 3.166274e+06 1.293965e+06 4.932099e+05 1.614613e+06 7.516608e+05 6.515662e+06 3.469746e+06 3.730045e+06 1.543470e+06 7.770099e+06 6.430373e+06 3.823649e+06 9.623739e+05 1.431107e+06 2.311927e+06 1.225992e+06 7.578947e+05 3.774199e+06 5.631290e+05 7.810329e+05 3.466713e+06 4.439779e+06 1.556980e+06 5.939013e+05 3.932109e+06 5.084071e+05 3.530100e+05 6.516898e+05 5.988106e+06 1.594537e+06 8.494654e+05 9.841616e+05 4.313890e+05 5.454182e+05 5.626925e+05 1.926836e+06 2.926143e+05 1.217665e+06 5.588898e+05 6.544190e+05 1.175742e+06 7.000606e+05 4.850622e+06 4.169938e+05 8.385821e+05 3.641066e+06 6.083235e+05 2.659843e+06 1.281554e+06 4.026506e+05 2.298477e+06 9.735842e+05 3.356429e+05 5.330430e+05 6.044016e+05 6.181517e+05 2.011892e+06 1.020696e+06 2.329657e+05 4.321268e+05 8.220236e+05 1.249830e+06 3.970538e+06 1.972068e+06 3.134909e+06 7.118127e+05 8.540358e+06 5.427233e+05 1.676176e+06 8.284684e+05 8.729286e+05 7.543623e+05 1.389813e+06 2.704361e+05 8.516202e+05 3.656955e+05 1.271058e+06 1.391134e+06 6.395470e+05 5.003982e+05 2.036530e+06 2.450462e+05 7.556263e+05 5.189319e+05 8.077573e+05 1.277879e+06 8.995929e+05 4.623601e+06 3.232348e+05 5.911699e+05 9.782944e+05 9.164516e+05 2.219062e+06 1.501203e+06 6.330947e+05 7.190455e+05 4.127046e+05 3.308049e+05 3.816454e+05 5.665650e+05 7.755810e+05 9.053816e+05 6.761386e+05 4.815911e+06 3.737403e+05 5.894071e+05 8.608860e+06 7.401782e+05 1.127591e+06 4.097094e+05 7.363192e+05 1.059964e+06 9.831377e+05 9.474803e+05 5.239059e+06 1.077872e+06 1.130502e+06 1.162426e+06 2.377900e+06 1.324797e+06 8.733488e+05 6.194597e+05 2.616648e+06 5.443658e+05 6.901329e+05 3.830774e+05 6.176553e+05 5.659038e+05 9.001728e+05 5.132776e+05 5.062492e+05 1.546086e+06 1.302375e+06 1.553033e+06 3.596602e+06 1.662615e+06 1.095160e+06 1.334267e+06 1.203818e+06 6.683113e+05 8.384059e+05 3.478624e+05 5.527705e+05 1.094961e+06 7.366719e+05 8.687824e+06 2.267039e+06 2.008914e+06 5.208856e+05 5.167880e+05 3.614747e+06 1.030767e+06 8.919467e+06 2.594220e+06 1.869340e+06 6.019162e+05 8.204809e+05 1.169886e+06 7.510968e+05 6.746013e+05 5.927520e+05 4.373981e+05 2.077287e+06 9.201238e+05 4.172362e+05 4.642359e+05 5.932178e+05 1.399237e+06 7.463940e+05 1.655985e+06 8.030771e+05 1.379694e+06 1.108654e+06 1.205028e+06 1.004084e+06 8.381188e+05 8.268331e+05 8.317408e+05 2.610852e+06 5.606571e+05 3.485620e+06 5.691671e+05 1.413132e+06 2.020069e+06 7.303425e+05 7.018649e+05 5.758463e+05 9.198722e+06 8.163640e+06 5.465134e+05 6.333249e+06 1.002100e+06 8.504364e+05 9.793650e+05 4.935759e+05 1.364616e+06 4.195166e+06 7.961478e+05 1.097613e+06 6.127632e+05 6.074362e+06 2.164958e+06 4.782190e+05 6.620875e+06 3.038530e+06 2.906674e+06 5.480912e+05 1.026403e+06 3.659204e+05 8.678085e+05 1.167462e+06 3.781723e+05 8-Nonynoic acid_1.75 1.528060e+05 1.621954e+06 9.036258e+05 1.144802e+06 1.939773e+05 1.166177e+06 8.857726e+05 1.395448e+06 278660.51 1.119697e+06 1.291355e+06 1.355171e+06 192943.20 1.102670e+06 1.107159e+06 1.076381e+06 2.376938e+05 1.220463e+06 1.252961e+06 1.273458e+06 4.731631e+05 1.104956e+06 1.232991e+06 1.318794e+06 188363.387 1.006305e+06 1.028178e+06 1.418256e+06 1.680901e+05 1.191640e+06 1.023077e+06 1.510917e+06 222520.34 9.888068e+05 1.376788e+06 9.732127e+05 2.643415e+05 1.118663e+06 1.032665e+06 1.231850e+06 2.147774e+05 1.552874e+06 1.296966e+06 1.569063e+06 2.989539e+05 9.986950e+05 1.191229e+06 1.022027e+06 8.737426e+05 1.244802e+06 1.143647e+06 2.130081e+06 9.713993e+05 1.017757e+06 1.437009e+06 1.702295e+06 1.532306e+06 1.851981e+06 1.276927e+06 1.344218e+06 2.052960e+06 1.481641e+06 2.916610e+06 1.531963e+06 1.108007e+06 2.233548e+06 1.312280e+06 1.197273e+06 1.529967e+06 1.224138e+06 1.806015e+06 1.713256e+06 1.862417e+06 1.863470e+06 1.154418e+06 1.138865e+06 1.048186e+06 8.159643e+05 8.694022e+06 9.962668e+05 9.674117e+05 1.336859e+06 9.517348e+05 1.171924e+06 1.117533e+06 2.350995e+06 7.505943e+05 6.949616e+05 1.176448e+06 9.102722e+05 1.370119e+06 7.824086e+05 1.585263e+06 8.213278e+05 1.253716e+06 1.491102e+06 1.282693e+06 5.954701e+05 1.170021e+06 1.355006e+06 1.074602e+06 9.688256e+05 8.154939e+05 9.443080e+05 1.355074e+06 1.260206e+06 1.124209e+06 1.005569e+06 6.979088e+05 7.463021e+05 9.212339e+05 2.238019e+06 1.439361e+06 1.181867e+06 1.334822e+06 4.655014e+05 1.655457e+06 8.830037e+05 9.558275e+05 1.160278e+06 7.326943e+05 5.612467e+05 6.131663e+05 6.113342e+05 8.279227e+05 5.846688e+05 1.976894e+06 1.313269e+06 7.587950e+05 9.141797e+05 1.126234e+06 3.573493e+06 6.553566e+05 1.066117e+06 8.527451e+05 8.713365e+05 1.543337e+06 1.507170e+06 9.347985e+05 1.243625e+06 6.869503e+05 1.382683e+06 1.104328e+06 4.415964e+05 8.403697e+05 1.097682e+06 1.231140e+06 1.154300e+06 1.299871e+06 1.345353e+06 1.152424e+06 9.425161e+05 9.849897e+05 9.992828e+05 1.122713e+06 9.097855e+05 1.506389e+06 1.451564e+06 1.497673e+06 9.629263e+05 9.151194e+05 1.161632e+06 1.100361e+06 9.190679e+05 1.788790e+06 1.036407e+06 1.117566e+06 8.535185e+05 2.055137e+06 1.334589e+06 1.078918e+06 1.020288e+06 1.081096e+06 1.098774e+06 1.073548e+06 1.271492e+06 1.307722e+06 1.335295e+06 1.206261e+06 1.642490e+06 2.249170e+06 1.265331e+06 1.264675e+06 1.256610e+06 1.595806e+06 1.979926e+06 1.140117e+06 1.220776e+06 3.305224e+06 1.159478e+06 1.457499e+06 1.554093e+06 1.048087e+06 1.612655e+06 9.090047e+06 1.166349e+06 3.259630e+06 3.754125e+06 9.512374e+05 1.566902e+06 1.019244e+06 1.851771e+06 1.465066e+06 1.433002e+06 1.336338e+06 1.175238e+06 5.746546e+06 9.409254e+05 1.966727e+06 1.670313e+06 1.003170e+06 1.271531e+06 1.253019e+06 1.798386e+06 1.483441e+06 1.562999e+06 1.241204e+06 1.805613e+06 1.902243e+06 1.994254e+06 1.398948e+06 1.687780e+06 1.373849e+06 1.304338e+06 1.844904e+06 1.865754e+06 1.648146e+06 1.835888e+06 1.953764e+06 1.340030e+06 1.998656e+06 1.777397e+06 8.768272e+05 1.616096e+06 1.332791e+06 2.126589e+06 7.942419e+05 9.485923e+05 9.135972e+05 8.892567e+05 2.359141e+06 6.699344e+05 1.467801e+06 9.833398e+05 1.102993e+06 2.037348e+06 1.495618e+06 7.803275e+05 8.388843e+05 1.055152e+06 9.039474e+05 8.827512e+05 1.059494e+06 1.162900e+06 1.423572e+06 7.432316e+05 8.907172e+05 9.615593e+05 1.115351e+06 1.303755e+06 9.550946e+05 7.972689e+05 183.55325_1.751 9.077959e+04 1.290891e+06 1.466800e+06 1.378146e+06 6.804322e+04 1.391631e+06 1.675203e+06 1.552386e+06 87105.58 1.248702e+06 1.571620e+06 1.378773e+06 70028.71 1.652322e+06 1.440417e+06 1.481434e+06 5.025851e+04 1.069608e+06 1.347084e+06 1.460273e+06 1.077259e+05 1.743046e+06 1.296205e+06 1.897646e+06 50993.457 1.270276e+06 1.205769e+06 1.677430e+06 5.109684e+04 1.531327e+06 9.471986e+05 1.355883e+06 69082.32 1.775651e+06 1.348444e+06 1.391589e+06 6.896385e+04 1.640345e+06 1.256435e+06 1.201443e+06 5.899690e+04 1.794349e+06 1.320699e+06 1.155777e+06 8.552447e+04 2.212972e+06 1.320126e+06 1.200926e+06 1.452412e+06 1.023939e+06 3.598550e+05 1.320416e+06 1.766808e+06 1.731197e+06 2.984196e+06 1.268277e+06 9.864819e+05 1.417042e+06 8.115372e+05 1.762010e+06 1.603352e+06 1.437495e+06 1.345473e+06 2.110055e+06 1.323330e+06 8.060116e+05 1.683056e+06 1.435426e+06 1.222261e+06 1.238994e+06 1.491090e+06 1.370239e+06 1.440632e+06 1.187364e+06 1.488304e+06 1.333091e+06 1.039668e+06 1.330381e+06 1.806136e+06 1.507090e+06 1.178311e+06 1.416987e+06 1.393052e+06 9.822408e+05 1.425867e+06 1.252375e+06 1.156593e+06 1.683055e+06 1.456650e+06 1.365168e+06 9.811979e+05 1.526077e+06 1.197392e+06 1.179099e+06 1.318190e+06 1.316411e+06 1.200395e+06 1.143278e+06 1.162416e+06 1.823978e+06 1.609352e+06 7.180446e+05 1.527121e+06 1.541500e+06 1.681430e+06 9.951347e+05 1.118507e+06 1.046456e+06 1.352060e+06 1.245256e+06 1.050032e+06 1.233679e+06 1.578848e+06 1.240410e+06 1.551008e+06 1.949867e+06 1.375533e+06 1.437268e+06 3.170463e+06 1.382214e+06 8.398361e+05 9.952678e+05 1.250433e+06 9.207080e+05 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7.002794e+05 1.957425e+06 1.170790e+06 1.833501e+06 1.406600e+06 1.529076e+06 1.542000e+06 1.239187e+06 1.125886e+06 1.416403e+06 1.214148e+06 1.239761e+06 1.141867e+06 1.309938e+06 1.431812e+06 9.965347e+05 1.028244e+06 1.067610e+06 1.217641e+06 1.271410e+06 1.140288e+06 1.478471e+06 1.057009e+06 1.096621e+06 1.341393e+06 1.230789e+06 1.144540e+06 1.355929e+06 1.616788e+06 1.305887e+06 1.336056e+06 1.326707e+06 1.086815e+06 1.739958e+06 1.074624e+06 2.057936e+06 1.685949e+06 1.615056e+06 1.582291e+06 1.127356e+06 1.173842e+06 1.570488e+06 1.886899e+06 1.684939e+06 1.869557e+06 1.468007e+06 1.161212e+06 1.020346e+06 1.378250e+06 1.225039e+06 1.091704e+06 1.372359e+06 1.373395e+06 1.063704e+06 1.265594e+06 3.220495e+06 1.530509e+06 1.404062e+06 1.226964e+06 1.164075e+06 2.055368e+06 C27 H44_1.751 8.828869e+06 1.220650e+06 9.470922e+05 9.105677e+05 4.526541e+04 8.730716e+05 9.878677e+05 1.819198e+06 78201.01 6.040755e+05 9.626824e+05 1.070596e+06 80938.11 9.910882e+05 1.057812e+06 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6.622215e+06 2.264443e+06 1.963091e+06 2.583693e+06 1.940279e+06 5.064760e+06 2.828947e+06 3.084191e+06 6.525141e+06 2.686422e+06 2.092576e+06 3.296322e+06 1.577783e+06 2.278285e+06 1.876346e+06 2.024154e+06 1.622045e+06 1.228556e+06 5.627279e+06 1.704589e+06 4.472150e+06 1.868550e+06 1.957061e+06 2.089461e+06 1.816947e+06 2.484529e+06 1.699786e+06 1.403053e+06 1.589118e+06 2.421112e+06 2.086536e+06 1.619755e+06 2.065786e+06 4.574333e+06 2.492474e+06 1.660476e+06 1.544631e+06 1.504429e+06 1.962890e+06 1.818803e+06 2.128638e+06 1.838287e+06 C12 H14 O3_1.754 1.746161e+05 4.632199e+06 4.039043e+06 3.249209e+06 1.187677e+05 3.317523e+06 2.984467e+06 4.001303e+06 122619.81 3.982840e+06 3.981260e+06 4.631226e+06 94490.85 4.305855e+06 4.095354e+06 4.786864e+06 1.335544e+05 1.466902e+06 4.900080e+06 2.008009e+06 2.326309e+05 2.570690e+06 5.315323e+06 5.391640e+06 92188.228 3.828430e+06 1.944074e+06 5.036119e+06 8.286290e+04 4.350323e+06 1.705932e+06 6.650237e+06 119268.95 4.095179e+06 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7.916927e+06 1.070791e+06 8.611204e+06 4.637809e+06 2.847287e+06 5.051945e+06 6.207527e+06 3.829049e+06 5.388926e+06 9.465448e+06 3.948654e+06 1.085719e+07 3.506193e+06 8.564209e+06 4.712107e+06 3.586978e+06 6.763935e+06 3.235257e+06 4.727386e+06 4.590594e+06 5.729035e+06 6.391547e+06 2.313236e+06 1.236191e+06 2.225059e+06 1.326519e+06 1.147447e+07 4.440516e+06 3.928983e+06 1.045155e+06 5.816238e+06 4.990619e+06 4.754671e+06 4.025884e+06 1.399740e+06 6.547172e+06 2.024988e+06 6.316967e+06 2.710458e+06 1.926082e+06 5.078471e+06 6.429954e+06 6.090014e+06 1.644092e+06 2.824739e+06 6.064699e+06 1.691439e+06 2.157697e+06 6.947595e+06 2.354884e+06 4.518101e+06 6.531790e+06 6.802065e+06 4.834859e+06 5.619967e+06 7.250728e+06 3.816419e+06 3.747347e+06 4.351966e+06 4.903069e+06 5.489273e+06 5.469983e+06 1.346369e+06 5.779306e+06 1.594410e+06 5.188597e+06 9.672012e+06 3.036483e+06 4.062957e+06 4.584950e+06 3.292898e+06 1.531409e+06 4.989116e+06 2.595802e+06 C7 H22 N9 O P_1.754 2.444259e+05 4.735322e+06 4.688143e+06 4.199319e+06 6.870826e+04 4.360153e+06 3.003339e+06 5.917274e+06 106526.32 4.374469e+06 4.684253e+06 4.448592e+06 94364.62 4.460226e+06 3.703906e+06 4.757571e+06 1.132038e+05 4.553689e+06 4.497613e+06 4.340485e+06 1.713371e+05 4.325409e+06 4.091704e+06 5.137186e+06 78365.410 3.990866e+06 4.873214e+06 4.516725e+06 7.252727e+04 4.429511e+06 4.531333e+06 4.616395e+06 109571.49 3.636749e+06 5.144624e+06 4.338628e+06 1.339889e+05 3.674407e+06 4.754738e+06 4.146678e+06 1.251871e+05 4.122764e+06 4.615443e+06 6.398161e+06 1.874581e+05 3.286743e+06 5.606525e+06 2.916832e+06 3.719454e+06 1.778339e+06 1.418324e+06 3.553955e+06 3.548092e+06 1.984638e+06 1.496975e+06 2.248261e+06 2.363637e+06 3.603213e+06 4.334113e+06 2.759999e+06 5.183677e+06 1.842044e+06 2.447287e+06 2.521656e+06 2.069729e+06 1.265261e+06 3.390971e+06 3.142242e+06 3.647896e+06 3.383832e+06 3.031316e+06 5.831616e+06 6.046998e+06 3.068422e+06 2.093252e+06 3.641145e+06 2.776831e+06 4.384553e+06 1.274790e+05 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6.468518e+06 5.793987e+06 5.852525e+06 2.712514e+06 6.872534e+06 6.246344e+06 3.239735e+06 3.785211e+06 2.964074e+06 3.264667e+06 4.430437e+06 2.128459e+06 1.545759e+06 2.520659e+06 1.237412e+06 2.171280e+06 2.532048e+06 2.748017e+06 3.974943e+06 4.112097e+06 1.932386e+06 4.296927e+06 1.579418e+06 1.669205e+06 2.682026e+06 1.250615e+07 2.990244e+07 2.194490e+06 3.894512e+06 C12 H27 N O5_1.755 4.524521e+04 2.635621e+05 3.175567e+05 3.804142e+05 3.510613e+04 2.825279e+05 2.811936e+05 3.133645e+05 48897.94 3.112502e+05 3.222277e+05 2.569084e+05 38468.05 3.431216e+05 3.344972e+05 2.850460e+05 9.118748e+04 3.321827e+05 2.415340e+05 3.075270e+05 9.707756e+04 2.484814e+05 3.529330e+05 3.821336e+05 45990.747 3.308972e+05 2.738515e+05 2.744350e+05 4.955063e+04 3.193093e+05 3.071503e+05 2.405153e+05 74158.32 3.380919e+05 3.117534e+05 3.602145e+05 8.782315e+04 1.551302e+05 3.181336e+05 2.141932e+05 8.236329e+04 6.637278e+05 2.592721e+05 4.862540e+05 5.526994e+04 2.439777e+05 2.802460e+05 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3.462639e+05 6.931683e+05 2.606871e+05 2.835476e+05 1.342674e+05 2.249607e+05 9.288555e+04 3.234816e+05 2.754479e+05 3.205889e+05 1.122804e+05 1.754758e+05 2.438292e+05 4.275852e+05 1.531408e+05 2.413924e+05 4.590433e+05 2.203627e+05 4.113084e+05 1.577199e+05 1.917191e+05 1.802626e+05 5.638633e+05 4.588381e+05 5.417551e+05 4.591446e+05 5.996084e+05 4.697992e+05 2.349779e+05 2.815317e+05 1.993407e+05 2.151079e+05 2.915800e+05 3.925877e+05 1.941449e+05 3.155572e+05 3.150215e+05 1.603019e+05 2.236726e+05 2.740208e+05 7.220973e+05 1.617074e+06 1.262827e+06 9.634885e+05 8.567271e+05 1.435327e+06 8.626943e+05 1.554273e+06 2.239289e+06 1.849240e+06 1.754938e+05 1.764984e+06 2.540253e+05 2.412920e+06 1.559210e+05 2.240354e+05 2.348970e+05 2.008605e+05 1.091989e+06 9.346477e+05 1.767529e+06 C29 H60 N9 O2 P S_1.756 5.884677e+04 4.866905e+05 6.025599e+05 5.006497e+05 4.479712e+04 5.949640e+05 5.984764e+05 5.474438e+05 56753.82 4.632633e+05 6.165778e+05 4.431281e+05 41719.92 6.082217e+05 6.582169e+05 4.107715e+05 9.731312e+04 5.671411e+05 5.754377e+05 6.300262e+05 1.386602e+05 3.919455e+05 5.656438e+05 6.321480e+05 58980.827 4.893753e+05 6.856657e+05 3.863858e+05 5.348468e+04 5.714471e+05 6.141199e+05 5.257382e+05 75680.63 5.170240e+05 5.840225e+05 5.877537e+05 8.873639e+04 4.007134e+05 6.763105e+05 5.906952e+05 7.908993e+04 3.611328e+05 6.055424e+05 5.507638e+05 5.803730e+04 6.086433e+05 6.100658e+05 4.555607e+05 4.799061e+05 7.577873e+05 6.962665e+05 5.728440e+05 4.568856e+05 3.535268e+05 3.798887e+05 3.504904e+05 3.883868e+05 2.414374e+05 2.140291e+05 7.400973e+05 2.879913e+05 2.064320e+05 5.143533e+05 5.206687e+05 6.321527e+05 6.795900e+05 7.978217e+05 3.222965e+05 5.207170e+05 2.780192e+05 4.171854e+05 4.931488e+05 4.755611e+05 4.955574e+05 5.616481e+05 4.750229e+05 6.738047e+05 4.524144e+05 1.915295e+05 6.448497e+05 7.478219e+05 5.612920e+05 3.194102e+05 6.805222e+05 3.633649e+05 7.419942e+05 2.533594e+05 1.361337e+05 5.256500e+05 6.255854e+05 9.379027e+05 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4.989507e+05 4.026836e+05 3.420949e+05 3.470225e+05 5.608179e+05 3.462723e+05 5.520017e+05 4.816164e+05 4.661026e+05 6.482867e+05 4.490064e+05 4.617779e+05 9.402731e+05 3.487401e+05 4.902725e+05 9.848059e+05 7.224292e+05 6.319076e+05 4.128833e+05 3.031623e+05 9.099270e+05 1.955674e+05 6.533656e+05 5.369587e+05 1.634987e+05 7.933468e+05 9.178028e+05 4.863152e+05 1.002320e+06 8.484402e+05 3.820137e+05 8.560219e+05 1.441300e+06 9.127773e+05 4.636116e+05 3.122022e+05 6.655735e+05 3.058263e+05 6.570406e+05 2.974774e+05 6.006909e+05 6.025558e+05 6.103039e+05 3.934523e+05 5.066555e+05 4.768290e+05 7.649634e+05 7.413447e+05 1.422853e+06 6.772772e+05 6.840259e+05 5.651317e+05 6.450435e+05 4.426931e+05 4.373006e+05 7.484671e+05 9.904075e+05 1.164711e+06 8.997040e+05 8.039299e+05 7.201123e+05 6.850382e+05 5.925954e+05 7.638543e+05 6.071074e+05 7.412259e+05 5.284079e+05 3.693008e+05 4.984360e+05 3.392077e+05 4.210650e+05 5.390217e+05 6.713488e+05 6.960153e+05 5.711847e+05 1.046251e+06 1.026172e+06 7.811988e+05 1.019436e+06 8.405605e+05 1.013893e+06 1.281312e+06 1.185179e+06 4.328693e+05 1.131455e+06 5.867880e+05 2.940597e+06 1.708358e+05 3.884927e+05 1.424802e+05 7.704357e+05 7.726182e+05 8.062588e+05 1.099795e+06 C12 H31 N8 O2 P_1.756 1.536857e+05 1.035758e+06 1.113610e+06 7.688112e+05 1.173835e+05 9.311215e+05 9.928579e+05 1.269789e+06 156430.51 9.607407e+05 7.992202e+05 1.116480e+06 127702.84 9.809950e+05 9.402175e+05 8.736907e+05 1.916223e+05 9.902478e+05 9.270646e+05 1.323587e+06 2.448256e+05 1.006588e+06 8.823860e+05 6.449670e+05 120932.152 8.305286e+05 1.664431e+06 9.991478e+05 1.097747e+05 7.050163e+05 8.843460e+05 1.290425e+06 158364.53 8.893488e+05 9.907535e+05 7.470839e+05 1.852718e+05 8.853682e+05 1.094731e+06 9.974908e+05 1.580676e+05 1.121400e+06 1.012290e+06 1.079821e+06 1.902869e+05 8.928100e+05 9.894166e+05 9.397672e+05 7.766329e+05 9.537072e+05 3.853004e+05 6.318343e+05 4.676953e+05 7.693823e+05 4.000429e+05 1.094935e+06 5.560216e+05 5.835772e+05 5.646685e+05 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1.058214e+06 1.189746e+06 8.665646e+05 9.917647e+05 3.091302e+05 1.230029e+06 1.583839e+06 4.145781e+05 5.665520e+05 3.621248e+05 3.246586e+05 2.731585e+05 4.381638e+05 6.749019e+05 4.122902e+05 3.571408e+05 3.251148e+05 9.929573e+05 6.884088e+05 1.204278e+06 1.047081e+06 1.303460e+06 1.137649e+06 7.952839e+05 9.065447e+05 8.314904e+05 9.378392e+05 1.438983e+06 7.402697e+05 7.099893e+05 7.325035e+05 8.446064e+05 9.930865e+05 8.978308e+05 8.952653e+05 8.407012e+05 8.014493e+05 7.749658e+05 1.008923e+06 8.734038e+05 3.196065e+05 3.867903e+05 6.200121e+05 4.858211e+05 1.103159e+06 1.371472e+06 8.833985e+05 9.432585e+05 1.253478e+06 1.103009e+06 9.623629e+05 9.723995e+05 8.420421e+05 7.705879e+05 6.765235e+05 6.185977e+05 8.135158e+05 1.675742e+06 9.307713e+05 1.091628e+06 1.261364e+06 8.019889e+05 5.829930e+05 8.586514e+05 1.031442e+06 1.249118e+06 1.281514e+06 7.465925e+05 1.059156e+06 7.659487e+05 7.534595e+05 6.496884e+05 1.410315e+06 1.411824e+06 1.054279e+06 6.115258e+05 9.963643e+05 8.196851e+05 1.294873e+06 9.457720e+05 1.330790e+06 9.349699e+05 1.210997e+06 1.419068e+06 1.099606e+06 7.465941e+05 8.992602e+05 2.906566e+06 1.608273e+06 1.298063e+06 1.879483e+06 2.496245e+06 1.776744e+06 1.102331e+06 1.075032e+06 9.741666e+05 7.506744e+05 1.116106e+06 2.010160e+06 6.237670e+05 5.991284e+05 5.573828e+05 9.104683e+05 8.787943e+05 8.254228e+05 4.980467e+06 5.090677e+06 6.055685e+06 4.312707e+06 4.330309e+06 5.812390e+06 4.451388e+06 4.988549e+06 8.983371e+06 5.341702e+06 4.544016e+05 6.014072e+06 1.013243e+06 1.249628e+07 4.829880e+05 6.429377e+05 4.970456e+05 7.328212e+05 4.098452e+06 4.563452e+06 4.174905e+06 C17 H37 N O7_1.757 8.769324e+04 7.752383e+05 7.185085e+05 7.294089e+05 6.879983e+04 7.487271e+05 7.907028e+05 8.803212e+05 105218.58 7.279106e+05 7.674413e+05 8.054157e+05 92324.13 7.074175e+05 7.474894e+05 6.659347e+05 1.062232e+05 8.349769e+05 7.130992e+05 9.125448e+05 1.509772e+05 7.301039e+05 6.745382e+05 6.473981e+05 66090.476 6.304282e+05 1.384700e+06 5.848530e+05 6.196012e+04 5.586582e+05 7.126469e+05 9.481259e+05 95022.18 7.404305e+05 6.848012e+05 5.950592e+05 1.112873e+05 6.841127e+05 9.265464e+05 8.302605e+05 9.741192e+04 7.406824e+05 7.872648e+05 7.880734e+05 1.498838e+05 7.279167e+05 7.902580e+05 7.092661e+05 5.395197e+05 5.889952e+05 2.248657e+05 5.254467e+05 3.246958e+05 6.273609e+05 2.075245e+05 9.976429e+05 3.706557e+05 3.997689e+05 3.802388e+05 8.603780e+05 4.952650e+05 4.589791e+05 3.442637e+05 2.782283e+05 2.432549e+05 7.870525e+05 4.984121e+05 2.199090e+05 2.022202e+05 1.773302e+05 2.941730e+05 2.225280e+05 3.435966e+05 2.113148e+05 4.622968e+05 4.462012e+05 4.119756e+05 6.740100e+05 1.913769e+05 6.620071e+05 5.815839e+05 5.711902e+05 4.088504e+05 4.656354e+05 4.605963e+05 6.258103e+05 2.538500e+05 2.639972e+05 3.896798e+05 4.505522e+05 5.632644e+05 3.392168e+05 5.273604e+05 3.122065e+05 5.125857e+05 4.426936e+05 5.078985e+05 8.157932e+05 2.542032e+05 4.861547e+05 3.973792e+05 3.073112e+05 5.193773e+05 4.255371e+05 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4.918572e+05 3.837803e+06 4.004476e+06 3.013114e+06 "(2Z,4Z,6Z)-2,4,6-Nonatrienal_1.759" 5.912368e+04 1.012215e+06 5.009064e+05 9.051815e+05 4.875186e+04 5.836258e+05 4.633854e+05 8.823322e+05 73152.62 6.510381e+05 8.034512e+05 8.998672e+05 57720.29 7.343498e+05 5.638401e+05 6.420899e+05 9.873719e+04 8.106576e+05 7.291023e+05 8.318462e+05 1.213102e+05 5.864063e+05 7.729111e+05 8.423302e+05 66697.592 6.584927e+05 6.730324e+05 8.320056e+05 6.447209e+04 6.068067e+05 7.494460e+05 9.789868e+05 84983.54 5.693251e+05 7.513210e+05 5.741108e+05 9.514129e+04 6.568187e+05 6.803965e+05 8.275164e+05 7.000144e+04 1.696072e+05 8.250141e+05 9.189614e+05 5.842436e+04 5.383712e+05 9.508825e+05 4.029008e+05 5.485805e+05 8.210438e+05 8.217058e+05 8.927587e+05 6.948451e+05 5.311311e+05 8.499425e+05 1.536582e+06 7.884911e+05 1.069122e+06 6.130396e+05 8.980664e+05 1.248075e+06 1.149579e+06 2.421129e+06 9.128278e+05 6.068149e+05 6.430184e+05 8.964964e+05 6.110523e+05 9.855207e+05 8.098110e+05 1.192416e+06 1.323426e+06 1.487572e+06 1.320278e+06 5.694217e+05 5.175254e+05 6.274462e+05 5.226813e+05 2.667665e+06 5.143215e+05 5.284535e+05 8.308590e+05 5.518874e+05 7.673908e+05 9.296780e+05 5.807543e+05 5.411339e+05 3.395895e+05 7.783251e+05 5.291003e+05 7.316072e+05 5.813289e+05 9.246925e+05 5.354568e+05 6.470579e+05 8.880097e+05 8.742029e+05 2.907781e+05 7.504970e+05 8.840497e+05 5.772710e+05 5.673499e+05 3.788980e+05 6.671899e+05 7.528965e+05 8.449355e+05 6.502180e+05 4.928107e+05 4.073038e+05 3.482571e+05 4.997103e+05 1.041804e+06 8.424463e+05 7.652101e+05 7.658705e+05 2.449884e+05 9.466694e+05 4.494182e+05 5.115896e+05 6.675571e+05 4.174373e+05 3.220358e+05 2.866965e+05 3.189900e+05 4.574421e+05 3.435399e+05 9.198941e+05 8.611700e+05 4.113120e+05 4.988590e+05 6.887391e+05 2.750600e+06 4.530938e+05 5.246886e+05 5.797258e+05 4.551552e+05 1.035346e+06 1.199854e+06 5.243410e+05 7.758581e+05 5.480283e+05 1.440926e+06 5.668178e+05 3.373220e+05 4.032424e+05 5.022780e+05 6.296081e+05 5.876876e+05 7.435837e+05 8.137924e+05 6.185666e+05 4.850865e+05 5.049205e+05 5.767685e+05 6.419229e+05 5.954373e+05 4.358647e+05 8.964927e+05 1.086326e+06 6.419371e+05 5.049807e+05 7.073038e+05 7.102289e+05 6.681920e+05 1.128102e+06 6.018040e+05 5.513095e+05 5.488964e+05 4.427872e+05 8.104575e+05 7.060328e+05 6.367875e+05 2.546350e+05 5.849502e+05 9.306519e+05 1.088279e+06 7.922649e+05 6.916134e+05 9.992069e+05 1.186810e+06 1.396950e+06 9.929432e+05 8.901011e+05 7.047478e+05 1.075946e+06 1.247229e+06 5.919728e+05 7.764560e+05 9.944024e+05 6.439061e+05 8.087660e+05 8.693301e+05 4.024589e+05 8.714122e+05 4.157993e+06 6.871837e+05 9.597524e+05 8.539047e+05 7.082864e+05 1.271742e+06 7.116715e+05 1.363954e+06 8.138824e+05 8.986118e+05 8.558501e+05 7.646865e+05 3.112556e+06 7.277257e+05 1.447031e+06 1.240427e+06 4.861539e+05 9.975061e+05 8.588706e+05 1.090316e+06 1.638987e+06 1.173807e+06 8.209864e+05 1.133407e+06 1.234246e+06 1.021966e+06 9.833974e+05 8.112489e+05 8.030645e+05 8.013873e+05 1.133378e+06 1.316592e+06 9.071103e+05 9.280201e+05 1.101210e+06 8.457793e+05 1.208586e+06 1.054581e+06 4.675353e+05 1.240263e+06 7.636131e+05 6.368066e+05 5.668229e+05 6.788725e+05 5.530861e+05 6.527997e+05 1.084476e+06 3.597653e+05 5.871226e+05 5.293872e+05 4.914335e+05 4.624078e+05 8.495464e+05 4.891213e+05 5.860488e+05 8.476759e+05 6.025769e+05 7.718277e+05 6.755031e+05 6.873486e+05 9.056201e+05 5.335561e+05 5.095578e+05 5.157253e+05 7.254520e+05 4.522284e+05 5.664172e+05 5.410431e+05 C10 H23 N O4_1.759 7.629706e+04 6.301180e+05 6.033214e+05 5.576381e+05 5.651483e+04 4.534441e+05 6.972750e+05 6.722089e+05 62315.20 4.644781e+05 6.152147e+05 5.238415e+05 44748.78 6.815926e+05 5.461835e+05 5.942771e+05 1.084009e+05 5.745634e+05 5.662067e+05 6.567092e+05 1.349540e+05 5.338227e+05 5.708164e+05 5.830788e+05 72335.992 5.171598e+05 6.519480e+05 6.122159e+05 6.703963e+04 6.142934e+05 5.645994e+05 6.254907e+05 95878.62 5.140047e+05 6.612907e+05 5.538436e+05 1.154893e+05 4.450100e+05 6.760846e+05 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6.598278e+05 9.990357e+05 123954.27 8.205644e+05 8.424507e+05 9.467024e+05 101989.80 8.391740e+05 8.054936e+05 7.816838e+05 1.155902e+05 9.755748e+05 8.791506e+05 7.971290e+05 1.741822e+05 7.422852e+05 9.517874e+05 1.079277e+06 83593.085 7.711843e+05 7.643946e+05 9.101546e+05 7.937939e+04 6.955371e+05 8.615435e+05 8.250134e+05 100847.46 1.001598e+06 8.833023e+05 8.631578e+05 1.124292e+05 8.304438e+05 7.670979e+05 9.835361e+05 1.042736e+05 5.752047e+05 9.825890e+05 1.118677e+06 1.479639e+05 7.345293e+05 9.123658e+05 7.226822e+05 2.451993e+05 5.094305e+05 2.966996e+06 1.307397e+06 3.019108e+05 1.324999e+06 2.594395e+05 7.263048e+06 3.169903e+06 3.505621e+06 7.818683e+05 7.949551e+06 6.024666e+06 3.162812e+06 3.583389e+05 1.187658e+06 2.280252e+06 1.240416e+06 5.075855e+05 3.015982e+06 1.867914e+05 4.569475e+05 3.491368e+06 3.869317e+06 1.326491e+06 2.483956e+05 3.630596e+06 4.115738e+05 1.967576e+05 5.132921e+05 6.083221e+06 1.364969e+06 5.987385e+05 7.779491e+05 1.793905e+05 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4.162326e+06 3.095091e+06 2.012791e+06 5.713463e+06 3.358916e+06 4.668106e+06 4.592248e+06 3.833888e+06 2.648578e+06 6.929792e+06 4.315416e+06 1.130884e+07 6.794929e+06 4.921571e+06 7.767354e+06 5.347582e+06 4.131127e+06 2.102064e+06 6.877991e+06 5.616829e+06 5.710040e+06 7.174978e+06 6.652359e+06 5.338684e+06 6.172235e+06 5.079776e+06 6.547780e+06 5.043435e+06 4.135339e+06 5.106301e+06 3.794294e+06 4.544421e+06 2.588666e+06 4.576211e+06 2.488854e+06 6.507017e+06 1.657691e+06 1.963082e+06 3.813024e+06 3.036250e+06 2.296593e+06 1.935329e+06 1.373258e+06 1.627975e+06 4.160778e+06 3.209848e+06 2.510509e+06 3.173016e+06 3.669154e+06 6.499481e+06 3.163227e+06 2.327812e+06 3.650776e+06 3.181941e+06 2.734570e+06 3.415439e+06 3.858596e+06 C5 H8 O_1.76 3.204200e+05 1.746657e+06 2.046833e+06 2.490187e+06 2.229797e+05 1.815715e+06 1.647100e+06 2.030842e+06 293206.49 1.655757e+06 2.071261e+06 3.419481e+06 235828.27 1.643632e+06 1.750449e+06 1.631486e+06 3.690827e+05 1.806037e+06 1.869589e+06 2.011259e+06 5.186109e+05 1.326988e+06 1.578433e+06 4.409154e+06 223588.775 1.105558e+06 1.627225e+06 1.867119e+06 2.524224e+05 1.900596e+06 1.947139e+06 2.349288e+06 292168.13 1.720224e+06 1.746209e+06 2.222779e+06 3.410047e+05 1.760512e+06 2.156867e+06 2.322032e+06 3.236678e+05 1.711794e+06 1.945045e+06 2.085238e+06 3.213010e+05 2.099028e+06 1.594971e+06 2.213174e+06 2.674403e+06 1.587335e+06 1.916507e+06 7.040463e+06 2.051947e+06 2.065639e+06 2.101685e+06 2.355490e+06 3.945024e+06 5.584613e+06 2.539334e+06 3.914682e+06 3.296503e+06 3.813570e+06 6.101808e+06 5.874174e+06 2.387297e+06 1.357361e+06 1.950931e+06 1.833711e+06 4.678269e+06 3.903890e+06 6.179381e+06 3.315471e+06 2.892252e+06 2.888402e+06 1.402338e+06 1.024183e+06 1.602067e+06 1.334552e+06 5.639917e+05 2.565616e+06 1.185212e+06 2.059086e+06 8.385187e+05 1.503759e+06 1.489547e+06 1.460271e+06 1.470082e+06 5.492599e+05 1.315686e+06 1.290445e+06 1.951967e+06 1.172572e+06 1.418642e+06 1.056191e+06 2.604684e+06 2.008930e+06 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6.035406e+05 7.077325e+05 5.369146e+05 3.921857e+05 6.177159e+05 5.694696e+05 6.115538e+05 5.904963e+05 3.760391e+05 4.472287e+05 8.214511e+05 1.388779e+06 6.243047e+05 4.287553e+05 3.243254e+05 6.379447e+05 7.880209e+05 4.189509e+05 7.274952e+05 4.947639e+05 7.629070e+05 7.158234e+05 5.438428e+05 3.879030e+05 6.190740e+05 5.421408e+05 9.402748e+05 8.133335e+05 4.433930e+05 4.690440e+05 5.860091e+05 7.212662e+05 4.588493e+05 4.402376e+05 5.918334e+05 7.436811e+05 4.738529e+05 6.104229e+05 4.969842e+05 5.218320e+05 1.006535e+06 5.774323e+05 4.267169e+05 6.321832e+05 C12 H14 N10_1.761 7.334708e+04 5.911885e+05 5.152359e+05 4.519224e+05 5.741135e+04 6.753505e+05 3.886195e+05 4.434748e+05 78147.30 4.737312e+05 5.747692e+05 6.163219e+05 49954.30 5.074914e+05 4.608715e+05 5.794753e+05 1.054900e+05 6.487611e+05 4.158034e+05 4.584856e+05 1.247756e+05 4.893631e+05 6.305206e+05 5.457775e+05 64707.252 4.280738e+05 6.484349e+05 4.621841e+05 6.536572e+04 6.034346e+05 4.990179e+05 5.257529e+05 97237.56 4.073071e+05 5.297667e+05 6.386928e+05 1.009498e+05 4.422829e+05 5.056911e+05 5.331724e+05 7.855312e+04 4.488537e+05 5.468429e+05 7.200658e+05 5.690981e+04 5.148940e+05 4.736617e+05 4.510505e+05 2.664157e+05 5.197009e+05 1.779214e+05 6.055385e+05 5.149731e+05 4.896001e+05 3.742558e+05 5.389117e+05 4.137407e+05 4.585812e+05 3.315507e+05 5.523310e+05 5.677433e+05 1.042294e+06 8.989052e+05 2.338243e+05 4.554518e+05 4.837899e+05 1.776037e+06 2.456617e+05 3.120853e+05 3.231156e+05 6.319549e+05 4.001735e+05 6.832400e+05 4.194147e+05 5.268564e+05 4.528252e+05 5.244086e+05 6.063737e+05 1.058368e+05 5.283956e+05 7.708380e+05 6.288715e+05 2.298676e+05 4.084492e+05 4.160396e+05 3.271373e+05 4.813260e+05 1.898810e+05 4.273575e+05 5.048469e+05 6.335402e+05 4.715769e+05 6.674119e+05 5.674359e+05 8.362966e+05 6.125411e+05 7.829775e+05 1.892893e+05 7.188938e+05 5.551389e+05 5.340142e+05 3.100461e+05 2.638458e+05 1.204198e+06 4.167300e+05 6.656277e+05 2.609198e+05 4.669342e+05 3.064315e+05 3.881638e+05 5.421624e+05 1.148146e+06 7.364657e+05 2.438260e+05 7.474629e+05 4.039044e+05 4.023805e+05 4.663991e+05 2.492232e+05 3.164556e+05 3.243036e+05 2.624892e+05 2.786142e+05 3.470372e+05 1.937352e+05 3.982832e+05 6.828718e+05 8.215207e+05 5.480947e+05 4.565956e+05 4.295932e+05 9.922413e+04 4.952906e+05 4.764502e+05 4.761406e+05 4.438109e+05 6.274239e+05 6.153463e+05 4.401798e+05 4.507396e+05 3.898782e+05 8.393871e+05 4.677365e+05 2.014871e+05 6.203996e+05 6.581830e+05 5.444176e+05 3.899763e+05 8.321101e+05 6.857188e+05 3.990957e+05 6.287954e+05 2.983358e+05 4.254950e+05 5.655286e+05 8.992316e+05 9.867181e+05 1.423096e+06 2.568616e+06 3.062118e+05 5.988911e+05 6.085352e+05 3.727504e+05 3.350097e+05 5.462185e+05 4.401367e+05 4.834925e+05 5.094527e+05 3.516217e+05 5.680578e+05 3.396218e+05 3.676763e+05 3.846989e+05 2.935391e+05 3.963650e+05 6.088808e+05 2.870798e+05 5.194632e+05 5.324069e+05 3.494806e+05 5.285616e+06 7.339827e+05 3.029207e+05 5.012226e+06 5.062071e+05 6.666274e+05 4.827194e+05 1.885454e+05 1.405074e+06 3.765641e+05 1.102642e+06 7.625722e+05 6.286311e+05 6.384110e+05 2.463800e+06 4.665311e+05 2.874278e+06 2.221681e+06 2.687027e+05 1.613140e+06 1.465477e+06 4.595911e+06 4.056293e+05 3.195777e+05 4.490861e+05 4.205801e+05 5.385303e+05 4.711720e+05 7.921352e+05 7.637976e+05 4.567783e+05 3.763048e+05 4.681781e+05 4.195397e+05 5.253777e+05 4.845032e+05 2.783451e+06 5.793347e+05 5.059919e+05 4.733567e+05 5.252609e+05 4.868136e+05 2.752022e+05 4.335299e+05 6.258295e+05 2.190556e+06 6.415220e+05 7.865246e+05 6.035081e+05 2.410786e+05 4.702334e+05 6.947503e+05 8.137518e+05 4.917456e+05 4.369048e+05 4.988717e+05 7.236106e+05 4.901232e+05 4.218880e+05 3.249451e+05 6.219277e+05 2.358844e+05 5.720666e+05 4.534526e+05 4.967769e+05 3.818361e+05 2.013579e+05 4.462812e+05 5.946539e+05 5.474916e+05 5.871536e+05 4.477141e+05 8.327836e+05 4.883775e+06 4.163450e+05 1.404754e+05 6.328920e+05 5.968457e+05 4.179185e+05 6.510540e+05 2.104381e+05 2.172167e+05 C9 H7 N O_1.761 2.846862e+06 1.478744e+06 1.399436e+06 1.316215e+06 1.151866e+05 1.195678e+06 1.186083e+06 1.941745e+06 109448.36 1.166798e+06 1.190784e+06 1.458420e+06 89364.13 1.436113e+06 1.222227e+06 1.268256e+06 1.967309e+05 1.420296e+06 1.452308e+06 1.423360e+06 2.354221e+05 1.165458e+06 1.512629e+06 1.507615e+06 134761.830 1.264412e+06 1.371438e+06 1.456695e+06 1.420728e+05 1.106844e+06 1.541091e+06 1.094338e+06 189551.22 1.476750e+06 1.305349e+06 1.487078e+06 1.948324e+05 1.432301e+06 1.272403e+06 1.613078e+06 1.661242e+05 9.470098e+05 1.392455e+06 1.762434e+06 1.106705e+05 1.234597e+06 1.446088e+06 1.169820e+06 5.565024e+05 8.810491e+05 3.476327e+06 1.894053e+06 8.122194e+05 1.742164e+06 1.257211e+06 7.855950e+06 3.609526e+06 4.129617e+06 1.200302e+06 8.343141e+06 8.292848e+06 4.173405e+06 1.403005e+06 1.989291e+06 2.824722e+06 1.574311e+06 9.279854e+05 3.601654e+06 5.442437e+05 8.951373e+05 3.588106e+06 4.062076e+06 1.575180e+06 7.975824e+05 4.700957e+06 7.006474e+05 7.735444e+05 8.503117e+05 6.493889e+06 1.555572e+06 9.281879e+05 1.360024e+06 5.246426e+05 7.893523e+05 6.057975e+05 2.103237e+06 3.034290e+05 1.364988e+06 5.667242e+05 6.343722e+05 1.780732e+06 6.558292e+05 5.202558e+06 4.049826e+05 1.157246e+06 3.740005e+06 5.941447e+05 2.506079e+06 1.164963e+06 8.851111e+05 2.717249e+06 1.409429e+06 3.840047e+05 5.883647e+05 5.511180e+05 9.119434e+05 2.107143e+06 1.097779e+06 8.345310e+05 6.896695e+05 9.628747e+05 1.450910e+06 4.462004e+06 2.089610e+06 3.363018e+06 6.761793e+05 8.989588e+06 5.705539e+05 1.705605e+06 9.893869e+05 9.268718e+05 1.017372e+06 1.533321e+06 3.002851e+05 9.860822e+05 4.623063e+05 1.340341e+06 1.472756e+06 7.071072e+05 8.566268e+05 3.579029e+06 6.262939e+05 9.256821e+05 8.762881e+05 1.212521e+06 1.409894e+06 9.642919e+05 5.298845e+06 4.405120e+05 5.636806e+05 1.497046e+06 1.129315e+06 2.406563e+06 1.806957e+06 7.894213e+05 1.061966e+06 4.200858e+05 6.366485e+05 4.060452e+05 6.543622e+05 7.634123e+05 9.771387e+05 4.305592e+05 5.492293e+06 5.061864e+05 5.147639e+05 8.885234e+06 6.704013e+05 1.234741e+06 8.016215e+05 8.429494e+05 1.389508e+06 1.090070e+06 7.224230e+05 5.126490e+06 1.229047e+06 1.168588e+06 1.659790e+06 2.324372e+06 1.316541e+06 9.983843e+05 8.856064e+05 2.142197e+06 6.454608e+05 7.088600e+05 6.428940e+05 8.675742e+05 7.812984e+05 1.142408e+06 5.899989e+05 5.091563e+05 1.759370e+06 1.604422e+06 1.854599e+06 3.705426e+06 1.884779e+06 1.262224e+06 1.373789e+06 1.643189e+06 6.597567e+05 9.810502e+05 7.429429e+05 6.376703e+05 1.171582e+06 7.637554e+05 9.138070e+06 1.796715e+06 2.457163e+06 6.092947e+05 1.105611e+06 3.400859e+06 1.083151e+06 8.858058e+06 2.839399e+06 2.035918e+06 7.831013e+05 9.892928e+05 1.369868e+06 7.690730e+05 1.035281e+06 5.956774e+05 5.557807e+05 2.704611e+06 1.104846e+06 4.491939e+05 5.878835e+05 5.196407e+05 1.682680e+06 1.056956e+06 2.215041e+06 1.284310e+06 1.638792e+06 1.617899e+06 1.367130e+06 1.342791e+06 1.363422e+06 8.592155e+05 7.906561e+05 3.650761e+06 8.659409e+05 4.023384e+06 6.138057e+05 1.361652e+06 2.292614e+06 1.175359e+06 1.006360e+06 6.480479e+05 9.756372e+06 8.202256e+06 6.783821e+05 7.939016e+06 1.060824e+06 1.179170e+06 1.554409e+06 8.766628e+05 1.382321e+06 4.902586e+06 1.214678e+06 1.368877e+06 7.956303e+05 6.437964e+06 2.523549e+06 6.042792e+05 7.452108e+06 3.060862e+06 3.260289e+06 1.111573e+06 1.414465e+06 3.155156e+05 1.146848e+06 1.391503e+06 8.852740e+05 C10 H16 O4_1.761 2.131306e+05 4.728919e+06 4.107181e+06 4.060133e+06 2.141235e+05 4.022534e+06 1.944767e+06 4.849787e+06 203200.44 4.342255e+06 4.393632e+06 4.411525e+06 207723.95 3.868972e+06 3.856808e+06 3.850207e+06 2.382325e+05 4.069977e+06 3.950195e+06 4.257186e+06 3.667120e+05 3.825523e+06 4.073778e+06 5.078379e+06 226883.147 3.404649e+06 4.320957e+06 2.507127e+06 4.717001e+05 4.043914e+06 4.520835e+06 5.787950e+06 268870.99 3.264624e+06 5.511274e+06 2.948469e+06 4.319729e+05 2.974509e+06 3.500196e+06 3.193325e+06 3.724637e+05 2.855740e+06 5.222269e+06 6.373156e+06 2.966160e+05 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3.367682e+05 4.983485e+05 8.068696e+05 1.069282e+06 7.337374e+05 4.009933e+05 C35 H58 N4 O7_1.764 1.942664e+05 1.179678e+06 1.151096e+06 1.100087e+06 1.699939e+05 9.468067e+05 1.170054e+06 1.331726e+06 145267.02 9.464228e+05 1.197300e+06 1.171064e+06 142791.71 1.196209e+06 1.045512e+06 9.322533e+05 3.465436e+05 1.066721e+06 1.101908e+06 1.340161e+06 3.862000e+05 1.064661e+06 1.048501e+06 1.193631e+06 203103.797 1.200645e+06 1.192736e+06 1.092138e+06 2.034809e+05 8.934275e+05 1.122273e+06 1.307357e+06 262097.80 1.038636e+06 1.149777e+06 1.210622e+06 2.828420e+05 9.381006e+05 1.173257e+06 1.198509e+06 2.420177e+05 8.590828e+05 1.378296e+06 1.188500e+06 1.396360e+05 1.053074e+06 1.111688e+06 1.069484e+06 7.466785e+05 4.954850e+05 5.481387e+05 5.885426e+05 4.748010e+05 5.049786e+05 6.357170e+05 6.592339e+05 5.521072e+05 5.893302e+05 5.877752e+05 5.278196e+05 6.307815e+05 6.092878e+05 6.228288e+05 5.852407e+05 6.153746e+05 4.771887e+05 6.032240e+05 5.729356e+05 5.388057e+05 6.051803e+05 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1.801588e+06 4.314316e+06 1.441203e+07 4.561341e+06 1.027441e+07 7.331111e+06 4.586292e+06 7.388500e+06 6.012481e+06 4.879179e+06 6.747025e+06 4.810085e+06 6.559130e+06 4.822207e+06 6.700101e+06 4.423593e+06 8.205594e+06 6.514811e+06 2.863514e+06 6.077328e+06 2.336058e+06 5.855171e+06 7.880555e+06 6.101722e+06 9.527042e+06 8.579401e+06 8.606134e+06 8.784823e+06 6.129869e+06 4.585089e+06 5.014490e+06 8.685784e+06 6.541450e+06 1.031861e+07 5.896205e+06 8.160933e+06 5.865084e+06 5.544179e+06 5.772427e+06 9.332436e+06 2.263957e+06 5.981709e+06 2.805461e+06 2.700999e+06 2.327105e+06 2.432039e+06 4.834709e+06 4.323890e+06 5.963731e+06 3.968552e+06 6.044002e+06 5.024625e+06 4.267180e+06 5.303051e+06 5.421257e+06 5.061464e+06 3.819905e+06 6.785327e+06 4.695130e+06 5.985660e+06 4.976760e+06 4.204178e+06 7.333529e+06 3.259722e+06 3.440161e+06 5.201600e+06 3.387028e+06 4.988855e+06 5.225620e+06 5.107863e+06 C33 H62 N9 O P S_1.766 4.037579e+04 8.408965e+05 7.992967e+05 7.160572e+05 5.810161e+04 6.266840e+05 8.168948e+05 8.955969e+05 49350.96 6.474766e+05 8.846994e+05 7.642193e+05 49372.97 8.351067e+05 7.156536e+05 5.695154e+05 1.218372e+05 7.324043e+05 7.605132e+05 9.906937e+05 1.325615e+05 7.013100e+05 7.017693e+05 7.979383e+05 69740.096 8.908541e+05 7.960160e+05 6.647415e+05 7.128805e+04 6.800864e+05 7.437758e+05 9.208758e+05 91206.79 6.782587e+05 8.158576e+05 8.778758e+05 9.811017e+04 6.205796e+05 7.977119e+05 8.363669e+05 8.476880e+04 5.191300e+05 9.238990e+05 8.407460e+05 4.787832e+04 7.818613e+05 7.665464e+05 6.956911e+05 3.465425e+05 1.725483e+05 1.882774e+05 2.062977e+05 1.646735e+05 1.746204e+05 2.236891e+05 2.290012e+05 1.971758e+05 2.031321e+05 2.034648e+05 1.842108e+05 2.202947e+05 2.088486e+05 2.188224e+05 2.040606e+05 1.950106e+05 1.636549e+05 2.083298e+05 1.983421e+05 1.866880e+05 2.091332e+05 2.254534e+05 2.061656e+05 2.334145e+05 2.309726e+05 1.884268e+05 1.640080e+05 1.956513e+05 2.233897e+05 2.045968e+05 2.122014e+05 1.590088e+05 1.561116e+06 1.443041e+05 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1.870031e+05 1.659121e+05 1.951728e+05 1.878485e+05 1.653956e+05 1.594696e+05 1.707815e+05 1.478433e+05 1.778597e+05 1.701245e+05 2.133614e+05 1.778844e+05 1.656260e+05 1.465035e+05 2.026540e+05 1.613241e+05 1.623334e+05 1.896702e+05 2.126565e+05 2.084306e+05 2.601511e+05 1.839278e+05 1.580984e+05 1.966792e+05 1.626092e+05 2.049328e+05 1.600558e+05 4.958143e+06 2.195002e+05 1.771141e+05 2.004729e+05 1.486481e+06 2.668711e+05 2.232697e+05 2.526438e+05 1.927228e+05 2.185910e+05 2.503165e+05 1.657515e+05 2.721354e+05 2.174480e+05 2.541812e+05 1.963283e+05 1.729224e+05 1.745916e+05 1.685677e+05 1.640462e+05 1.411890e+08 2.183460e+05 2.010808e+05 3.312715e+06 1.695329e+05 1.568469e+05 2.065720e+05 1.906683e+05 2.569273e+05 2.219188e+05 1.563033e+05 2.537167e+05 2.132133e+05 5.524072e+05 1.691784e+05 6.345033e+05 1.255625e+06 5.204338e+05 6.418660e+05 1.149324e+06 2.669100e+06 2.167521e+06 1.730858e+05 9.540676e+06 1.864203e+05 1.909044e+05 1.794536e+05 2.174875e+05 4.187606e+05 1.372951e+06 8.654375e+05 2.062220e+05 1.793597e+05 2.108542e+05 1.988165e+05 1.242203e+06 1.792635e+05 2.055394e+05 2.307712e+05 2.201155e+05 1.829647e+05 1.754797e+05 2.121142e+05 1.796591e+05 1.772106e+05 2.145580e+05 1.545478e+05 2.448136e+05 1.590007e+05 1.607422e+05 1.416964e+05 1.652880e+05 2.023867e+05 2.217040e+05 2.505478e+05 "Benzyl (2R,3S)-3-hydroxy-2-methylbutanoate_1.767" 2.715296e+05 4.393346e+06 6.027959e+06 4.540252e+06 1.520126e+05 6.080225e+06 8.180643e+06 5.235061e+06 194391.20 4.166079e+06 6.959287e+06 4.243691e+06 170374.41 7.036658e+06 3.999620e+06 5.479639e+06 2.399625e+05 6.253489e+06 6.874279e+06 4.543881e+06 3.597333e+05 6.611252e+06 4.527475e+06 6.406916e+06 215199.566 5.560792e+06 6.670445e+06 5.370927e+06 2.320785e+05 2.609092e+06 6.793412e+06 7.056821e+06 281652.98 4.396073e+06 6.270943e+06 6.614206e+06 2.773885e+05 4.593755e+06 5.515379e+06 5.862109e+06 2.329605e+05 3.932440e+06 6.697269e+06 7.131346e+06 2.409837e+05 4.407192e+06 6.644587e+06 4.626584e+06 4.042587e+06 4.470892e+06 9.738501e+05 9.161117e+06 5.816045e+06 3.909849e+06 5.809477e+06 5.687854e+06 6.750447e+06 8.095038e+06 5.484444e+06 4.142396e+06 1.370956e+07 5.221266e+06 6.485621e+06 8.543559e+06 7.910112e+06 5.807259e+06 3.694033e+06 6.199680e+06 5.393463e+06 9.356432e+06 8.350063e+06 4.446126e+06 1.126457e+07 1.289585e+07 6.798150e+06 7.355343e+06 3.150925e+06 6.111511e+06 6.095588e+05 7.505950e+06 7.515744e+06 5.943547e+06 4.449528e+06 2.501703e+06 3.635581e+06 4.626851e+06 1.568762e+06 2.256800e+06 3.886524e+06 5.519947e+06 7.861073e+06 6.770522e+06 7.114008e+06 4.399576e+06 5.053432e+06 5.734528e+06 9.082267e+06 1.898012e+06 6.219437e+06 4.336893e+06 4.815661e+06 4.631139e+06 3.472532e+06 5.609941e+06 5.892612e+06 7.225427e+06 5.370251e+06 7.284977e+06 3.343441e+06 4.803131e+06 3.187430e+06 8.324795e+06 6.325056e+06 4.208491e+06 7.810345e+06 3.077209e+06 4.527382e+06 6.595223e+06 4.314248e+06 6.389669e+06 1.686853e+06 2.318387e+06 2.546960e+06 5.395740e+06 3.298334e+06 5.096887e+06 9.262866e+06 2.357882e+06 5.881038e+06 4.037861e+06 8.749461e+06 5.873336e+05 2.114447e+06 7.224660e+06 6.482515e+06 5.047168e+06 8.584430e+06 7.221543e+06 4.892863e+06 5.752623e+06 3.182422e+06 1.424446e+07 8.370752e+06 3.678468e+06 4.042180e+06 5.664400e+06 3.073182e+06 2.934686e+06 8.083958e+06 8.151763e+06 4.682772e+06 3.543939e+06 5.936980e+06 4.839311e+06 4.574330e+06 5.338762e+06 1.049710e+07 1.115755e+07 8.879397e+06 2.427101e+06 3.275569e+06 6.065556e+06 5.467078e+06 6.263568e+06 7.003089e+06 4.845433e+06 5.803931e+06 4.561333e+06 4.234029e+06 5.223182e+06 5.680447e+06 4.813301e+06 5.004910e+06 6.459595e+06 5.058914e+06 5.220181e+06 1.019584e+07 7.563636e+06 6.393707e+06 8.912479e+06 6.378714e+06 7.334147e+06 3.963726e+06 5.165800e+06 5.097685e+06 1.001842e+07 5.391876e+06 1.688078e+06 2.113497e+06 2.585297e+06 1.944289e+06 5.181997e+06 3.428695e+06 8.092408e+06 1.038026e+07 5.034921e+06 1.809281e+06 7.136276e+06 2.583248e+06 2.436684e+06 4.947334e+06 5.952767e+06 7.310715e+06 4.435666e+06 8.004832e+06 4.508954e+06 3.913419e+06 1.828217e+06 8.114054e+06 8.718146e+06 8.348298e+05 5.186443e+06 6.883512e+06 7.738070e+06 1.492264e+06 4.966770e+06 2.120770e+06 6.940348e+06 7.971010e+06 7.132353e+06 7.415143e+06 5.249142e+06 5.326983e+06 6.818918e+06 7.804683e+06 1.200360e+07 6.297231e+06 4.748354e+06 5.333417e+06 8.213387e+06 9.651745e+06 8.845271e+06 6.719208e+06 5.089274e+06 7.731286e+06 3.105126e+06 6.159413e+06 5.571095e+06 5.078969e+06 5.782546e+06 1.070028e+07 3.744108e+06 9.865034e+06 4.915574e+06 3.562314e+06 2.700061e+06 8.144633e+06 4.997358e+06 2.446590e+06 6.621397e+06 5.176298e+06 7.085876e+06 8.056825e+06 4.464207e+06 1.361415e+07 3.173494e+06 4.304134e+06 8.308612e+06 1.976697e+06 5.587185e+06 3.287790e+06 4.760099e+06 1142.78659_1.767 1.124318e+05 1.714433e+06 1.574439e+06 1.730654e+06 8.321282e+04 1.180793e+06 1.640427e+06 2.046288e+06 91297.31 1.436989e+06 1.682421e+06 1.854228e+06 70803.46 1.478484e+06 1.222909e+06 1.467470e+06 1.687359e+05 1.787119e+06 1.577589e+06 1.745573e+06 1.902767e+05 1.511648e+06 1.399023e+06 2.113042e+06 122129.650 1.648688e+06 1.285603e+06 1.403627e+06 9.134264e+04 1.724421e+06 1.705080e+06 1.789777e+06 118892.32 1.690477e+06 1.610526e+06 1.243407e+06 1.340624e+05 1.265884e+06 1.964596e+06 1.736716e+06 1.088871e+05 1.328707e+06 1.986568e+06 1.407458e+06 8.725160e+04 1.861401e+06 1.578050e+06 1.389691e+06 1.375751e+06 1.627558e+06 7.632734e+05 1.209010e+06 8.316598e+05 1.283096e+06 1.280446e+06 9.572241e+05 1.027140e+06 1.121924e+06 1.069222e+06 1.997203e+06 1.307971e+06 1.478806e+06 1.562403e+06 1.497365e+06 1.192354e+06 1.267164e+06 2.144980e+06 1.096583e+06 1.099514e+06 1.168769e+06 1.918546e+06 1.680388e+06 1.776277e+06 1.351734e+06 1.056022e+06 1.252894e+06 1.669694e+06 1.348709e+06 7.064144e+05 1.609360e+06 1.634970e+06 1.906266e+06 1.075904e+06 1.961480e+06 1.638619e+06 1.464391e+06 9.353412e+05 8.232361e+05 1.675401e+06 1.701592e+06 2.083019e+06 1.661525e+06 1.692011e+06 1.417482e+06 1.683145e+06 1.173503e+06 1.257540e+06 1.130440e+06 1.441997e+06 1.550312e+06 1.533216e+06 1.305876e+06 9.408754e+05 1.596452e+06 1.789748e+06 1.320864e+06 1.135596e+06 1.218485e+06 7.642598e+05 1.034838e+06 1.427508e+06 1.850056e+06 1.624999e+06 1.341335e+06 1.784184e+06 9.737759e+05 1.757157e+06 1.148204e+06 1.127041e+06 1.689643e+06 1.037969e+06 1.010546e+06 6.424987e+05 2.169043e+06 1.184991e+06 1.359700e+06 2.944854e+06 2.166441e+06 1.527852e+06 1.666639e+06 1.735176e+06 2.777238e+05 1.530001e+06 1.331871e+06 1.471888e+06 1.773263e+06 1.774492e+06 2.100623e+06 1.381920e+06 1.808872e+06 4.726049e+05 2.183936e+06 2.869991e+06 5.868988e+05 6.413805e+05 8.799103e+05 9.819106e+05 7.837011e+05 1.427941e+06 1.584746e+06 9.522068e+05 1.509653e+06 1.030070e+06 1.651475e+06 1.081561e+06 1.554279e+06 1.905091e+06 2.170750e+06 2.352695e+06 1.932450e+06 1.954523e+06 1.671747e+06 1.392966e+06 1.278192e+06 1.689027e+06 1.291782e+06 9.991580e+05 1.241424e+06 1.673665e+06 1.361971e+06 1.238033e+06 1.141129e+06 1.232381e+06 1.210991e+06 1.794617e+06 2.003118e+06 1.095980e+06 1.109502e+06 1.518240e+06 1.181630e+06 1.679653e+06 1.342484e+06 1.644487e+06 2.577317e+06 1.644979e+06 1.799718e+06 1.042250e+06 1.467581e+06 2.550500e+06 1.258425e+06 1.756479e+06 1.600048e+06 8.999012e+05 1.804047e+06 2.636285e+06 1.494401e+06 3.149624e+06 2.404107e+06 9.935897e+05 2.730164e+06 2.243970e+06 2.767136e+06 1.146987e+06 1.157214e+06 1.378695e+06 1.251491e+06 1.956985e+06 1.063788e+06 1.833641e+06 1.806521e+06 1.386178e+06 1.361634e+06 1.462401e+06 1.527801e+06 1.768228e+06 2.189378e+06 3.954639e+06 1.827906e+06 2.566695e+06 1.579092e+06 2.284955e+06 1.499741e+06 1.386734e+06 1.839350e+06 2.528469e+06 2.594244e+06 1.638752e+06 2.191287e+06 3.503451e+06 1.533774e+06 2.042120e+06 1.637434e+06 1.511941e+06 1.731330e+06 1.554986e+06 1.789460e+06 1.532135e+06 1.289955e+06 1.538155e+06 1.456023e+06 1.884266e+06 2.375222e+06 2.549931e+06 3.952091e+06 2.537796e+06 2.798433e+06 4.306741e+06 2.502773e+06 2.776632e+06 4.274772e+06 3.716204e+06 8.379985e+05 3.174428e+06 1.462371e+06 4.639579e+06 8.497482e+05 9.001985e+05 6.892829e+05 1.319281e+06 2.203079e+06 2.292342e+06 2.654618e+06 C7 H21 N4 O5 P_1.767 4.379745e+04 4.461282e+05 3.425592e+05 3.133397e+05 5.247448e+04 1.731243e+05 3.308474e+05 4.221323e+05 48684.98 4.407531e+05 2.495495e+05 2.877850e+05 46518.16 3.057691e+05 3.214908e+05 3.632941e+05 1.004991e+05 4.536072e+05 3.041454e+05 2.310264e+05 1.214192e+05 2.992179e+05 3.944770e+05 4.737923e+05 61962.428 2.086378e+05 3.741179e+05 3.605149e+05 6.307174e+04 3.294442e+05 3.100353e+05 3.679444e+05 94525.21 2.235147e+05 4.350225e+05 3.891090e+05 1.049578e+05 3.329190e+05 2.174731e+05 2.417708e+05 9.132001e+04 4.321767e+05 2.806565e+05 4.842857e+05 4.614463e+04 3.227050e+05 2.880368e+05 1.366046e+05 4.360896e+05 3.477012e+05 2.435070e+05 3.696620e+05 2.007670e+05 2.521378e+05 2.380897e+05 1.905177e+05 2.510417e+05 1.982184e+05 2.727973e+05 3.279655e+05 4.540223e+05 3.126443e+05 3.018684e+05 2.893132e+05 3.471131e+05 2.367235e+05 2.221072e+05 2.141652e+05 3.708465e+05 1.837369e+05 4.435677e+05 2.981550e+05 2.969790e+05 2.848564e+05 1.646396e+05 3.138965e+05 1.730656e+05 3.147853e+05 8.511152e+04 3.088248e+05 3.620066e+05 4.693999e+05 1.775104e+05 3.716616e+05 2.078697e+05 1.760304e+05 2.468481e+05 2.294305e+05 2.402217e+05 3.731380e+05 3.622069e+05 3.369513e+05 2.460106e+05 2.645847e+05 3.079245e+05 2.685706e+05 2.511201e+05 2.280905e+05 2.858210e+05 3.632584e+05 3.383256e+05 3.436427e+05 1.260349e+05 4.540836e+05 3.113238e+05 2.960464e+05 2.657128e+05 2.330167e+05 1.127410e+05 1.461000e+05 1.644649e+05 3.694638e+05 2.523206e+05 2.656659e+05 3.984507e+05 1.989888e+05 4.801615e+05 1.939524e+05 1.859517e+05 2.121334e+05 2.194213e+05 1.295147e+05 1.408992e+05 2.122114e+05 2.502715e+05 1.754253e+05 3.910544e+05 3.297809e+05 3.015374e+05 3.066654e+05 3.678689e+05 1.037352e+05 1.154087e+05 1.969913e+05 2.841697e+05 2.676592e+05 1.672585e+05 2.335399e+05 1.805553e+05 3.292492e+05 1.566509e+05 3.619963e+05 3.182238e+05 1.300510e+05 2.045637e+05 1.820602e+05 1.702624e+05 1.621731e+05 3.038638e+05 5.735341e+05 2.295088e+05 3.345491e+05 2.521639e+05 4.008916e+05 3.235430e+05 2.432911e+05 3.458570e+05 4.582940e+05 3.440437e+05 3.236404e+05 4.138070e+05 1.830372e+05 1.725993e+05 1.648099e+05 3.505553e+05 2.544725e+05 2.017060e+05 1.525919e+05 1.984669e+05 1.933542e+05 2.098156e+05 2.279009e+05 1.955596e+05 1.299285e+05 2.635940e+05 4.018656e+05 2.439425e+05 3.574836e+05 3.968893e+05 2.857493e+05 3.112581e+06 1.607268e+05 3.244652e+05 1.942345e+06 4.096214e+05 3.910568e+05 3.419660e+05 1.256725e+05 5.349887e+05 1.955171e+05 7.626657e+05 5.510990e+05 4.264197e+05 4.575029e+05 7.827784e+05 3.264534e+05 1.210046e+06 7.861759e+05 2.255551e+05 1.005115e+06 1.093782e+06 1.745132e+06 4.789991e+05 3.250722e+05 1.830329e+05 2.162878e+05 3.475281e+05 2.468576e+05 3.545644e+05 4.144662e+05 1.627911e+05 1.512431e+05 2.246683e+05 3.241966e+05 3.690411e+05 4.048040e+05 1.193496e+06 4.857497e+05 3.119379e+05 3.647623e+05 3.990740e+05 1.649350e+05 2.755442e+05 4.247923e+05 3.569445e+05 5.957815e+05 3.532385e+05 3.885300e+05 3.316791e+05 5.242200e+05 3.401149e+05 5.535807e+05 3.749909e+05 3.934404e+05 3.986612e+05 1.727843e+05 1.794329e+05 2.004480e+05 3.298500e+05 2.561946e+05 3.215022e+05 3.122097e+05 4.102851e+05 2.650400e+05 3.515929e+05 2.169098e+05 4.614184e+05 2.412569e+05 3.188928e+05 3.379039e+05 3.649107e+05 4.339087e+05 4.253271e+05 3.006773e+05 4.769381e+05 1.665680e+05 1.910888e+05 4.389140e+05 4.743488e+05 2.397509e+05 2.029255e+05 2.068204e+05 C11 H11 N O2_1.769 6.315342e+06 2.508342e+06 4.138162e+06 3.735268e+06 3.660960e+04 3.518190e+06 2.522029e+06 5.014034e+06 39634.40 2.315767e+06 2.438772e+06 5.206440e+06 40444.26 4.186598e+06 2.459679e+06 2.898867e+06 1.139245e+05 2.462018e+06 3.139581e+06 5.838651e+06 1.371938e+05 1.555043e+06 3.275308e+06 3.370592e+06 72760.323 4.524102e+06 3.371344e+06 2.883364e+06 8.077227e+04 2.941774e+06 3.534030e+06 4.373473e+06 120729.84 2.497406e+06 4.304136e+06 2.052204e+06 1.376684e+05 3.275404e+06 4.161988e+06 4.523434e+06 1.248153e+05 1.218251e+06 3.714051e+06 4.787536e+06 8.026306e+04 3.514734e+06 3.254853e+06 2.496926e+06 1.871125e+06 7.976193e+06 3.819747e+06 2.152637e+06 3.663605e+06 3.723316e+06 1.976031e+06 6.725491e+06 1.306192e+07 1.217246e+07 2.413711e+07 2.537529e+06 3.515092e+06 3.041961e+06 4.145502e+05 5.165375e+06 2.603637e+06 2.458432e+06 7.783363e+06 8.626633e+06 7.098237e+06 1.728308e+06 1.263337e+07 2.481957e+06 2.108258e+06 2.497209e+06 5.758971e+06 2.322082e+06 2.756123e+06 1.343249e+07 6.032773e+06 2.864820e+06 3.365248e+06 1.870856e+06 1.852785e+06 8.239077e+06 8.888818e+06 4.541828e+06 3.423578e+06 3.343343e+06 1.617491e+06 1.950633e+06 3.355374e+06 2.326644e+06 7.308022e+06 1.623041e+07 5.329534e+06 1.349719e+07 1.492348e+07 8.635143e+06 2.227945e+06 5.458759e+06 2.240178e+06 2.553003e+06 8.870173e+05 2.408024e+06 2.823930e+06 1.935021e+06 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7.541465e+05 7.055329e+05 1.050763e+06 6.627379e+05 6.579684e+05 1.326649e+06 4.838350e+05 8.645066e+05 2.437741e+05 7.923591e+05 9.198658e+05 3.114515e+05 3.480128e+05 2.811546e+05 1.492431e+05 7.683130e+05 1.243027e+06 8.189772e+05 7.074859e+05 1.138543e+06 2.730553e+06 8.678045e+05 9.368278e+05 6.979823e+05 9.344912e+05 2.953099e+06 2.333838e+06 9.968822e+05 5.684657e+05 9.171873e+05 8.367547e+05 3.516956e+05 2.358819e+05 7.367266e+05 6.156776e+05 1.261960e+05 5.631733e+05 2.341968e+05 2.372097e+05 6.195846e+05 1.955936e+05 1.625589e+05 3.732055e+05 1.973285e+05 1.219796e+06 3.475870e+06 8.478916e+05 6.911971e+05 8.644621e+05 6.341796e+05 4.585794e+05 3.438572e+05 7.074207e+05 4.306519e+05 1.026555e+06 4.816304e+05 5.286139e+05 3.564082e+05 1.031992e+06 1.095464e+06 6.478193e+05 7.531549e+05 2.475398e+05 7.906955e+05 8.880080e+05 4.182079e+05 1.066810e+06 1.016389e+06 5.851259e+05 5.113207e+05 3.851707e+05 5.308121e+05 2.996897e+05 3.410219e+05 1.060100e+06 2.369542e+05 9.180136e+05 2.878159e+05 5.635578e+05 5.343970e+05 6.540471e+05 4.250335e+05 2.850172e+05 6.630240e+05 1.109233e+06 4.736652e+05 9.381109e+05 3.163102e+05 9.005698e+05 1.036201e+06 5.301611e+05 5.656313e+05 5.957929e+05 8.085771e+05 1.097402e+06 1.211069e+06 9.147014e+05 2.138990e+05 4.706114e+05 7.160732e+05 8.809491e+05 8.005515e+05 7.324845e+05 8.457073e+05 1.328521e+06 6.360497e+05 6.977657e+05 2.238765e+06 1.075271e+06 9.707928e+05 1.228434e+06 9.776566e+05 1.416051e+06 7.317955e+05 1.199637e+06 1.013992e+06 7.283375e+05 2.990990e+06 1.286916e+06 1.354288e+06 1.201518e+06 1.081495e+06 4.006477e+06 7.819680e+05 2.980675e+05 5.485573e+05 8.332098e+05 4.315329e+05 9.951092e+05 2.812517e+06 C32 H53 N5 O2 S_1.774 4.887405e+04 2.429473e+06 1.759477e+06 1.761543e+06 5.759463e+04 4.711567e+05 1.725773e+06 2.528332e+06 49790.21 1.341463e+06 2.265373e+06 2.216403e+06 53602.66 1.161149e+06 1.373390e+06 1.239310e+06 1.402260e+05 1.604435e+06 1.884052e+06 2.373131e+06 1.435669e+05 1.369435e+06 1.117802e+06 2.823931e+06 82890.780 1.501595e+06 1.296324e+06 1.995175e+06 6.009422e+04 1.429818e+06 1.755999e+06 2.613501e+06 84210.80 1.518302e+06 1.458689e+06 1.397567e+06 1.040876e+05 1.243610e+06 1.918264e+06 2.253513e+06 8.627997e+04 1.261939e+06 1.790616e+06 2.411989e+06 5.679691e+04 1.392460e+06 1.635973e+06 1.635705e+06 1.307769e+06 2.555900e+06 7.070009e+05 1.336515e+06 8.011501e+05 1.305856e+06 1.389848e+06 8.115284e+05 9.863606e+05 1.135155e+06 1.147564e+06 3.001416e+06 1.174495e+06 1.414147e+06 1.673848e+06 1.669516e+06 1.327342e+06 1.072603e+06 2.684778e+06 1.085947e+06 1.091648e+06 1.019653e+06 2.193562e+06 1.685055e+06 1.784152e+06 1.277194e+06 7.701224e+05 1.799298e+06 1.866909e+06 1.310788e+06 5.350993e+05 2.253079e+06 2.343619e+06 2.249218e+06 1.197970e+06 3.061033e+06 1.650481e+06 1.490810e+06 8.891005e+05 8.552067e+05 1.602439e+06 1.960483e+06 1.863478e+06 2.354123e+06 1.546553e+06 1.335582e+06 1.704699e+06 1.247754e+06 1.298698e+06 1.212180e+06 1.559587e+06 1.618519e+06 1.653142e+06 1.751482e+06 8.277183e+05 2.060300e+06 1.868371e+06 1.163801e+06 1.079421e+06 1.234214e+06 6.595878e+05 9.167899e+05 1.261095e+06 2.030382e+06 1.642431e+06 1.807532e+06 2.261405e+06 9.946212e+05 1.632634e+06 1.271825e+06 1.016081e+06 2.865695e+06 1.109160e+06 1.063338e+06 6.574270e+05 1.608320e+06 1.863227e+06 1.518679e+06 3.966471e+06 1.721448e+06 2.105394e+06 2.476409e+06 1.460675e+06 2.265534e+05 1.436225e+06 1.703309e+06 1.497670e+06 2.397651e+06 1.608608e+06 2.831079e+06 1.207958e+06 2.313071e+06 4.993334e+05 3.122591e+06 4.626023e+06 5.101792e+05 6.439572e+05 7.818983e+05 1.045466e+06 6.986670e+05 1.353787e+06 1.673884e+06 9.586601e+05 1.401667e+06 9.812404e+05 1.601795e+06 9.761823e+05 1.507845e+06 2.424127e+06 3.338767e+06 3.658266e+06 2.501917e+06 1.845836e+06 2.095199e+06 1.390758e+06 1.175722e+06 1.793972e+06 1.361445e+06 1.115184e+06 1.276642e+06 1.811940e+06 1.513933e+06 1.169184e+06 1.113484e+06 1.373643e+06 1.062978e+06 2.444801e+06 2.223311e+06 9.923104e+05 1.238937e+06 2.349989e+06 1.265945e+06 4.488679e+06 1.198333e+06 2.404953e+06 3.098301e+06 2.173740e+06 2.199390e+06 1.024659e+06 1.241905e+06 3.442674e+06 1.353919e+06 2.344650e+06 1.981731e+06 9.219012e+05 3.220360e+06 4.782330e+06 1.407231e+06 3.917979e+06 3.233614e+06 8.616814e+05 4.203050e+06 3.560525e+06 4.258841e+06 1.269400e+06 1.110673e+06 1.433829e+06 1.335808e+06 2.193266e+06 2.086715e+07 2.200519e+06 2.636109e+06 1.467849e+06 1.225753e+06 1.289509e+06 1.336785e+06 2.545886e+06 2.813833e+06 3.672647e+06 2.657051e+06 3.239757e+06 2.200079e+06 2.487384e+06 1.434288e+06 1.418353e+06 2.322932e+06 3.705407e+06 3.613243e+06 1.852053e+06 3.680695e+06 2.271096e+06 2.238291e+06 2.831940e+06 2.456915e+06 1.446693e+06 1.682126e+06 2.447596e+06 1.340549e+06 1.549882e+06 1.118302e+06 2.267345e+06 1.496056e+06 1.715016e+06 3.861775e+06 3.276442e+06 5.034829e+06 2.662522e+06 3.649185e+06 4.821945e+06 2.998927e+06 4.902965e+06 6.947532e+06 4.274350e+06 7.348210e+05 3.981976e+06 1.365781e+06 9.182828e+06 9.207649e+05 8.810270e+05 7.701834e+05 1.433892e+06 2.435989e+06 2.717342e+06 5.238090e+06 Ethyl 2-pyrrolecarboxylate_1.775 1.061219e+05 1.106222e+06 9.826760e+05 6.678881e+05 6.659372e+04 7.917569e+05 1.151153e+06 9.621256e+05 53258.66 9.123688e+05 9.708176e+05 1.116732e+06 48141.45 9.379933e+05 6.405217e+05 1.189127e+06 1.090848e+05 7.911521e+05 1.029735e+06 1.005701e+06 1.342912e+05 7.824882e+05 1.020148e+06 1.184193e+06 120055.852 6.612320e+05 1.043988e+06 9.471471e+05 1.328527e+05 7.316433e+05 9.893306e+05 1.331745e+06 146110.29 7.194890e+05 9.779138e+05 9.764609e+05 1.194781e+05 7.801002e+05 8.781539e+05 9.924970e+05 1.020311e+05 8.003307e+05 1.114710e+06 1.291097e+06 5.814568e+04 6.646882e+05 9.640580e+05 8.773802e+05 8.320696e+05 8.863678e+05 1.120079e+06 3.915229e+06 1.368039e+06 1.059093e+06 1.528977e+06 1.932255e+06 1.187756e+06 1.966798e+06 2.146942e+06 1.561132e+06 2.439061e+06 1.850578e+06 1.669523e+06 1.934400e+06 1.662615e+06 6.395765e+05 1.242283e+06 1.040155e+06 1.099035e+06 1.193057e+06 1.873206e+06 1.963633e+06 2.877993e+06 1.302123e+06 1.324132e+06 2.048781e+06 1.016002e+06 1.343659e+06 1.094695e+05 1.455012e+06 1.011874e+06 1.087684e+06 6.723926e+05 1.206270e+06 9.049172e+05 9.956577e+05 7.133371e+05 3.494219e+05 5.489361e+05 7.413564e+05 1.501511e+06 8.563125e+05 1.197054e+06 7.906190e+05 1.198840e+06 1.323753e+06 6.737097e+05 8.657542e+05 1.079501e+06 7.166787e+05 9.913022e+05 6.723423e+05 5.272714e+05 8.001013e+05 1.061689e+06 6.814012e+05 5.356544e+05 9.301504e+05 9.843065e+05 4.857411e+05 8.211332e+05 1.247085e+06 1.243857e+06 5.916454e+05 9.336263e+05 6.193617e+05 1.270350e+06 1.005601e+06 7.241724e+05 1.189874e+06 7.676367e+05 4.847370e+05 3.961387e+05 1.723862e+05 9.545735e+05 7.715448e+05 1.348175e+06 1.012240e+06 1.112501e+06 1.196359e+06 1.447496e+06 1.180646e+05 8.431249e+05 7.659609e+05 8.973722e+05 7.128214e+05 1.215509e+06 1.215942e+06 9.488785e+05 9.453286e+05 1.002866e+06 5.499600e+05 1.206877e+06 6.600971e+05 9.597708e+05 1.183633e+06 1.096584e+06 1.153187e+06 2.029466e+05 1.320393e+06 1.423235e+06 1.193218e+06 6.399493e+05 7.774319e+05 6.699486e+05 1.270477e+06 1.203214e+06 1.019890e+06 1.351027e+06 9.029335e+05 6.727915e+05 1.532869e+06 7.467202e+05 8.728940e+05 1.184441e+06 8.389900e+05 1.081939e+06 9.933164e+05 7.557195e+05 8.371644e+05 1.086180e+06 7.614552e+05 1.358013e+06 1.129221e+06 1.518766e+06 1.180962e+06 1.438694e+06 9.667828e+05 1.512683e+06 4.153982e+06 1.548755e+06 4.164011e+05 7.417498e+05 1.358583e+06 5.238048e+05 8.763354e+05 1.175825e+06 7.458891e+05 1.048868e+06 9.567363e+05 1.679044e+06 5.622889e+05 4.619538e+05 1.044489e+06 1.173096e+06 9.501295e+05 7.869438e+05 8.820175e+05 8.263338e+05 7.650367e+05 1.336778e+06 1.231679e+06 1.182711e+06 6.134372e+05 1.162067e+06 6.850874e+05 9.523984e+05 9.144012e+05 1.172912e+06 7.883649e+05 6.411339e+05 9.046812e+05 7.782842e+05 1.209770e+06 8.453478e+05 1.321983e+06 1.140134e+06 9.467254e+05 1.008219e+06 1.028017e+06 8.063293e+05 8.565890e+05 8.778436e+05 9.558432e+05 1.029218e+06 1.036088e+06 1.457551e+06 1.131103e+06 1.277697e+06 1.246422e+06 1.232626e+06 9.621524e+05 7.910831e+05 1.291750e+06 8.777088e+05 9.000919e+05 1.161083e+06 5.872928e+05 1.161900e+06 1.537222e+06 1.647194e+06 2.631212e+06 1.098640e+06 1.041652e+06 1.043717e+06 9.139214e+05 1.337090e+06 5.840408e+05 9.766013e+05 2.315415e+06 1.446972e+06 1.047501e+06 1.014190e+06 1.550238e+06 2.766696e+06 6.248252e+05 8.112518e+05 8.971344e+05 2.916437e+05 2.172710e+05 1.131715e+06 9.548830e+05 C15 H24 N10_1.775 2.717166e+05 5.321019e+05 5.149755e+05 6.618482e+05 6.121643e+04 5.495384e+05 5.069543e+05 6.350860e+05 74200.10 5.356822e+05 5.544738e+05 5.673596e+05 74971.05 4.090161e+05 7.140485e+05 5.322278e+05 1.550300e+05 5.008302e+05 4.743094e+05 7.545446e+05 1.642883e+05 4.505399e+05 6.101466e+05 5.075877e+05 87119.132 5.273430e+05 7.282804e+05 3.798069e+05 9.011689e+04 5.713832e+05 6.337129e+05 5.857370e+05 128815.50 5.087588e+05 5.637430e+05 3.355112e+05 1.259530e+05 6.236318e+05 6.339051e+05 6.354606e+05 9.578015e+04 4.385936e+05 5.489164e+05 6.835907e+05 5.685041e+04 6.429674e+05 4.185429e+05 5.412707e+05 5.332286e+05 1.054065e+06 3.329948e+05 2.809296e+05 2.365855e+05 3.807398e+05 5.540091e+05 7.079028e+05 5.680849e+05 3.246626e+05 6.253263e+05 2.760411e+06 5.653453e+05 4.674363e+05 6.830675e+05 5.646645e+05 2.398720e+05 1.975515e+05 2.983959e+06 2.863682e+05 4.951514e+05 3.128340e+05 3.177390e+05 2.892920e+05 2.921969e+05 4.025824e+05 5.189058e+05 2.040545e+05 5.332892e+05 7.280823e+05 1.333742e+05 5.527577e+05 2.418412e+05 5.520261e+05 4.192636e+05 4.398972e+05 2.414948e+05 4.234166e+05 3.848654e+05 2.688121e+05 3.864810e+05 3.703969e+05 8.461633e+05 2.982967e+05 5.660949e+05 1.038868e+06 2.623725e+06 4.491909e+05 2.762005e+05 1.806410e+05 2.853350e+05 5.749188e+05 1.074458e+06 7.982351e+05 1.763105e+05 3.579002e+05 1.569220e+06 7.730828e+05 7.264934e+05 8.114224e+05 1.619698e+05 4.913173e+05 6.873914e+05 8.118765e+05 8.610971e+05 8.848052e+05 9.073776e+05 3.456147e+05 3.091580e+05 2.207273e+05 2.381956e+05 8.630611e+05 5.075802e+05 4.133895e+05 3.541105e+05 7.852811e+05 5.848529e+05 2.681892e+05 4.068606e+06 6.169268e+05 8.636874e+05 5.170124e+05 4.388893e+05 1.577041e+05 7.340808e+05 4.429583e+05 7.119110e+05 7.186336e+05 5.056831e+05 9.583213e+05 6.121434e+05 5.853030e+05 6.041399e+05 9.446423e+05 1.091137e+06 5.561472e+05 5.296077e+05 1.130171e+06 6.416866e+05 5.691781e+05 8.338825e+05 1.535243e+06 7.482373e+05 1.646576e+06 1.831740e+06 3.588005e+05 1.691244e+05 2.237115e+05 2.709166e+05 7.857790e+05 5.578708e+05 4.865419e+05 3.267828e+05 6.687737e+05 7.646377e+05 3.535742e+05 7.166357e+05 4.204082e+05 7.495190e+05 3.447734e+05 3.048027e+05 5.927561e+05 3.488816e+05 9.478464e+05 5.738539e+05 3.329638e+05 5.085913e+05 5.984110e+05 4.798268e+05 2.369742e+05 5.404031e+05 2.741188e+05 1.026768e+06 4.812042e+05 3.726118e+05 3.607507e+06 2.771537e+05 5.065764e+05 8.191210e+05 5.261531e+05 6.461769e+06 2.089155e+05 5.967386e+06 4.535279e+05 3.021800e+05 4.117814e+05 1.272845e+06 7.481596e+05 3.235741e+06 2.291676e+06 7.050169e+05 3.919441e+06 7.332113e+06 3.881227e+06 4.721510e+05 7.377554e+05 4.733779e+05 2.433700e+05 5.022421e+05 1.738727e+05 6.807062e+05 5.499483e+05 4.458631e+05 3.715050e+05 4.952630e+05 4.282759e+05 4.755844e+05 4.841919e+05 5.747077e+06 4.750223e+05 7.117668e+05 3.526349e+05 8.234642e+05 4.520610e+05 3.777660e+05 5.501874e+05 7.373847e+05 3.032300e+06 4.636900e+05 6.065419e+05 3.876944e+05 2.488115e+05 3.183692e+05 6.167204e+05 2.736948e+05 1.074364e+06 6.019870e+05 4.179597e+05 4.540063e+05 4.203199e+05 6.683190e+05 4.004313e+05 5.778881e+05 2.588022e+05 3.031478e+05 6.323219e+05 2.910293e+05 2.835739e+05 3.663172e+05 2.862251e+05 3.333727e+05 6.058137e+05 7.047233e+05 4.342131e+05 3.298417e+05 5.087685e+05 6.266680e+05 2.007397e+05 5.456687e+05 4.169772e+05 2.079254e+05 2.558042e+05 4.824486e+05 4.629478e+05 C14 H5 N2 O4 P3_1.777 5.130858e+04 7.603957e+07 7.506461e+07 6.948041e+07 6.063036e+04 5.483088e+07 7.129965e+07 8.920530e+07 53482.03 7.175597e+07 7.393876e+07 8.394638e+07 52270.09 5.526080e+07 6.448538e+07 6.911786e+07 1.204036e+05 7.440905e+07 7.261691e+07 8.300920e+07 1.439386e+05 6.274316e+07 7.213100e+07 8.259090e+07 81896.402 6.020578e+07 7.980439e+07 7.809122e+07 8.334642e+04 5.095214e+07 7.415833e+07 9.145307e+07 110196.14 6.077505e+07 7.148821e+07 7.748384e+07 1.133630e+05 4.501929e+07 1.000799e+08 8.074676e+07 9.899835e+04 4.583981e+07 6.198783e+07 1.007588e+08 5.883476e+04 6.297475e+07 8.487848e+07 5.464920e+07 5.238987e+07 1.626804e+08 1.573580e+07 4.771596e+07 2.299784e+07 1.463582e+08 2.002967e+05 2.631502e+05 2.459350e+07 2.152449e+05 3.836246e+07 1.164271e+08 2.759528e+07 1.799669e+06 8.766636e+07 1.456672e+07 7.897093e+06 1.945923e+07 2.870620e+07 6.503203e+05 2.066624e+07 4.524491e+07 1.209313e+06 2.195757e+05 4.519921e+07 1.560749e+07 2.894678e+07 3.279676e+05 3.302500e+07 1.393893e+07 1.004590e+05 1.611395e+07 1.398875e+06 3.093528e+07 2.178630e+07 1.310785e+07 3.809219e+06 2.327037e+07 1.008269e+07 8.324176e+05 1.947081e+07 8.597486e+06 1.982202e+07 2.469422e+07 4.772503e+07 2.509562e+06 6.043803e+05 5.871451e+05 1.248880e+07 4.896829e+05 6.640605e+06 2.153384e+07 1.528278e+05 1.123912e+07 3.039376e+05 2.325161e+07 1.122548e+07 1.553084e+07 2.259613e+07 1.479847e+07 1.517742e+05 1.648663e+05 4.937992e+05 8.798689e+06 3.026332e+06 4.849689e+05 1.072481e+06 5.483243e+05 4.534601e+05 7.691311e+05 3.027595e+05 2.859351e+05 1.735883e+05 2.023395e+05 1.723607e+05 2.346997e+06 1.956187e+05 1.781735e+05 2.483751e+05 3.089629e+05 1.742804e+05 5.447952e+05 1.938092e+05 1.118665e+05 2.807690e+05 1.832413e+05 1.622577e+05 2.886266e+05 2.269889e+05 2.809869e+05 1.845135e+05 1.980134e+05 1.766283e+05 2.608938e+05 2.815699e+05 1.747077e+05 1.845610e+05 2.593427e+05 3.246868e+05 1.780045e+05 2.111620e+05 2.577170e+05 1.929456e+05 2.455515e+05 1.870784e+05 3.043580e+05 2.860547e+05 2.066388e+05 2.313924e+05 2.110384e+05 6.525663e+05 1.335349e+05 2.010874e+05 1.890215e+05 6.217299e+07 5.567979e+07 2.427324e+08 1.076178e+08 8.180825e+07 1.825588e+08 3.128239e+07 2.026521e+08 1.094808e+08 8.963416e+07 1.518673e+08 1.541343e+08 2.319335e+08 8.738983e+07 1.940255e+07 2.967981e+07 2.393039e+06 5.172379e+07 2.297195e+07 4.087276e+08 3.820479e+08 4.591503e+06 6.216720e+07 3.196419e+08 2.817305e+08 1.536090e+07 1.969149e+07 1.925039e+08 1.492400e+07 7.384710e+07 2.111989e+08 3.874946e+07 3.890266e+08 6.241148e+07 5.799527e+07 4.001161e+07 5.998459e+06 9.537225e+05 8.002888e+06 8.556998e+06 1.781139e+08 2.263884e+08 3.655507e+08 2.145635e+08 2.574315e+08 4.772913e+07 2.838900e+08 9.212368e+07 1.922333e+07 4.751901e+08 8.498207e+07 4.922031e+08 1.337436e+08 4.581516e+08 4.757185e+07 1.260345e+08 5.644577e+08 1.850180e+08 5.074150e+08 3.802458e+08 2.071538e+07 4.171979e+06 6.825964e+07 4.486572e+08 8.632761e+07 3.332680e+07 1.110612e+08 6.609858e+07 2.544420e+07 1.545739e+08 1.291410e+08 3.021996e+07 9.564655e+07 1.487052e+08 4.515100e+08 1.217628e+07 6.257454e+07 2.422828e+07 7.322781e+06 3.846799e+08 4.793925e+07 1.360803e+08 5.239234e+07 1.490053e+07 4.537434e+07 2.537629e+07 1.871159e+07 8.413366e+07 9.271985e+06 8.047319e+06 1.451604e+07 7.704686e+06 6.553354e+06 9.542806e+05 3.718952e+06 2.125592e+06 3.447951e+07 4.686316e+07 9.164274e+07 1.331735e+08 C43 H96 N6 O9 P2 S_1.777 4.742861e+04 1.457246e+06 1.420760e+06 1.517510e+06 5.856342e+04 1.620426e+06 1.073237e+06 1.748127e+06 62066.73 1.431614e+06 1.643195e+06 1.656669e+06 62633.90 1.321363e+06 1.443603e+06 1.187349e+06 1.484188e+05 1.463142e+06 1.523182e+06 1.688390e+06 1.659276e+05 1.171804e+06 1.789415e+06 1.513796e+06 86988.382 1.317903e+06 1.470492e+06 1.537966e+06 8.498420e+04 1.439181e+06 1.373383e+06 1.596610e+06 115780.61 1.547096e+06 1.418461e+06 1.537763e+06 1.228347e+05 1.117221e+06 1.616788e+06 1.748898e+06 1.035409e+05 1.164737e+06 1.713177e+06 1.448032e+06 5.872115e+04 1.404568e+06 1.306829e+06 1.601423e+06 1.250407e+06 1.796626e+06 4.821095e+05 9.003012e+05 8.319794e+05 1.551037e+06 8.122649e+05 6.603940e+05 9.821437e+05 8.799253e+05 5.966438e+05 1.855580e+06 1.136932e+06 1.431958e+06 1.265172e+06 9.861765e+05 9.304734e+05 1.472436e+06 1.874481e+06 6.458055e+05 8.139507e+05 6.558985e+05 9.895141e+05 1.321600e+06 1.152456e+06 8.814873e+05 1.221270e+06 1.267672e+06 1.307850e+06 1.452724e+06 6.954191e+06 1.320746e+06 1.580039e+06 1.659027e+06 1.144029e+06 1.627824e+06 1.161518e+06 1.612957e+06 9.634550e+05 7.753972e+05 1.502783e+06 1.689472e+06 1.499709e+06 1.358054e+06 1.249919e+06 1.100737e+06 1.629565e+06 1.160498e+06 2.194094e+06 1.670353e+06 1.135808e+06 1.171369e+06 1.401329e+06 1.421451e+06 1.000541e+06 1.216581e+06 9.072705e+05 1.424169e+06 7.472084e+05 1.472555e+06 8.916232e+05 1.074828e+06 1.636821e+06 1.764614e+06 1.554987e+06 1.486983e+06 2.298457e+06 8.925030e+05 2.831150e+06 1.512508e+06 1.332002e+06 2.045497e+06 9.336430e+05 7.734173e+05 7.151951e+05 1.737862e+06 1.354223e+06 9.906836e+05 2.893765e+06 1.263127e+06 1.250649e+06 1.603125e+06 1.607582e+06 1.279808e+06 1.307462e+06 1.700660e+06 1.580814e+06 2.027792e+06 1.598055e+06 2.306991e+06 1.062745e+06 1.665502e+06 4.810981e+05 2.568273e+06 3.105020e+06 3.402674e+05 5.272113e+05 7.055471e+05 5.984010e+05 6.151607e+05 6.449059e+05 9.268373e+05 6.923367e+05 1.188943e+06 7.505768e+05 1.692682e+06 1.107589e+06 1.348424e+06 1.845413e+06 1.943894e+06 2.403016e+06 1.732327e+06 1.335308e+06 1.730124e+06 1.151243e+06 1.343788e+06 1.502144e+06 1.296850e+06 1.196211e+06 1.350801e+06 1.410885e+06 1.239170e+06 1.768725e+06 9.589160e+05 1.606073e+06 1.065920e+06 1.372742e+06 1.874437e+06 6.450177e+05 7.936156e+05 1.018734e+06 8.902008e+05 1.852716e+06 1.178390e+06 1.377567e+06 1.596146e+06 1.769020e+06 2.115264e+06 1.076656e+06 1.023681e+06 1.527972e+06 4.942502e+05 1.672702e+06 1.249044e+06 7.095302e+05 1.849893e+06 2.071786e+06 1.731511e+06 1.942745e+06 2.065748e+06 1.160487e+06 2.582867e+06 1.848392e+06 2.276756e+06 1.397312e+06 1.247846e+06 1.355510e+06 1.547829e+06 1.880219e+06 7.978610e+05 1.785457e+06 2.102314e+06 1.355355e+06 1.132856e+06 1.338605e+06 1.584949e+06 1.609263e+06 1.827239e+06 3.444327e+06 1.618086e+06 2.699051e+06 2.838532e+06 1.925486e+06 1.335586e+06 1.368457e+06 1.810709e+06 2.394632e+06 3.248010e+06 2.563407e+06 1.921861e+06 3.392594e+06 2.026684e+06 1.764123e+06 1.367136e+06 1.300007e+06 1.687296e+06 1.516150e+06 1.117252e+06 1.096594e+06 5.649074e+05 1.792714e+06 1.413137e+06 1.563396e+06 3.099537e+06 3.712008e+06 3.584352e+06 2.875056e+06 2.324511e+06 4.372184e+06 2.401938e+06 3.828103e+06 5.443492e+06 4.100891e+06 8.165508e+05 3.564260e+06 1.477068e+06 7.282040e+06 7.697516e+05 7.602779e+05 4.608403e+05 1.213810e+06 2.729233e+06 3.412016e+06 3.857667e+06 3-(2-HYDROXYPHENYL)PROPANOATE 3.319053e+05 1.694376e+07 1.407811e+07 1.308589e+07 9.470516e+04 1.309132e+07 1.473740e+07 1.735889e+07 87601.69 1.401426e+07 1.551578e+07 1.534335e+07 80064.56 1.374755e+07 1.480540e+07 1.390062e+07 1.863649e+05 1.412202e+07 1.595230e+07 1.470906e+07 2.272303e+05 1.327488e+07 1.570702e+07 1.747533e+07 125812.210 1.127788e+07 1.661897e+07 1.512939e+07 1.224235e+05 1.236849e+07 1.498515e+07 1.814323e+07 170813.51 1.289753e+07 1.484742e+07 1.552398e+07 1.923638e+05 1.204417e+07 1.598423e+07 1.502137e+07 1.761050e+05 1.081110e+07 1.644541e+07 2.004644e+07 9.990925e+04 1.109856e+07 1.764550e+07 1.162830e+07 7.865273e+06 1.358063e+07 6.340692e+06 1.543963e+07 1.043170e+07 1.185533e+07 1.208359e+07 1.270529e+07 1.364065e+07 1.475024e+07 1.384139e+07 1.448683e+07 1.859739e+07 6.135593e+06 1.403688e+07 1.738982e+07 1.513836e+07 1.472034e+07 1.929650e+07 1.211219e+07 1.379582e+07 1.157681e+07 1.933802e+07 1.589892e+07 1.787099e+07 1.837597e+07 1.242849e+07 1.362332e+07 1.340442e+07 1.426591e+07 4.040585e+06 1.530170e+07 1.257415e+07 1.395574e+07 1.400286e+07 1.545540e+07 1.194617e+07 1.544715e+07 5.439367e+06 9.601675e+06 1.241912e+07 1.421095e+07 2.414281e+07 1.269764e+07 2.051165e+07 1.572029e+07 1.625776e+07 1.898393e+07 2.596970e+07 1.148709e+07 1.673706e+07 1.524297e+07 1.567976e+07 1.849275e+07 9.914346e+06 1.791713e+07 1.835285e+07 1.082819e+07 1.406541e+07 1.931223e+07 1.064904e+07 1.071790e+07 1.382168e+07 2.500929e+07 2.023184e+07 1.514689e+07 1.686847e+07 1.346506e+07 1.707786e+07 1.360552e+07 1.227253e+07 1.852194e+07 1.043412e+07 9.378743e+06 9.482713e+06 1.155852e+07 1.290312e+07 9.765760e+06 2.133592e+07 8.952778e+06 1.223996e+07 1.354528e+07 1.500369e+07 6.520568e+05 1.065888e+07 1.285164e+07 1.385300e+07 1.583479e+07 2.098521e+07 1.815457e+07 1.419039e+07 1.790655e+07 7.629114e+06 2.166347e+07 2.157924e+07 1.071435e+07 1.329081e+07 9.396514e+06 1.208223e+07 1.332764e+07 1.204280e+07 2.498981e+07 1.393274e+07 1.518944e+07 1.447062e+07 2.344970e+07 2.347995e+07 2.187666e+07 3.621275e+07 4.041532e+07 4.251319e+07 2.298033e+07 2.402981e+07 3.043496e+07 1.261098e+07 1.276941e+07 1.646922e+07 1.006778e+07 1.145426e+07 1.118551e+07 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1.576845e+07 1.637308e+07 1.324971e+07 1.304058e+07 1.821540e+07 1.381061e+07 1.851380e+07 1.348410e+07 1.257209e+07 2.303704e+07 9.726103e+06 1.142424e+07 2.027169e+07 9.311733e+06 1.018221e+07 1.331234e+07 1.484568e+07 C16 H35 Cl N4 O5 P2 S_1.779 2.967520e+04 2.906858e+06 2.797752e+06 3.182408e+06 3.647460e+04 2.507421e+06 3.531265e+06 3.384587e+06 34918.98 3.118714e+06 2.497452e+06 3.031087e+06 35468.78 3.103199e+06 3.102007e+06 2.864819e+06 8.376501e+04 2.806688e+06 2.815961e+06 3.209701e+06 1.000084e+05 3.198909e+06 2.805380e+06 3.109991e+06 54904.542 3.013617e+06 3.188139e+06 3.034639e+06 4.877962e+04 2.946072e+06 2.280720e+06 3.331675e+06 64987.20 3.191292e+06 2.854012e+06 3.427448e+06 6.319781e+04 2.893132e+06 2.868237e+06 2.965380e+06 5.935229e+04 2.570529e+06 2.628442e+06 3.851683e+06 3.348968e+04 3.229454e+06 3.342168e+06 2.262049e+06 2.397655e+06 2.820025e+06 2.075470e+06 2.639105e+06 2.622866e+06 2.913501e+06 3.145956e+06 3.142991e+06 2.861215e+06 3.280899e+06 2.874290e+06 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1.608082e+07 5.212677e+04 1.012586e+07 1.345271e+07 1.527735e+07 58439.37 1.976273e+07 1.571940e+07 4.888429e+06 5.688323e+04 1.684492e+07 1.892338e+07 1.543068e+07 5.624970e+04 1.558043e+07 1.272978e+07 2.110263e+07 4.403303e+04 8.417068e+06 1.331500e+07 1.587293e+07 1.381807e+07 2.169715e+07 1.200794e+07 1.404932e+07 1.312994e+07 1.433786e+07 4.354153e+06 2.086233e+07 1.462390e+07 1.629404e+07 1.224345e+07 5.192874e+06 1.617056e+07 7.201437e+06 4.445891e+06 1.696935e+07 5.548703e+06 1.593796e+07 1.734473e+07 1.372469e+07 1.961180e+07 1.452495e+07 1.028095e+07 3.726646e+06 1.299201e+07 1.982649e+07 1.416673e+07 1.502846e+07 1.001879e+07 1.789718e+07 3.900809e+05 1.492891e+07 4.758461e+06 1.032941e+07 1.362477e+07 1.825802e+07 1.179256e+07 1.940771e+07 1.083216e+07 5.823658e+06 9.702408e+06 6.426266e+06 1.451725e+07 2.394327e+07 3.063022e+06 2.073270e+07 3.421639e+06 1.498243e+07 1.425605e+07 1.428497e+07 1.560066e+07 1.924055e+07 1.638755e+07 1.152722e+07 1.364191e+07 1.357592e+07 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7.139302e+06 1.162238e+07 3.609401e+06 4.071796e+06 6.732484e+06 1.612592e+07 2.615618e+07 3.401085e+06 3.649751e+06 2.181217e+07 2.451827e+07 1.762053e+07 5.696736e+06 1.684427e+07 2.349881e+07 1.882428e+07 7.427997e+06 1.494820e+07 2.010635e+07 2.950226e+07 1.786531e+07 1.515858e+07 7.266646e+06 2.066702e+07 1.176656e+07 6.923797e+06 1.565100e+07 4.710374e+06 8.755049e+06 1.662834e+07 1.903367e+07 3.553612e+06 1.122734e+07 8.490599e+06 3.552341e+06 9.120332e+06 1.338564e+07 3.183642e+07 1.831733e+07 4.552050e+06 2.615022e+07 1.388516e+07 4.928360e+06 2.495977e+06 7.072387e+06 6.787729e+06 3.892852e+06 2.277421e+06 1.967721e+07 3.296299e+06 5.868349e+06 1.430168e+07 1.580429e+07 7.286400e+06 5.773120e+06 7.021834e+06 1.549022e+07 3.208561e+06 1.806425e+07 1.599262e+07 1.773326e+07 2.025679e+07 6.174813e+06 1.235462e+07 2.027859e+07 4.195973e+06 1.316793e+07 4.918834e+06 2.345788e+07 2.083993e+07 1.179845e+07 5.485681e+06 5.631154e+06 1.169299e+07 1.148320e+07 8.585352e+06 1.232362e+07 1.640562e+07 1.373731e+07 1.457495e+07 5.440281e+06 "2-(Hydroxymethyl)-3,5-dimethoxyphenol_1.779" 1.940624e+05 1.740297e+07 1.619082e+07 1.455691e+07 1.590822e+05 1.390513e+07 1.646609e+07 1.708584e+07 177290.94 1.550035e+07 1.691803e+07 1.761668e+07 142601.11 1.456190e+07 1.607680e+07 1.392002e+07 3.465323e+05 1.555840e+07 1.708822e+07 1.604539e+07 3.961636e+05 1.401097e+07 1.767624e+07 1.838809e+07 216378.164 1.358800e+07 1.615178e+07 1.690505e+07 2.224011e+05 1.374843e+07 1.708745e+07 1.882811e+07 316807.27 1.236076e+07 1.653235e+07 1.783522e+07 3.564586e+05 1.289153e+07 1.847233e+07 1.556439e+07 3.192610e+05 9.655210e+06 1.842158e+07 2.066397e+07 1.913109e+05 1.393493e+07 1.826182e+07 1.282377e+07 6.706642e+06 1.473899e+07 8.633647e+06 1.450271e+07 1.088516e+07 1.308016e+07 1.273631e+07 1.239286e+07 1.365665e+07 1.497038e+07 1.507627e+07 1.697481e+07 1.934935e+07 1.022078e+07 1.455442e+07 1.776583e+07 1.686813e+07 1.408625e+07 2.076744e+07 1.349597e+07 1.511759e+07 1.233945e+07 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4.968579e+06 7.388785e+06 5.065273e+06 4.643897e+06 9.002464e+06 3.857544e+06 3.669180e+06 6.551725e+06 3.372136e+06 3.210629e+06 5.615736e+06 5.070835e+06 C14 H22 O5_1.782 1.245074e+05 5.702360e+05 5.500580e+05 5.729092e+05 6.337649e+04 4.077713e+05 5.241933e+05 6.319287e+05 56865.59 4.172568e+05 5.139168e+05 6.694923e+05 51986.04 6.414680e+05 3.736041e+05 5.834968e+05 1.239352e+05 4.570014e+05 4.463420e+05 4.959065e+05 1.383771e+05 5.696896e+05 6.122733e+05 8.154588e+05 73883.385 3.552599e+05 3.546307e+05 6.564703e+05 7.483608e+04 5.429256e+05 4.238016e+05 4.635109e+05 86541.94 5.167875e+05 5.664915e+05 7.501733e+05 8.245237e+04 5.769700e+05 3.338206e+05 4.884211e+05 8.048384e+04 5.256206e+05 6.001425e+05 5.265279e+05 4.880126e+04 5.553531e+05 5.378651e+05 5.112994e+05 5.239532e+05 2.634521e+05 3.550264e+05 4.942847e+05 3.430861e+05 2.149708e+05 3.361155e+05 6.445019e+05 5.851464e+05 4.415228e+05 5.908296e+05 7.191110e+05 4.742366e+05 6.139886e+05 4.513538e+05 5.486379e+05 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6.229409e+05 1.486361e+06 4.653185e+05 4.179292e+05 2.950991e+05 6.922441e+05 5.201275e+05 4.278304e+05 9.654009e+05 7.823741e+05 3.912883e+05 1.159376e+06 3.926724e+05 5.920434e+05 7.109224e+05 4.771399e+05 4.696408e+05 4.382224e+05 5.720319e+05 5.126974e+05 2.706012e+05 6.222666e+05 1.060517e+06 5.608023e+05 2.218398e+05 4.399768e+05 5.585140e+05 5.349126e+05 6.170616e+05 3.713164e+05 4.590713e+05 6.405695e+05 7.758371e+05 4.040188e+05 7.126277e+05 4.263905e+05 1.302546e+06 5.581031e+05 5.488654e+05 2.390837e+05 7.878534e+05 9.787714e+05 6.288887e+05 9.744869e+05 C20 H34 N4 O4_1.782 9.315860e+04 4.563216e+06 2.500487e+06 4.384637e+06 1.126922e+05 3.053193e+06 3.929741e+06 4.600834e+06 98263.82 3.478746e+06 3.893085e+06 4.131728e+06 93832.47 3.407699e+06 3.546051e+06 3.601768e+06 2.170308e+05 3.944400e+06 3.603490e+06 4.093094e+06 2.585864e+05 3.086317e+06 4.151633e+06 4.814269e+06 145032.700 3.890081e+06 2.485919e+06 4.585824e+06 1.503242e+05 2.376136e+06 3.922031e+06 5.090100e+06 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2-(Diethoxymethyl)furan_1.782 2.612406e+04 4.185183e+05 2.506046e+05 4.869144e+05 3.487788e+04 1.074888e+06 4.493876e+05 4.845212e+05 51561.59 4.618781e+05 5.723230e+05 2.915959e+05 31620.19 5.627024e+05 8.066076e+05 4.199391e+05 1.105816e+06 6.139142e+05 4.833713e+05 3.554161e+05 6.749880e+04 4.741956e+05 6.573243e+05 7.529964e+05 45962.030 5.128444e+05 3.030564e+05 4.183623e+05 4.757144e+04 5.283452e+05 6.858930e+05 6.273844e+05 69826.48 2.445839e+05 5.808948e+05 7.538631e+05 7.186159e+04 5.804106e+05 3.397256e+05 4.180753e+05 7.534046e+04 3.853806e+05 8.660653e+05 9.401321e+05 3.431723e+04 2.890056e+05 6.360917e+05 4.056703e+05 2.532487e+05 1.549584e+06 1.763347e+05 6.641440e+05 6.601454e+05 2.966728e+05 4.209472e+05 7.141968e+05 5.175979e+05 6.718894e+05 9.625361e+05 4.093839e+05 1.126163e+06 8.479459e+05 6.644793e+05 5.428941e+05 7.538183e+05 3.673036e+05 5.999957e+05 6.346009e+05 5.827507e+05 3.740273e+05 7.761108e+05 8.388707e+05 1.115619e+06 1.005785e+06 7.577459e+05 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1.178652e+05 3.003919e+05 6.483636e+05 5.071589e+05 3.179447e+05 3.234771e+05 3.087445e+05 2.484210e+05 4.646123e+05 6.676991e+05 3.051010e+05 6.403817e+05 3.064546e+05 6.158737e+05 4.461119e+05 3.819901e+05 4.660691e+05 4.761170e+05 2.835302e+05 3.017832e+05 4.116907e+05 4.529245e+05 5.488304e+05 1.055839e+06 2.008476e+05 3.524018e+05 3.432629e+05 1.072545e+05 5.487614e+05 4.640463e+05 1.497318e+06 5.293435e+05 2.826242e+05 Cinoxate_1.784 3.703827e+05 4.289439e+05 6.652272e+05 6.369849e+05 1.054543e+05 6.429265e+05 3.652275e+05 9.310937e+05 156629.36 6.468110e+05 4.716595e+05 5.531655e+05 102492.81 5.201608e+05 8.497466e+05 4.502435e+05 2.543940e+05 5.481831e+05 5.553576e+05 4.881993e+05 2.792727e+05 5.729746e+05 7.370500e+05 5.390472e+05 140229.467 6.841193e+05 6.997271e+05 4.943406e+05 1.425048e+05 5.388494e+05 6.862713e+05 5.999496e+05 213314.78 4.146462e+05 7.393612e+05 4.997159e+05 2.176764e+05 4.836067e+05 8.928003e+05 5.058969e+05 1.877209e+05 4.942684e+05 6.186228e+05 7.499324e+05 1.034400e+05 5.044862e+05 4.631234e+05 6.836639e+05 6.531718e+05 4.782219e+05 4.652669e+05 7.047440e+05 3.932813e+05 5.003250e+05 4.694726e+05 5.677540e+05 6.998532e+05 7.630999e+05 6.385473e+05 7.289172e+05 1.070226e+06 6.961172e+05 8.433590e+05 7.746957e+05 5.174008e+05 6.911122e+05 1.017498e+06 5.709104e+05 5.657634e+05 6.602931e+05 9.160508e+05 1.101180e+06 9.088161e+05 1.171840e+06 4.852934e+05 5.217492e+05 5.360126e+05 4.596710e+05 4.104991e+05 4.930319e+05 4.703580e+05 7.575539e+05 2.975875e+05 7.217042e+05 2.855871e+05 5.405736e+05 3.316857e+05 3.541709e+05 4.147471e+05 4.602012e+05 6.490421e+05 3.568875e+05 9.908136e+05 3.811376e+05 1.119376e+06 6.118070e+05 8.964617e+05 5.389629e+05 7.947470e+05 5.664050e+05 6.890064e+05 4.725537e+05 2.497201e+05 8.599689e+05 8.381847e+05 8.177774e+05 9.627490e+05 7.909833e+05 2.434746e+05 3.147613e+05 6.470115e+05 7.540368e+05 5.232631e+05 4.030578e+05 4.908448e+05 4.374747e+05 6.200848e+05 5.894716e+05 3.461329e+05 6.661950e+05 3.927669e+05 4.116962e+05 4.221236e+05 5.586221e+05 3.670793e+05 4.524835e+05 7.767315e+05 6.259742e+05 2.669236e+05 4.065556e+05 4.273609e+05 2.605527e+05 6.530741e+05 5.947625e+05 4.465095e+05 5.806403e+05 6.556877e+05 3.277029e+05 5.025147e+05 4.649948e+05 2.977328e+05 5.911957e+05 6.763394e+05 2.638475e+05 3.442896e+05 6.035272e+05 5.906338e+05 7.490062e+05 7.107164e+05 1.037895e+06 3.949909e+05 5.830627e+05 5.136180e+05 4.913968e+05 2.952693e+05 3.985126e+05 6.304307e+05 6.849868e+05 6.113222e+05 7.069379e+05 8.106670e+05 7.976178e+05 5.992147e+05 4.195885e+05 6.535181e+05 4.427852e+05 4.440780e+05 5.077193e+05 7.896621e+05 3.608652e+05 5.525428e+05 3.452375e+05 5.851573e+05 3.784568e+05 8.175134e+05 7.305360e+05 6.386736e+05 6.964843e+05 7.914786e+05 1.039433e+06 3.299733e+06 5.954277e+05 3.941343e+05 5.327074e+06 3.786379e+05 4.730491e+05 3.225017e+05 5.106240e+05 4.957998e+06 7.706840e+05 2.651043e+06 4.898569e+05 4.560622e+05 4.449424e+05 3.894042e+06 3.677464e+05 4.252610e+06 2.941502e+06 3.287581e+05 5.433485e+06 5.204084e+06 2.919677e+06 5.018545e+05 4.887456e+05 3.648636e+05 3.447857e+05 4.084946e+05 3.564978e+05 4.501472e+05 5.711188e+05 3.375239e+05 5.696917e+05 2.832200e+05 5.477683e+05 6.885911e+05 6.838898e+05 4.664204e+06 3.637360e+05 1.242873e+06 6.357973e+05 6.309341e+05 3.027345e+05 3.042562e+05 5.346664e+05 7.854695e+05 9.827186e+05 4.293284e+05 4.342835e+05 6.945953e+05 4.813389e+05 5.318563e+05 3.966283e+05 5.410240e+05 4.066366e+05 7.543597e+05 3.967639e+05 3.510786e+05 3.994362e+05 3.756251e+05 5.313909e+05 8.130565e+05 3.028199e+05 5.537175e+05 4.189263e+05 4.715010e+05 4.906033e+05 4.076491e+05 6.563480e+05 4.819024e+05 3.996694e+05 6.349741e+05 8.532384e+05 3.051750e+05 5.833367e+05 1.200022e+06 3.721992e+05 2.707195e+05 6.045314e+05 3.332578e+05 6.582824e+05 5.913164e+05 3.905888e+05 C18 H24 N10 O3 P2_1.784 6.090132e+04 1.628688e+07 1.489889e+07 1.876636e+07 6.379194e+04 1.475594e+07 2.356756e+07 1.980241e+07 52797.33 1.982824e+07 1.688264e+07 1.697703e+07 50033.15 1.690537e+07 1.831928e+07 1.900541e+07 1.065649e+05 1.489264e+07 1.513986e+07 1.736531e+07 9.866589e+04 2.371635e+07 2.014325e+07 2.004325e+07 64500.813 1.354813e+07 1.768511e+07 1.962059e+07 5.625360e+04 1.409044e+07 1.360514e+07 1.923127e+07 64312.43 2.380528e+07 1.774353e+07 1.211502e+07 6.341129e+04 2.161786e+07 1.999586e+07 1.856603e+07 6.144808e+04 1.733205e+07 1.302447e+07 2.357247e+07 3.958732e+04 1.829015e+07 1.749546e+07 1.598141e+07 1.221607e+07 1.776527e+07 9.343497e+06 1.578765e+07 1.387504e+07 1.636355e+07 1.744322e+07 2.057620e+07 1.787498e+07 1.740518e+07 1.560066e+07 1.369643e+07 1.653444e+07 1.460717e+07 1.588981e+07 1.928480e+07 1.166503e+07 1.537271e+07 1.738549e+07 1.554838e+07 1.949711e+07 1.963234e+07 1.451824e+07 1.657766e+07 2.069528e+07 2.635063e+07 1.755477e+07 1.913578e+07 1.754616e+07 1.798087e+07 3.162034e+05 1.500323e+07 1.763151e+07 1.300432e+07 1.564667e+07 1.790097e+07 1.334934e+07 1.876639e+07 1.100340e+07 1.647838e+07 1.435976e+07 1.645085e+07 1.725547e+07 1.867954e+07 1.909920e+07 1.846625e+07 1.113149e+07 1.655866e+07 1.615839e+07 1.538063e+07 1.767278e+07 1.629182e+07 1.626637e+07 1.534432e+07 1.533744e+07 1.449300e+07 1.810968e+07 1.508169e+07 1.417070e+07 1.464291e+07 1.220371e+07 1.186557e+07 1.372497e+07 1.942742e+07 2.060672e+07 1.035613e+07 1.878558e+07 2.201249e+07 1.634194e+07 1.710251e+07 1.289191e+07 1.497338e+07 1.156726e+07 1.216131e+07 1.270885e+07 1.347956e+07 1.856116e+07 1.659467e+07 1.984482e+07 1.203433e+07 1.389688e+07 1.855236e+07 1.721365e+07 6.245730e+04 1.504015e+07 1.521677e+07 1.736175e+07 1.600470e+07 1.930360e+07 2.093263e+07 1.752340e+07 1.681842e+07 8.743237e+06 2.073161e+07 1.726024e+07 1.494903e+07 1.773458e+07 1.530224e+07 1.549219e+07 1.356615e+07 1.794760e+07 1.721185e+07 1.595415e+07 2.262517e+07 1.302842e+07 1.617151e+07 1.780450e+07 1.966445e+07 1.945158e+07 2.050910e+07 2.264748e+07 1.443134e+07 1.620578e+07 1.124879e+07 1.248014e+07 1.786312e+07 1.381431e+07 1.591992e+07 8.808368e+06 1.617827e+07 1.365109e+07 1.501476e+07 1.649299e+07 1.615569e+07 1.479306e+07 1.669507e+07 2.066762e+07 1.870041e+07 1.715683e+07 1.419534e+07 1.860374e+07 1.941815e+07 1.649093e+07 2.288378e+07 1.594978e+07 1.492490e+07 1.741540e+07 1.723211e+07 1.313736e+07 2.103837e+07 1.321450e+07 1.052768e+07 1.956887e+07 2.364042e+07 1.040200e+07 1.373133e+07 1.917049e+07 2.102792e+07 2.152912e+07 1.609126e+07 1.301101e+07 2.290742e+07 1.977722e+07 2.368415e+07 1.835889e+07 1.625242e+07 2.644438e+07 2.170137e+07 1.889675e+07 1.914556e+07 2.533720e+07 1.134517e+07 1.861121e+07 2.260734e+07 1.892356e+07 1.286471e+07 2.913630e+07 2.063563e+07 1.739165e+07 1.417726e+07 2.573621e+07 1.801254e+07 2.077883e+07 1.424435e+07 1.381475e+07 1.960468e+07 2.113685e+07 1.479881e+07 1.421543e+07 1.089356e+07 1.574714e+07 1.846050e+07 2.087347e+07 1.775538e+07 1.642725e+07 2.142780e+07 1.899564e+07 1.290050e+07 2.262804e+07 1.456377e+07 2.059893e+07 1.980661e+07 1.832533e+07 1.726030e+07 1.885997e+07 2.436596e+07 1.908965e+07 2.035446e+07 2.029165e+07 1.769116e+07 1.665496e+07 2.402269e+07 1.573101e+07 1.429394e+07 1.270550e+07 1.619562e+07 2.574393e+07 1.192417e+07 1.051650e+07 1.302610e+07 1.737252e+07 1.682854e+07 8.867878e+06 1.995329e+07 C7 H13 N2 O2 P_1.784 1.816828e+06 2.817001e+06 2.600296e+06 2.581147e+06 1.505626e+05 2.881903e+06 2.544750e+06 2.132958e+06 77546.41 2.298095e+06 3.168793e+06 3.350625e+06 53071.89 2.416108e+06 2.473984e+06 2.785267e+06 1.088753e+05 2.989638e+06 1.987427e+06 2.925731e+06 1.276560e+05 2.103864e+06 3.075250e+06 3.488798e+06 68866.268 1.803018e+06 3.130792e+06 2.910841e+06 7.535594e+04 1.992822e+06 3.105823e+06 2.428763e+06 111579.50 1.596543e+06 3.256791e+06 3.992815e+06 1.113640e+05 1.481459e+06 2.529684e+06 3.943228e+06 1.030252e+05 1.607542e+06 1.776740e+06 4.440216e+06 6.673619e+04 2.000717e+06 3.042829e+06 1.994125e+06 1.454493e+06 3.266350e+06 2.183185e+06 9.326092e+05 2.603088e+06 2.881391e+06 1.030702e+06 2.966390e+06 4.762960e+06 6.320519e+06 7.857883e+06 2.147059e+06 1.589243e+06 1.075084e+06 1.102793e+06 2.147445e+06 6.159166e+05 1.175933e+06 4.925622e+06 3.221392e+06 2.155933e+06 9.868072e+05 8.663630e+06 1.054950e+06 1.039927e+06 1.118373e+06 3.478081e+06 3.285499e+06 2.509958e+06 5.500392e+06 8.317863e+05 3.600888e+05 3.648160e+06 7.039521e+05 4.376721e+05 5.652690e+06 2.976465e+06 4.325228e+06 1.443649e+06 2.082379e+06 5.391106e+05 2.416891e+06 1.323786e+06 2.720307e+06 4.783314e+06 1.057661e+07 1.518170e+06 2.746526e+06 6.836131e+06 1.240180e+06 1.541108e+06 2.188599e+06 2.476910e+06 1.468851e+06 1.500112e+05 1.297823e+06 1.095451e+06 2.058720e+06 1.306008e+06 1.357399e+06 1.248818e+05 9.079611e+05 2.767607e+06 1.473105e+06 1.439438e+06 2.431735e+06 1.813656e+06 2.338258e+06 1.856212e+06 2.025713e+06 1.052697e+06 1.866154e+05 4.113057e+05 2.921261e+06 4.756008e+06 7.015122e+06 4.328166e+06 1.621246e+06 2.893952e+06 1.277531e+06 4.093746e+05 9.709053e+05 5.611179e+05 1.456198e+06 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4.676972e+06 1.003125e+05 2.556702e+06 4.375366e+06 4.982035e+06 105147.29 3.694464e+06 4.259859e+06 4.706082e+06 105565.22 3.753322e+06 4.203911e+06 3.885120e+06 2.213030e+05 3.358090e+06 4.154041e+06 4.656847e+06 2.625798e+05 3.486943e+06 4.143260e+06 5.400458e+06 139027.350 3.911661e+06 3.646823e+06 4.041171e+06 1.285502e+05 3.710750e+06 4.323968e+06 4.891536e+06 184859.11 3.438020e+06 4.742680e+06 3.060269e+06 2.060036e+05 4.233665e+06 4.727570e+06 3.924137e+06 1.742580e+05 3.427851e+06 4.568102e+06 5.163303e+06 9.650873e+04 3.199376e+06 4.807675e+06 3.495305e+06 2.470750e+06 4.073987e+06 1.354301e+06 2.520087e+06 6.497692e+05 2.526025e+06 1.724118e+06 3.283594e+06 1.529566e+06 1.513004e+06 2.751100e+06 5.628116e+06 2.244517e+06 1.791674e+06 2.590412e+06 3.517344e+06 2.899790e+06 3.215922e+06 4.319862e+06 2.388505e+06 2.253586e+06 1.759900e+06 3.555224e+06 3.347954e+06 3.982786e+06 3.157963e+06 3.424656e+06 3.688874e+06 4.100546e+06 4.305466e+06 7.295538e+05 4.940699e+06 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1.187244e+06 8.627051e+05 9.842659e+05 8.991603e+05 1.273051e+06 7.719593e+05 1.919080e+06 1.107400e+06 1.164226e+06 8.129059e+05 7.138152e+05 9.617693e+05 1.091705e+06 1.454916e+06 2.343834e+06 1.589379e+06 5.659015e+06 1.087675e+06 1.358605e+06 8.442335e+05 7.917691e+05 1.230510e+06 1.076201e+06 3.188323e+06 1.875762e+06 1.447721e+06 2.353563e+06 1.056594e+06 1.133104e+06 1.478574e+06 6.850150e+05 1.554145e+06 1.247327e+06 9.824118e+05 1.227503e+06 1.361216e+06 1.171147e+06 7.256264e+05 1.547184e+06 1.008751e+06 1.046544e+06 2.765775e+06 8.587665e+05 1.326918e+06 1.302419e+06 9.175895e+05 1.313317e+06 1.553154e+06 1.265268e+06 8.524875e+05 1.091042e+06 7.302522e+05 2.279882e+06 6.761911e+05 5.076921e+05 6.740131e+05 6.844684e+05 8.282269e+05 1.402015e+06 1.345846e+06 C12 H31 N7 O2 P2_1.791 3.790758e+04 4.451611e+05 2.348850e+05 1.163244e+05 4.350149e+04 3.337270e+05 2.881948e+05 3.174108e+05 49206.79 4.769845e+05 3.602738e+05 2.500070e+05 50047.22 3.326690e+05 3.915521e+05 1.866795e+05 1.148126e+05 4.627857e+05 3.914117e+05 3.671087e+05 1.072908e+05 1.900255e+05 4.155824e+05 4.800772e+05 65772.775 2.845427e+05 3.587647e+05 2.976079e+05 7.155159e+04 2.750259e+05 2.050237e+05 5.437306e+05 100506.98 1.519102e+05 2.947949e+05 4.119635e+05 1.134326e+05 3.817661e+05 2.370680e+05 2.365192e+05 8.778658e+04 1.665302e+05 3.014267e+05 4.443215e+05 4.339911e+04 4.873444e+05 2.174911e+05 1.312631e+05 2.334985e+05 1.958987e+05 1.905606e+05 4.229921e+05 2.627702e+05 4.822596e+05 1.078363e+05 1.666263e+05 1.140056e+05 1.776785e+05 1.662799e+05 2.145220e+05 2.331748e+05 1.295322e+05 1.647306e+05 1.943512e+05 2.427698e+05 7.775743e+05 1.522628e+05 1.676709e+05 1.273731e+05 1.466453e+05 5.021256e+05 1.317978e+05 2.005110e+05 1.615036e+05 9.309680e+05 4.222130e+05 6.445941e+05 6.931879e+05 1.232994e+05 1.245948e+06 5.564862e+05 4.549144e+05 9.341450e+05 6.058662e+05 4.194875e+05 7.317619e+05 6.013762e+05 2.808941e+05 4.367455e+05 5.036376e+05 4.278307e+05 6.006899e+05 2.720352e+05 1.357507e+05 1.901791e+05 1.410002e+05 1.659454e+05 1.495616e+05 1.143345e+05 2.241296e+05 1.139952e+05 2.220950e+05 1.292136e+05 2.342789e+05 1.675005e+05 3.010162e+05 3.078827e+05 1.752741e+05 1.115623e+05 1.430142e+05 2.795503e+05 1.963551e+05 1.441570e+05 1.593562e+05 2.587794e+05 1.015091e+05 1.381307e+05 2.228082e+05 1.345041e+05 1.604654e+05 1.810377e+05 1.296698e+05 1.300331e+05 1.397607e+05 1.753704e+05 1.635076e+05 1.280875e+05 1.445830e+05 9.779390e+04 1.016735e+05 3.143703e+05 1.166785e+05 1.249660e+05 4.125439e+05 1.971178e+05 1.233922e+05 3.663431e+05 1.203552e+05 1.151295e+05 2.185616e+05 1.318505e+05 2.444974e+05 2.920400e+05 2.900509e+05 1.282857e+05 1.276178e+05 4.028801e+05 1.802288e+05 1.374900e+05 2.815251e+05 1.413250e+05 5.055565e+05 3.742969e+05 3.294001e+05 1.096491e+05 1.147479e+05 2.556574e+05 1.350237e+05 1.375835e+05 1.630496e+05 1.379916e+05 1.378111e+05 1.365314e+05 3.896981e+05 5.728233e+05 5.701704e+05 1.461575e+05 5.240205e+05 4.376881e+05 2.212368e+05 6.282950e+05 1.001526e+05 2.499838e+05 3.197363e+05 7.142172e+05 4.133031e+05 1.546170e+05 1.747708e+05 1.123187e+05 1.305704e+05 2.414514e+05 7.439182e+05 2.190715e+05 6.854268e+05 2.329947e+05 1.846311e+05 2.696317e+05 1.277014e+05 3.492195e+05 3.742437e+05 8.754470e+05 3.723828e+05 1.606702e+05 2.611484e+05 9.147222e+05 1.827210e+05 7.365320e+05 7.485763e+05 8.433473e+05 8.258656e+05 7.782870e+05 8.829848e+05 1.824973e+05 4.387010e+05 4.083030e+05 3.038337e+05 7.016989e+05 1.253955e+05 8.012040e+05 4.690973e+05 2.422117e+05 2.505376e+05 6.157457e+05 1.124554e+06 1.481106e+05 6.689382e+05 9.310934e+05 3.440118e+05 6.440696e+05 5.867466e+05 1.155300e+06 4.420404e+05 2.174856e+05 5.544059e+05 2.313801e+05 4.819532e+05 2.944368e+05 1.496035e+05 3.516768e+05 3.474296e+05 1.924853e+05 5.920456e+05 2.775557e+05 1.782508e+05 1.814302e+05 5.853038e+05 3.623484e+05 3.736304e+05 1.748739e+05 2.480771e+05 2.172710e+06 1.945909e+05 1.574500e+05 2.871680e+05 4.383775e+05 3.616112e+05 1.565655e+05 1.371053e+05 3.189422e+05 2.408580e+05 5.597807e+05 4.985920e+05 2.092713e+05 2.951006e+05 4.000145e+05 5.406697e+06 5.480151e+05 3.708356e+05 2.474047e+05 3.814957e+05 2.272514e+05 1.941761e+05 C15 H24 O6_1.792 1.418410e+05 1.957789e+06 2.436160e+06 1.999590e+06 1.471763e+05 1.844353e+06 2.322399e+06 2.247642e+06 158545.20 1.969091e+06 1.784576e+06 2.309846e+06 151329.77 2.299013e+06 1.914692e+06 2.100336e+06 3.359129e+05 2.035926e+06 2.050713e+06 2.471319e+06 3.727002e+05 1.689660e+06 2.316404e+06 2.522080e+06 214467.058 1.601511e+06 2.139359e+06 2.026836e+06 2.015667e+05 1.879410e+06 2.145780e+06 2.663945e+06 265711.13 1.910107e+06 2.034427e+06 2.210940e+06 2.949734e+05 1.696851e+06 2.407697e+06 1.927670e+06 2.633462e+05 1.851059e+06 2.033659e+06 2.233587e+06 1.386425e+05 2.448639e+06 2.150304e+06 1.862178e+06 1.297249e+06 1.641325e+06 1.232029e+06 2.420038e+06 1.594755e+06 1.743675e+06 2.039683e+06 1.925082e+06 1.981323e+06 2.205528e+06 2.304306e+06 2.096847e+06 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4.018242e+06 3.019213e+06 3.440523e+06 1.596574e+06 6.227680e+06 5.000264e+06 1.514840e+06 2.186443e+06 2.487978e+06 2.824061e+06 3.083102e+06 5.523832e+06 6.991568e+06 4.604912e+06 4.512182e+06 3.589875e+06 2.026281e+06 2.069843e+06 2.151985e+06 3.733162e+06 5.154687e+06 5.121200e+06 2.896593e+06 1.933253e+06 2.357120e+06 1.479583e+06 1.207257e+06 2.052219e+06 1.476760e+06 1.372701e+06 1.554687e+06 9.980316e+05 1.556542e+06 1.419007e+06 1.343795e+06 1.596072e+06 1.410338e+06 1.860973e+06 2.317993e+06 2.082951e+06 2.356186e+06 2.586558e+06 3.847138e+06 6.124324e+06 1.780433e+06 1.581368e+06 4.572829e+06 1.695328e+06 1.579335e+06 1.398251e+06 1.606910e+06 5.738494e+06 1.222927e+06 6.509657e+06 4.558993e+06 1.850364e+06 2.220967e+06 4.217177e+06 1.390734e+06 4.604266e+06 3.362193e+06 1.643398e+06 3.181372e+06 3.157156e+06 5.034761e+06 1.513462e+06 1.551744e+06 1.654779e+06 1.415795e+06 1.682047e+06 1.074858e+06 2.520043e+06 1.413992e+06 1.471739e+06 1.426894e+06 1.448438e+06 1.819177e+06 2.378462e+06 1.563127e+06 4.933438e+06 2.113005e+06 2.440423e+06 1.833217e+06 1.868626e+06 1.574670e+06 1.524100e+06 1.960672e+06 1.996843e+06 2.611177e+06 2.651840e+06 1.972057e+06 2.188233e+06 2.178896e+06 2.513271e+06 2.162097e+06 2.934878e+06 1.854494e+06 2.574575e+06 1.960176e+06 2.417966e+06 3.148169e+06 2.042531e+06 1.807471e+06 4.029147e+06 2.134056e+06 2.937939e+06 3.068949e+06 2.219880e+06 2.640824e+06 3.151178e+06 1.720662e+06 2.324533e+06 6.143392e+06 3.923500e+06 1.932372e+06 2.739209e+06 1.832309e+06 7.583463e+06 1.223077e+06 1.122315e+06 1.609604e+06 1.853821e+06 2.655159e+06 2.466810e+06 2.768142e+06 N-Nonanoylglycine_1.792 1.357956e+05 1.407200e+06 1.633245e+06 1.181933e+06 1.081138e+05 1.212811e+06 1.276466e+06 1.612337e+06 479562.67 1.270211e+06 9.048216e+05 1.203326e+06 153844.51 1.545770e+06 2.254639e+06 1.525713e+06 1.486005e+05 9.403067e+05 1.059516e+06 1.201086e+06 2.946693e+05 9.485512e+05 1.497261e+06 1.631533e+06 141339.221 1.402735e+06 1.487079e+06 1.485501e+06 1.261141e+05 9.905071e+05 1.281519e+06 1.386809e+06 170243.24 1.533294e+06 1.464799e+06 1.249693e+06 2.150674e+05 1.125346e+06 1.734665e+06 1.690317e+06 1.778168e+05 7.333813e+05 1.320780e+06 1.682432e+06 1.036565e+06 1.207699e+06 1.517743e+06 1.203587e+06 6.506529e+05 5.105282e+05 6.305047e+05 1.082518e+06 8.569929e+05 8.259326e+05 4.538915e+05 1.271469e+06 9.087073e+05 1.010000e+06 1.952913e+06 6.415339e+05 1.076211e+06 2.121390e+06 6.212652e+05 1.334835e+06 8.610256e+05 1.623868e+06 1.579338e+06 9.396817e+05 8.105009e+05 8.437121e+05 1.301459e+06 9.524661e+05 1.113294e+06 1.337882e+06 1.096247e+06 1.401363e+06 1.277267e+06 1.336062e+06 8.565655e+06 1.201357e+06 9.605658e+05 9.437937e+05 9.634329e+05 1.040708e+06 1.024523e+06 1.478855e+06 9.994063e+05 5.669564e+05 1.130423e+06 2.354262e+06 1.893606e+06 9.881454e+05 1.352562e+06 1.276874e+06 1.323724e+06 1.425064e+06 1.964851e+06 7.168457e+05 1.144602e+06 1.821636e+06 9.162706e+05 1.125049e+06 7.808913e+05 1.052228e+06 1.026100e+06 1.650190e+06 2.630005e+05 1.308749e+06 9.243991e+05 6.199221e+05 8.557920e+05 2.373101e+06 1.255130e+06 9.193894e+05 8.728789e+05 6.290012e+05 1.344448e+06 8.885790e+05 9.739548e+05 9.989886e+05 5.543786e+05 6.240829e+05 3.055173e+05 7.449662e+05 8.780748e+05 7.030212e+05 1.269447e+06 1.163138e+06 3.789656e+05 8.431258e+05 1.022772e+06 3.890808e+07 9.678140e+05 9.275486e+05 5.747599e+05 8.900798e+05 1.779714e+06 1.023721e+06 9.021392e+05 1.048740e+06 8.495724e+05 1.113086e+06 9.359003e+05 9.989886e+05 9.218799e+05 9.750546e+05 1.185192e+06 1.149128e+06 1.095936e+06 1.608452e+06 1.436570e+06 1.751127e+06 1.531008e+06 1.147568e+06 1.132209e+06 9.156119e+05 1.553747e+06 1.596547e+06 4.196815e+06 7.241541e+05 1.160403e+06 1.571100e+06 8.865494e+05 2.229516e+06 7.983527e+05 7.737114e+05 6.315882e+05 9.021338e+05 9.762781e+05 1.105089e+06 6.281540e+05 7.045296e+05 1.200260e+06 7.048335e+05 9.854271e+05 6.395997e+05 7.085245e+05 8.282054e+05 8.491906e+05 8.415556e+05 9.336660e+05 6.637826e+05 3.873703e+05 9.666041e+05 8.153647e+05 5.776747e+05 6.360476e+05 5.403888e+05 5.089641e+05 5.228906e+05 7.982411e+05 1.045952e+06 1.143827e+06 5.029485e+05 1.094554e+06 6.921853e+05 1.375499e+06 7.706936e+05 4.636264e+05 8.393623e+05 6.059147e+05 1.094669e+06 5.588183e+05 4.549510e+05 6.990782e+05 3.944595e+05 7.857128e+05 3.101419e+05 8.053517e+05 8.147540e+05 6.530495e+05 6.218001e+05 3.699588e+05 6.276540e+05 1.123801e+06 8.009072e+05 1.833263e+06 7.950357e+05 6.240951e+05 7.429833e+05 2.940727e+06 2.610964e+05 5.882045e+05 9.707747e+05 1.253940e+06 5.895649e+05 1.448979e+06 9.031913e+05 8.787147e+05 6.955866e+05 9.439120e+05 9.857394e+05 1.156122e+06 7.216712e+05 7.647600e+05 1.702342e+06 1.465121e+06 1.506759e+06 9.353599e+05 1.143342e+06 4.279615e+06 1.117189e+06 1.618282e+06 1.479190e+06 9.129206e+05 1.279170e+06 2.706019e+06 8.402152e+05 9.086789e+05 1.110621e+06 1.811214e+06 1.675104e+06 1.115728e+06 1.290180e+06 3.900605e+06 6.343601e+05 8.920106e+05 7.355107e+05 7.047018e+05 1.194994e+06 1.517737e+06 1.311454e+06 C25 H47 N5 O6_1.793 4.351618e+04 3.872532e+06 3.749232e+06 4.255917e+06 4.926309e+04 2.280882e+06 3.804064e+06 4.520817e+06 52714.06 3.223175e+06 3.827504e+06 4.148077e+06 53416.61 3.344599e+06 3.774592e+06 3.505581e+06 9.120294e+04 2.932727e+06 3.640148e+06 4.115116e+06 1.224858e+05 3.150481e+06 3.621058e+06 4.820777e+06 68631.223 3.554683e+06 3.286881e+06 3.625904e+06 6.495747e+04 3.309364e+06 3.670507e+06 4.277007e+06 93824.50 3.202473e+06 4.208278e+06 2.573537e+06 1.032786e+05 3.976366e+06 4.260734e+06 3.361813e+06 8.051749e+04 3.053213e+06 4.108358e+06 4.465372e+06 4.784180e+04 2.981600e+06 4.256140e+06 3.114787e+06 2.179853e+06 3.574673e+06 1.087996e+06 2.315559e+06 4.866482e+05 2.180753e+06 1.511273e+06 2.986226e+06 1.344375e+06 1.283152e+06 2.508325e+06 4.881405e+06 2.034562e+06 1.574369e+06 2.304419e+06 3.295361e+06 2.673664e+06 2.771296e+06 3.781502e+06 2.222192e+06 2.066410e+06 1.580802e+06 3.288434e+06 3.087844e+06 3.622406e+06 2.945816e+06 3.073727e+06 3.275414e+06 3.535370e+06 3.770218e+06 6.144501e+05 4.466781e+06 3.694925e+06 4.425589e+06 2.572016e+06 4.427011e+06 2.625650e+06 3.240083e+06 2.034389e+06 1.453263e+06 2.648481e+06 3.516212e+06 3.884991e+06 3.497528e+06 4.173322e+06 2.859709e+06 5.983620e+06 3.625263e+06 3.771397e+06 3.925403e+06 3.137812e+06 2.515825e+06 2.822410e+06 2.561041e+06 2.514698e+06 2.946136e+06 2.956301e+06 3.238779e+06 2.060526e+06 3.061797e+06 2.078901e+06 2.957676e+06 3.283632e+06 4.402818e+06 3.223647e+06 4.466194e+06 4.700252e+06 2.653521e+06 4.706893e+06 3.634505e+06 3.202313e+06 4.948860e+06 2.124350e+06 2.409721e+06 1.470499e+06 4.383135e+06 3.014512e+06 3.498993e+06 5.830450e+06 3.319226e+06 3.785211e+06 4.146605e+06 3.684060e+06 1.010073e+05 2.917551e+06 3.447742e+06 3.569812e+06 4.440613e+06 4.651160e+06 4.861540e+06 3.336722e+06 4.364437e+06 7.441983e+05 5.907352e+06 5.079492e+06 6.845898e+05 1.069053e+06 1.551265e+06 1.560489e+06 1.273628e+06 2.198044e+06 2.331181e+06 1.696502e+06 3.417487e+06 2.227805e+06 3.055970e+06 2.855711e+06 3.389196e+06 4.051142e+06 5.697623e+06 6.309588e+06 3.965387e+06 4.238300e+06 4.058304e+06 3.305142e+06 3.140890e+06 5.220788e+06 3.205916e+06 2.147369e+06 3.322366e+06 3.591627e+06 2.566707e+06 3.195392e+06 2.764507e+06 4.438152e+06 2.296573e+06 3.382375e+06 4.389505e+06 1.813370e+06 2.057279e+06 3.282493e+06 2.345939e+06 3.194302e+06 4.094582e+06 3.812781e+06 4.450993e+06 3.169394e+06 4.266986e+06 3.193717e+06 2.706035e+06 5.465994e+06 1.509695e+06 5.246903e+06 3.649451e+06 1.370905e+06 3.581001e+06 6.361292e+06 3.307422e+06 6.631747e+06 4.684146e+06 2.736844e+06 5.558219e+06 5.977035e+06 6.514018e+06 4.017525e+06 2.674403e+06 3.611503e+06 3.124551e+06 4.247426e+06 1.605089e+06 5.519619e+06 4.883071e+06 3.336996e+06 3.448469e+06 3.253515e+06 4.216652e+06 4.528761e+06 4.697075e+06 5.090540e+06 4.269724e+06 5.896282e+06 4.705639e+06 4.092733e+06 2.931379e+06 2.147687e+06 3.093683e+06 4.669216e+06 5.018436e+06 4.314244e+06 4.594115e+06 5.425715e+06 4.154147e+06 4.846915e+06 4.374498e+06 2.884257e+06 3.879704e+06 4.824397e+06 2.391752e+06 2.731926e+06 2.658577e+06 3.013658e+06 3.860976e+06 4.452560e+06 7.370791e+06 8.051362e+06 9.329157e+06 6.029218e+06 6.912604e+06 8.003152e+06 6.837779e+06 7.402611e+06 1.141106e+07 7.540465e+06 2.327922e+06 7.504277e+06 4.078137e+06 1.500306e+07 2.076914e+06 1.246748e+06 1.554468e+06 2.166028e+06 5.829264e+06 4.689511e+06 7.401922e+06 C10 H14 O3_1.795 1.113823e+05 6.494478e+05 4.310598e+05 5.519241e+05 5.633207e+04 7.233728e+05 5.155394e+05 7.212332e+05 53842.42 6.512579e+05 5.712741e+05 5.352736e+05 56269.29 5.930112e+05 5.920528e+05 5.358131e+05 1.057549e+05 6.426294e+05 6.753241e+05 5.072363e+05 1.348196e+05 5.353143e+05 6.880255e+05 8.094910e+05 84946.801 4.083157e+05 5.130455e+05 6.139209e+05 7.617884e+04 5.455324e+05 6.793501e+05 5.834166e+05 103802.68 6.286094e+05 6.778208e+05 6.002722e+05 1.161342e+05 4.212052e+05 5.678178e+05 5.993365e+05 8.417963e+04 6.240811e+05 5.126652e+05 8.353653e+05 7.314489e+04 4.931849e+05 7.170082e+05 4.473215e+05 5.255139e+05 5.923627e+05 4.584668e+05 8.275859e+05 3.772448e+05 3.952574e+05 5.377223e+05 6.067150e+05 6.663261e+05 8.350305e+05 6.783552e+05 6.172720e+05 6.419531e+05 9.008646e+05 7.768927e+05 5.004692e+05 5.586333e+05 3.625362e+05 4.647616e+05 3.898243e+05 5.969443e+05 5.018777e+05 7.169495e+05 9.265512e+05 5.404138e+05 5.489769e+05 6.115753e+05 4.571815e+05 6.361613e+05 8.759827e+05 4.830684e+06 3.707019e+05 5.974050e+05 5.712196e+05 4.327176e+05 5.053826e+05 4.818715e+05 4.373908e+05 1.322580e+05 2.230096e+05 8.369190e+05 6.377334e+05 4.659694e+05 3.793781e+05 7.704014e+05 6.346696e+05 8.475121e+05 7.547754e+05 6.360425e+05 3.790433e+05 4.402987e+05 6.550704e+05 7.778843e+05 3.639967e+05 3.674991e+05 4.537532e+05 8.460171e+05 6.727140e+05 3.003532e+05 4.858143e+05 4.684337e+05 3.154096e+05 3.073524e+05 1.288265e+06 7.025620e+05 4.493200e+05 1.080310e+06 5.464078e+05 8.646008e+05 1.846271e+05 3.985770e+05 4.785462e+05 2.974414e+05 3.344249e+05 3.848568e+05 5.817719e+05 3.185046e+05 4.974961e+05 2.292347e+06 3.828197e+05 4.785386e+05 6.099066e+05 6.220596e+05 2.652302e+05 3.695665e+05 3.730388e+05 3.546831e+05 4.268776e+05 5.062990e+05 5.799642e+05 4.756486e+05 5.062040e+05 4.928424e+05 8.833363e+05 4.480364e+05 3.415251e+05 4.401336e+05 4.290814e+05 5.183001e+05 3.213067e+05 3.323963e+05 6.933627e+05 5.143733e+05 3.814717e+05 3.231056e+05 4.787252e+05 6.043866e+05 3.990682e+05 7.593593e+05 1.153473e+06 1.152217e+06 5.987564e+05 4.947784e+05 5.510513e+05 3.983679e+05 4.062740e+05 5.605007e+05 3.568051e+05 3.400650e+05 3.919045e+05 4.292693e+05 2.607372e+05 3.215373e+05 3.420840e+05 5.556250e+05 2.884856e+05 4.405439e+05 3.931983e+05 7.751885e+05 6.737160e+05 6.796134e+05 7.226338e+05 1.176940e+06 2.240590e+05 3.596556e+05 1.484001e+06 5.321571e+05 5.190898e+05 5.492882e+05 5.330258e+05 1.608852e+06 3.233490e+05 1.066274e+06 5.736253e+05 3.649620e+05 8.415145e+05 1.118480e+06 5.792469e+05 1.177143e+06 1.704795e+06 4.754960e+05 2.429859e+06 1.905206e+06 2.027921e+06 5.028725e+05 3.879495e+05 3.955272e+05 3.916189e+05 3.982117e+05 3.574693e+05 6.767128e+05 2.184236e+05 3.206925e+05 4.312462e+05 5.495570e+05 4.510251e+05 5.660005e+05 3.739425e+05 1.398547e+06 8.742285e+05 6.379255e+05 7.612826e+05 5.012817e+05 3.686869e+05 6.515399e+05 5.103382e+05 7.756481e+05 1.565801e+06 7.118915e+05 5.077818e+05 1.196021e+06 5.271248e+05 4.959164e+05 8.051887e+05 3.629803e+05 3.459180e+05 5.414197e+05 4.526347e+05 3.498124e+05 5.548123e+05 6.130767e+05 4.246770e+05 9.880866e+05 2.260275e+05 4.306177e+05 4.784691e+05 5.025487e+05 5.900413e+05 4.750766e+05 4.383506e+05 5.936703e+05 8.490589e+05 6.166049e+05 7.645851e+05 6.591076e+05 4.598717e+05 9.649260e+05 3.253099e+05 4.598393e+05 6.980365e+05 3.075734e+05 5.462954e+05 3.615939e+05 3.619590e+05 809.674_1.795 6.805928e+05 5.575307e+05 6.606988e+05 4.687514e+05 3.184546e+04 4.258761e+05 4.057556e+05 3.343145e+05 44981.00 7.920585e+05 4.695056e+05 2.531313e+05 45002.62 7.625880e+05 5.149094e+05 3.947851e+05 6.491575e+04 6.510099e+05 5.831047e+05 5.637334e+05 1.019839e+05 5.421035e+05 2.875694e+05 1.347841e+05 60295.475 5.700749e+05 5.039505e+05 5.202906e+05 4.735416e+04 5.446576e+05 5.064954e+05 5.038498e+05 59114.10 4.609871e+05 6.052779e+05 6.828289e+05 6.718563e+04 5.650318e+05 2.224361e+05 3.122796e+05 6.171899e+04 8.374884e+05 3.725710e+05 4.550867e+05 2.842515e+04 5.579189e+05 5.760627e+05 7.072858e+04 5.816215e+05 4.658629e+05 1.308746e+05 5.501494e+05 5.725437e+05 4.540962e+05 3.307832e+05 8.128925e+04 6.964080e+05 6.545124e+05 3.822002e+05 5.674441e+05 8.705265e+05 1.153630e+06 8.856908e+05 1.827387e+06 4.484791e+05 4.614158e+05 4.129877e+05 4.519951e+05 1.036141e+06 6.912198e+05 6.239996e+05 8.831368e+05 7.933230e+05 8.940902e+05 3.354165e+05 6.014366e+05 6.280106e+05 8.816108e+05 3.392444e+05 7.066154e+05 8.777332e+05 1.155257e+06 5.083857e+05 1.501950e+05 9.010197e+05 9.839821e+05 3.738418e+05 7.231097e+05 8.965581e+05 8.884004e+05 2.861526e+05 4.220846e+05 4.682174e+05 1.225692e+06 2.942197e+05 2.148485e+05 1.997621e+05 1.372028e+06 8.340255e+05 4.778774e+05 8.843555e+05 5.357867e+05 1.030436e+06 4.347908e+05 4.465861e+05 4.601831e+05 4.796478e+05 5.543696e+05 1.351847e+06 9.992930e+05 3.928857e+05 2.355326e+05 1.682353e+05 3.133562e+05 3.646186e+05 8.928849e+05 3.497022e+05 7.568292e+05 4.547135e+05 6.988152e+05 5.629784e+05 1.321788e+05 3.175669e+05 4.498289e+05 6.604236e+05 7.741382e+05 4.020610e+05 1.139796e+05 8.189888e+05 2.916929e+05 8.703757e+05 5.108920e+05 6.163488e+05 9.186498e+05 1.033270e+06 7.368301e+05 5.044887e+05 5.694653e+05 6.471548e+05 3.006100e+05 8.919505e+05 3.175886e+05 6.230073e+05 5.581270e+05 5.804878e+05 4.956032e+05 1.273747e+06 1.057046e+05 1.961981e+05 3.316099e+05 1.420636e+06 1.832928e+05 4.715000e+05 9.147570e+05 5.788599e+05 3.299623e+05 5.849432e+05 5.913393e+05 1.907004e+05 8.319602e+05 8.431309e+05 3.810997e+05 4.262206e+05 4.092287e+05 5.959436e+05 4.448120e+05 4.347110e+05 4.571070e+05 8.707709e+05 3.165435e+05 9.187808e+05 2.791782e+05 9.099275e+05 6.587050e+05 5.758235e+05 5.993346e+05 2.422673e+05 7.866958e+05 7.004608e+05 5.840814e+05 1.817375e+05 3.908937e+05 6.428073e+05 7.969109e+05 1.050864e+06 3.433824e+05 1.630293e+05 1.267930e+05 2.944406e+05 4.857226e+05 1.031995e+06 4.102729e+05 1.939103e+05 7.146004e+05 3.910489e+05 1.172453e+06 1.520294e+05 1.460226e+05 1.052767e+06 5.151694e+05 3.708990e+05 8.762038e+05 5.395344e+05 3.745533e+05 8.056868e+05 4.184199e+05 8.802781e+05 8.362521e+05 6.533652e+05 3.989011e+05 2.263292e+05 1.578765e+05 6.803107e+05 2.117728e+05 5.864171e+05 3.653285e+05 1.199826e+06 1.315895e+05 4.937788e+05 2.604090e+05 1.405922e+05 1.574721e+05 8.001551e+05 5.779044e+05 1.549403e+05 3.083470e+05 6.371060e+05 4.735679e+05 5.040218e+05 4.920196e+05 4.946922e+05 6.181908e+05 6.377209e+05 4.234971e+05 1.774078e+05 3.488069e+05 2.881806e+05 7.368858e+05 1.947214e+06 6.120367e+05 5.758345e+05 9.799867e+05 8.117743e+05 4.528795e+05 6.554913e+05 5.767218e+05 3.531851e+05 2.235532e+05 5.843618e+05 5.422609e+05 1.171352e+06 3.489435e+05 1.099377e+06 1.131981e+06 1.561026e+05 2.812755e+05 4.359453e+05 2.079755e+06 5.479786e+05 1.355264e+06 5.186782e+05 3.022760e+05 C17 H20 N2 O5_1.795 1.503345e+05 2.792114e+06 6.206060e+06 6.775512e+06 6.567000e+04 3.990860e+06 7.742377e+06 9.539623e+06 55140.22 4.278744e+06 7.025502e+06 4.881486e+06 70593.97 2.770766e+06 5.987223e+06 6.104760e+06 1.818108e+05 3.435388e+06 7.145680e+06 7.805084e+06 1.831941e+05 2.530106e+06 5.930248e+06 1.205807e+07 121905.298 2.280620e+06 6.198164e+06 4.557832e+06 1.196571e+05 3.049963e+06 4.284807e+06 1.006858e+07 149677.40 4.328091e+06 7.643281e+06 4.815100e+06 1.746342e+05 4.684436e+06 6.809410e+06 5.517120e+06 1.677698e+05 3.594701e+06 5.188971e+06 1.098117e+07 9.021001e+04 3.501178e+06 4.668658e+06 5.989379e+06 4.627045e+05 5.490005e+05 5.353263e+05 1.855246e+06 3.127814e+05 2.948710e+05 1.803462e+06 1.432525e+06 2.116729e+05 8.924801e+05 1.095488e+06 1.076633e+06 5.740830e+06 2.777371e+06 1.046670e+06 9.635319e+05 1.755222e+06 5.421740e+05 7.554747e+05 1.931018e+06 6.243826e+05 9.149076e+05 4.091358e+06 2.195597e+06 1.012858e+06 1.139607e+06 9.528336e+05 6.982478e+05 1.343285e+06 3.919432e+05 3.260014e+06 9.177719e+05 6.212285e+05 6.255683e+05 5.787818e+05 1.162974e+06 1.940381e+06 3.785019e+05 4.408857e+05 1.742155e+05 3.292203e+05 1.018827e+06 1.543228e+06 9.058281e+05 3.237628e+05 5.266744e+05 9.051575e+05 8.991648e+05 3.647229e+05 1.990856e+06 1.217497e+06 1.482032e+06 6.245034e+05 8.130957e+05 9.208046e+05 6.586437e+05 9.057577e+05 9.551234e+05 2.505703e+05 2.769647e+05 2.755623e+07 6.431544e+05 5.703289e+05 6.412947e+05 2.593405e+05 9.589715e+05 1.097150e+06 3.939534e+05 3.227151e+05 6.337220e+05 4.552072e+05 3.722055e+06 6.360604e+05 5.605127e+05 2.365587e+05 2.350156e+05 3.544351e+05 4.099138e+05 5.107897e+05 5.094439e+05 9.383137e+05 3.150722e+06 7.046737e+05 1.664399e+05 4.177068e+05 1.327733e+06 1.014668e+06 7.402540e+05 1.033839e+06 3.983845e+05 2.118631e+05 1.792300e+06 5.067110e+05 3.246732e+05 7.318767e+05 6.123405e+05 5.353878e+05 5.773651e+05 8.718858e+05 5.824132e+05 1.693477e+05 4.673730e+05 5.955398e+05 4.231655e+05 1.708693e+05 1.422033e+06 2.726242e+05 4.625610e+05 1.157790e+06 1.522454e+06 1.964241e+06 1.346416e+06 3.260308e+05 9.779367e+05 5.532947e+05 2.414939e+05 5.179361e+05 2.456856e+06 1.339957e+06 9.066664e+05 3.206746e+05 6.893132e+05 1.925189e+06 4.647740e+05 6.686068e+05 5.010718e+05 5.674115e+05 8.680430e+05 1.246006e+06 8.735308e+05 7.200778e+05 6.026680e+05 2.200512e+06 3.204867e+05 3.090135e+05 7.046076e+05 4.210099e+05 7.240434e+05 8.816020e+05 7.428013e+05 2.730348e+06 1.097534e+06 6.770290e+05 1.981897e+05 5.461875e+05 2.912821e+05 6.061870e+06 1.108176e+06 3.848765e+05 1.360973e+06 1.418857e+06 1.289847e+06 1.557832e+06 5.129571e+05 3.120973e+05 1.793868e+06 5.516809e+05 1.697207e+06 1.732828e+06 2.949585e+05 1.835380e+06 1.295901e+06 1.783873e+06 7.222334e+05 3.264512e+05 9.411125e+05 3.161783e+05 1.010980e+06 8.737570e+05 1.450167e+06 2.786009e+06 2.657515e+06 9.702423e+05 7.710613e+05 1.344610e+06 6.482222e+05 8.650649e+05 2.815950e+06 1.214603e+06 4.437586e+05 5.843096e+05 4.697812e+05 2.478515e+06 3.326875e+05 3.418248e+05 7.436853e+05 3.885279e+06 5.303307e+05 7.065148e+05 3.897361e+05 7.803976e+05 8.723815e+05 1.675495e+06 6.485314e+06 6.973079e+05 1.206033e+06 1.328503e+06 4.816753e+06 1.954967e+06 3.508545e+06 5.261226e+05 7.918886e+05 3.688911e+06 2.176237e+06 1.671242e+06 1.146513e+06 2.962631e+06 7.809218e+06 1.408682e+06 6.991117e+06 3.050889e+05 3.203781e+05 1.250603e+06 6.464732e+06 4-Methoxybenzaldehyde_1.795 1.350745e+05 1.269070e+07 1.227128e+07 1.131602e+07 1.708969e+05 8.248824e+06 1.103629e+07 1.563902e+07 126594.38 8.913023e+06 1.216206e+07 1.158736e+07 109385.13 1.226343e+07 9.289581e+06 1.275615e+07 1.148643e+06 1.145330e+07 1.129715e+07 1.154109e+07 3.330575e+05 1.185827e+07 1.175802e+07 9.634871e+06 294579.466 1.115325e+07 1.262510e+07 1.423022e+07 2.648371e+05 8.790688e+06 1.149963e+07 1.333018e+07 268760.91 8.359985e+06 1.401062e+07 1.363332e+07 3.204351e+05 8.661282e+06 9.584397e+06 1.441782e+07 2.282004e+05 8.442638e+06 1.283762e+07 1.389190e+07 1.254531e+05 9.961188e+06 1.088731e+07 1.153158e+07 1.185099e+07 1.594965e+07 5.162536e+06 2.249239e+07 1.138260e+07 1.529291e+07 1.183610e+07 1.546627e+07 2.252682e+07 1.865849e+07 1.291136e+07 1.549849e+07 2.135259e+07 1.844932e+07 1.343533e+07 1.784420e+07 2.712673e+07 1.458561e+07 1.304252e+07 1.345223e+07 1.607087e+07 1.407205e+07 2.967370e+07 1.930671e+07 1.543695e+07 1.907509e+07 2.218582e+07 9.835568e+06 1.123651e+07 1.573354e+07 3.833993e+07 2.179229e+07 1.492291e+07 1.535184e+07 1.253752e+07 1.162722e+07 8.489831e+06 1.281389e+07 5.730030e+06 5.971532e+06 7.930456e+06 1.215583e+07 2.470096e+07 9.049537e+06 2.563016e+07 1.167537e+07 2.325515e+07 1.636178e+07 2.620776e+07 8.114385e+06 1.381802e+07 1.336826e+07 1.502985e+07 1.253255e+07 8.017081e+06 1.352816e+07 1.567159e+07 1.663859e+07 1.329419e+07 1.636412e+07 6.324521e+06 1.032782e+07 1.261765e+07 4.336762e+07 2.102507e+07 1.264683e+07 1.572257e+07 7.651901e+06 2.616062e+07 1.697766e+07 1.408863e+07 1.307338e+07 6.793354e+06 6.303171e+06 7.108370e+06 4.805587e+06 1.090527e+07 9.398344e+06 2.810972e+07 9.560660e+06 1.058880e+07 1.443381e+07 7.786964e+06 6.122606e+06 6.606938e+06 1.146552e+07 8.900902e+06 1.211397e+07 1.152646e+07 1.548525e+07 9.020245e+06 1.309822e+07 9.202915e+06 9.144743e+06 2.033695e+07 9.896424e+06 9.193823e+06 2.744619e+07 9.425614e+06 1.075189e+07 2.141354e+07 2.471553e+07 1.628559e+07 2.923233e+07 1.524802e+07 1.513283e+07 1.151036e+07 1.107816e+07 2.193434e+07 4.595712e+07 2.983440e+07 1.040707e+07 2.122641e+07 2.224752e+07 1.803635e+07 1.496586e+07 1.669791e+07 1.271914e+07 1.518337e+07 1.289323e+07 1.154319e+07 2.344620e+07 1.430466e+07 1.699906e+07 1.656875e+07 1.770623e+07 1.330725e+07 9.028049e+06 1.461476e+07 1.190765e+07 1.368463e+07 1.133791e+07 1.290135e+07 4.849715e+06 6.366550e+06 2.336054e+07 1.385299e+07 1.193398e+07 1.027404e+07 6.485774e+06 1.616818e+07 5.460166e+06 1.967605e+07 6.213060e+06 5.677557e+06 1.166151e+07 2.607158e+07 1.111898e+07 2.338535e+07 2.473855e+07 9.737826e+06 2.588129e+07 2.151618e+07 3.250285e+07 1.167878e+07 1.054845e+07 8.714522e+06 6.820881e+06 7.954256e+06 9.311046e+06 1.097471e+07 1.341775e+07 7.553017e+06 9.006319e+06 7.975946e+06 1.020021e+07 1.031341e+07 1.299690e+07 3.083793e+07 1.320426e+07 1.664157e+07 2.195164e+07 1.225607e+07 9.925112e+06 6.709926e+06 1.074879e+07 1.574130e+07 1.751697e+07 2.689567e+07 1.633166e+07 1.222772e+07 9.713436e+06 1.392178e+07 6.285091e+06 6.642781e+06 9.309872e+06 9.987641e+06 6.641015e+06 1.083963e+07 4.922509e+06 1.013359e+07 9.713507e+06 2.070954e+07 1.058119e+07 1.161083e+07 1.910727e+07 9.564379e+06 1.469727e+07 2.092011e+07 1.664620e+07 1.158247e+07 1.475494e+07 1.451097e+07 9.754428e+06 7.964187e+06 9.102305e+06 1.765193e+07 4.927362e+06 9.284403e+06 1.264935e+07 3.925086e+06 7.958928e+06 8.889798e+06 9.980066e+06 2-oxohex-4-enoic acid_1.795 3.658124e+05 2.150289e+07 1.943106e+07 1.611476e+07 1.125112e+05 1.176453e+07 4.510158e+07 1.592515e+07 148926.72 1.607936e+07 1.768139e+07 1.889900e+07 123308.53 1.477585e+07 4.377748e+07 9.458863e+06 2.666798e+05 2.889797e+07 2.240238e+07 6.917018e+07 3.812921e+05 6.114122e+06 2.448021e+07 2.966168e+07 236572.998 1.855230e+07 2.133765e+07 2.094191e+07 2.464466e+05 2.011506e+07 1.750326e+07 2.920967e+07 390759.45 2.128313e+07 1.886001e+07 1.999276e+07 3.363643e+05 1.475755e+07 2.168012e+07 2.000202e+07 2.189138e+05 1.619863e+07 2.569335e+07 1.670013e+07 9.030183e+04 3.119697e+07 1.576394e+07 1.610435e+07 1.027014e+07 1.061280e+07 9.705326e+06 1.404056e+07 1.458446e+07 1.538294e+07 1.264871e+07 1.639873e+07 2.238388e+07 1.944684e+07 1.386184e+07 1.422659e+07 2.656584e+07 2.083859e+07 1.590685e+07 5.359427e+07 3.850472e+07 8.834725e+06 3.906656e+07 3.804496e+07 1.748399e+07 1.559870e+07 1.429135e+07 3.175601e+07 6.385183e+07 2.802792e+07 1.124433e+07 3.468445e+07 5.220783e+07 2.155489e+07 8.159780e+05 1.014091e+07 1.251806e+07 1.698998e+07 1.360642e+07 1.288674e+07 1.519740e+07 1.470751e+07 1.416526e+07 8.646297e+06 4.897036e+07 2.252472e+07 1.590937e+07 1.174029e+07 2.100730e+07 3.265531e+06 4.440169e+07 1.633816e+07 6.332279e+06 1.248398e+07 1.953959e+07 1.114387e+07 1.175520e+07 1.830032e+07 2.151721e+07 5.659064e+06 4.077826e+07 1.985225e+07 1.605386e+07 2.084511e+07 8.775951e+06 9.553433e+06 3.236124e+07 3.870852e+07 2.754609e+07 2.627909e+07 1.413008e+07 1.234358e+07 6.403080e+07 4.263359e+07 1.561527e+07 1.586803e+07 1.169869e+07 8.158879e+06 2.436761e+07 2.350087e+07 6.780614e+06 4.161762e+07 3.721913e+07 1.468538e+07 1.102306e+07 1.228339e+07 3.717115e+07 5.645169e+05 1.838430e+07 4.403971e+07 9.805033e+06 3.476648e+07 4.160414e+07 6.888948e+06 2.017221e+07 3.159768e+07 2.238543e+07 8.466733e+07 7.992888e+06 1.343740e+07 1.013609e+07 2.822016e+07 1.510013e+07 1.823359e+07 2.109172e+07 2.153003e+07 1.319279e+07 1.801938e+07 2.201029e+07 1.348617e+07 1.935972e+07 1.423270e+07 2.051621e+07 1.588825e+07 2.102466e+07 1.532625e+07 1.913512e+07 2.111191e+07 1.395857e+07 7.519338e+06 1.959391e+07 9.803727e+06 2.328535e+07 1.224895e+07 8.981769e+06 1.278164e+07 1.337267e+07 1.542293e+07 1.494108e+07 1.448905e+07 1.014276e+07 1.409272e+07 2.492404e+07 2.419229e+07 1.819948e+07 3.144971e+07 3.616967e+07 3.407625e+07 1.852683e+07 2.625032e+07 3.121866e+07 3.522672e+07 1.941557e+07 1.892814e+07 6.390103e+07 1.900519e+07 3.774574e+07 2.481931e+07 2.676881e+07 3.386979e+07 4.693641e+07 2.139570e+07 3.058016e+07 7.653589e+07 4.215270e+07 3.295585e+07 5.985854e+07 1.093057e+08 3.375898e+07 1.873527e+07 2.130132e+07 1.581679e+07 3.055146e+07 1.779411e+07 3.805916e+07 1.303865e+07 3.037275e+07 2.803710e+07 2.296007e+07 3.253916e+07 1.999438e+07 7.005565e+07 2.819635e+07 2.355176e+07 2.274377e+07 2.638072e+07 2.224602e+07 4.306796e+07 1.676931e+07 1.984979e+07 3.667990e+07 2.853063e+07 8.784274e+07 1.305738e+07 4.512840e+07 1.947600e+07 3.461738e+07 2.467421e+07 3.308178e+07 3.027332e+07 8.734277e+07 2.433434e+07 2.634438e+07 9.515476e+07 1.877471e+07 1.469976e+07 2.747390e+07 1.327107e+07 2.730914e+07 2.075569e+07 1.593225e+07 1.229426e+07 2.238366e+07 1.754119e+07 4.525464e+07 2.118396e+07 1.504033e+07 1.660050e+07 1.230757e+07 1.374549e+07 1.638293e+07 8.348192e+06 7.216475e+06 1.285548e+07 1.571692e+07 3.771756e+07 1.560959e+07 2.163332e+07 1743187_1.796 2.031975e+05 1.381699e+07 3.420492e+07 1.151041e+07 9.086835e+04 9.531324e+06 1.506149e+07 1.412881e+07 249444.22 1.333855e+07 3.188128e+07 1.606766e+07 297555.44 1.285763e+07 1.550721e+07 2.126996e+07 5.040252e+05 1.418863e+07 2.018962e+07 3.684735e+07 3.767831e+05 7.916058e+06 1.961745e+07 2.567771e+07 266959.209 9.342585e+06 1.601159e+07 2.389502e+07 1.771436e+05 1.429996e+07 1.595459e+07 2.136150e+07 260371.79 1.846356e+07 9.381178e+06 1.918491e+07 2.880656e+05 1.636315e+07 1.947772e+07 1.412322e+07 5.866800e+05 1.728853e+07 1.488345e+07 2.736572e+07 1.235384e+05 1.273225e+07 1.462399e+07 1.793205e+07 8.653793e+06 1.051481e+07 2.365889e+07 1.376910e+07 1.749003e+07 4.169371e+06 1.627136e+07 1.393527e+07 2.576663e+07 1.644859e+07 4.092307e+07 1.539458e+07 3.660471e+07 2.238053e+07 1.779309e+07 3.985087e+07 1.472975e+07 7.097117e+06 1.802178e+07 3.568386e+07 2.378745e+07 2.280020e+07 3.460800e+07 3.025311e+07 5.449116e+07 2.475868e+07 5.005300e+06 5.052128e+06 3.625931e+07 1.905648e+07 2.260006e+05 3.616670e+06 2.203899e+07 1.625991e+07 1.015857e+07 1.331553e+07 1.410214e+07 1.955598e+07 8.939994e+06 8.093635e+06 1.071445e+07 1.821145e+07 1.552500e+07 1.433256e+07 1.685899e+07 7.942443e+06 1.619167e+07 1.649202e+07 3.488846e+07 2.034060e+07 1.835747e+07 1.438904e+07 1.286977e+07 3.194332e+07 2.627494e+07 3.593254e+06 1.132060e+07 1.176849e+07 1.356709e+07 4.084326e+07 9.378253e+06 6.686762e+06 9.851669e+06 1.975926e+07 4.326004e+07 9.703022e+06 1.202371e+07 1.094234e+07 2.951376e+07 2.624503e+07 3.049024e+07 1.382756e+07 2.416216e+07 4.162653e+06 2.317692e+07 1.795149e+07 6.669476e+06 2.401965e+07 1.169997e+07 1.303239e+07 1.075936e+07 1.002994e+07 3.804028e+07 5.734428e+05 3.571521e+07 3.485412e+06 1.112948e+07 1.771130e+07 3.152610e+07 1.057325e+07 1.912703e+07 3.639771e+07 9.378521e+06 1.363308e+07 1.442002e+07 9.298873e+06 2.138246e+07 1.301330e+07 1.482280e+07 9.310769e+06 1.833573e+07 4.773128e+07 1.333361e+07 1.570963e+07 5.523716e+07 1.588948e+07 1.676383e+07 1.103170e+07 1.373757e+07 1.492963e+07 2.287328e+07 1.362548e+07 1.437911e+07 1.153243e+07 1.081556e+07 7.986914e+06 1.615372e+07 1.013449e+07 2.537940e+07 9.071759e+06 8.986626e+06 2.162380e+07 1.116386e+07 1.320320e+07 1.541164e+07 1.210522e+07 1.041059e+07 1.117555e+07 1.766734e+07 2.275373e+07 1.614637e+07 1.857770e+07 2.784328e+07 1.761990e+07 2.228230e+07 2.539565e+07 2.378200e+07 2.245047e+07 1.708691e+07 3.744071e+07 6.196014e+07 2.237653e+07 2.947432e+07 1.075213e+07 1.775292e+07 3.112232e+07 1.757330e+07 1.937203e+07 2.660922e+07 3.042796e+07 2.162516e+07 2.958795e+07 5.746428e+07 4.201261e+07 1.271354e+07 1.658410e+07 3.276020e+07 1.788739e+07 2.668486e+07 1.444793e+07 3.389225e+07 1.340059e+07 2.558041e+07 2.481159e+07 1.586653e+07 1.478217e+07 3.804776e+07 5.735846e+07 7.052116e+07 2.372859e+07 2.472114e+07 2.329937e+07 1.982665e+07 1.647154e+07 1.328148e+07 2.196653e+07 2.849817e+07 2.467157e+07 5.668259e+07 2.151104e+07 5.020561e+07 1.780824e+07 3.124179e+07 2.616617e+07 2.862068e+07 5.309841e+07 2.782498e+07 1.936250e+07 2.172896e+07 2.200680e+07 2.009739e+07 1.232596e+07 1.689733e+07 1.430922e+07 2.167847e+07 1.703020e+07 1.326180e+07 1.080255e+07 2.973781e+07 1.262864e+07 3.292238e+07 1.782530e+07 1.077522e+07 1.127595e+07 1.045228e+07 2.848504e+07 1.363651e+07 8.408313e+06 6.481299e+06 9.497847e+06 3.482680e+07 3.357833e+07 1.082171e+07 5.415035e+07 CORTISOL 8.249532e+06 2.648585e+06 2.641849e+06 2.007967e+06 4.588448e+04 1.753135e+06 2.246419e+06 2.564693e+06 43525.35 2.191390e+06 2.776039e+06 2.621797e+06 40957.34 2.080795e+06 2.133632e+06 2.148783e+06 6.495419e+04 2.191358e+06 2.262662e+06 2.741074e+06 1.011951e+05 2.027087e+06 2.562439e+06 3.119811e+06 63738.065 1.733394e+06 1.905438e+06 2.380206e+06 6.572241e+04 2.051528e+06 2.468276e+06 2.912647e+06 88662.49 1.776438e+06 2.783858e+06 2.113104e+06 9.515812e+04 2.028891e+06 2.776612e+06 2.418022e+06 7.529862e+04 1.691863e+06 2.205315e+06 3.170905e+06 4.127935e+04 1.990263e+06 2.375457e+06 2.178877e+06 1.242155e+06 3.965786e+06 1.461336e+06 3.480150e+06 6.705423e+05 1.231180e+06 2.342511e+06 1.301685e+06 1.852028e+06 2.977124e+06 5.313309e+06 3.722168e+06 7.102221e+06 5.496233e+06 7.077132e+06 5.035521e+06 3.903974e+06 1.998697e+06 2.081709e+06 3.116378e+06 3.645327e+06 3.231249e+06 2.182099e+06 4.905520e+06 6.891617e+06 2.063218e+06 1.902912e+06 2.268321e+06 1.062938e+06 2.954473e+06 2.652345e+06 1.825904e+06 1.088714e+06 4.204028e+06 6.625932e+05 1.896907e+06 1.538793e+06 1.922062e+06 1.973035e+06 1.639201e+06 2.730130e+06 6.053023e+06 1.826811e+06 1.242557e+06 1.717286e+06 1.006689e+06 1.312586e+06 2.135304e+06 2.237081e+06 1.848410e+06 1.090093e+06 3.070611e+06 2.566697e+06 2.078883e+06 1.494008e+06 1.590701e+06 6.300934e+05 4.714444e+06 1.487944e+06 1.492116e+06 1.399618e+06 3.208894e+06 4.483835e+06 3.679920e+06 4.610147e+06 1.314377e+06 8.700747e+05 2.620787e+06 4.633010e+06 4.901608e+06 8.508370e+05 3.157289e+06 1.466980e+06 3.742747e+05 1.390059e+06 3.504335e+06 2.898278e+06 2.883341e+06 6.597452e+06 8.898202e+05 1.159332e+06 1.842555e+06 3.348333e+06 2.322705e+06 1.735814e+06 1.173293e+05 2.263646e+06 6.400514e+06 1.427274e+06 3.022726e+06 1.177875e+06 3.546167e+06 9.257819e+05 2.562020e+06 1.241992e+06 9.274309e+05 1.965874e+06 1.723488e+06 3.465042e+06 1.587062e+06 2.912681e+06 1.194270e+06 1.437829e+06 1.888201e+06 6.516787e+05 2.177567e+06 2.138561e+06 1.051692e+06 2.039419e+06 4.170063e+06 3.775536e+06 4.764795e+06 4.377506e+06 4.919885e+06 1.655869e+06 8.970670e+05 2.428054e+06 1.816376e+06 3.722517e+06 1.713410e+06 2.871113e+06 1.782765e+06 2.156621e+06 4.551203e+06 2.060903e+06 1.838345e+06 9.615786e+05 9.849186e+05 2.363201e+06 3.813389e+06 5.178932e+06 1.359152e+06 1.687565e+06 2.456827e+06 4.553478e+06 9.033497e+05 5.921882e+06 1.608954e+05 5.949471e+05 1.053781e+06 1.211367e+06 3.046823e+06 2.002066e+05 2.014675e+06 1.564850e+05 1.563684e+06 3.271569e+05 1.249589e+06 2.933591e+06 2.624085e+06 1.472097e+06 8.080188e+06 9.212253e+05 1.491862e+06 1.563246e+06 1.159816e+06 1.888597e+06 3.893174e+06 7.454139e+05 1.601580e+06 3.172569e+06 3.405026e+05 2.178782e+06 1.367667e+06 1.485011e+06 2.273113e+06 3.683016e+05 1.688096e+06 3.252037e+06 1.555645e+06 6.506450e+05 1.401728e+06 1.661498e+06 6.822587e+05 4.581562e+06 2.446674e+06 1.717158e+06 1.653091e+06 4.831708e+05 2.984511e+06 2.201799e+06 5.127954e+06 1.850515e+06 1.305698e+06 3.031239e+06 3.289866e+06 1.406114e+06 2.096375e+06 1.564409e+06 4.863541e+06 4.096170e+06 6.058151e+06 9.262498e+06 3.790761e+06 3.284986e+06 6.115056e+06 2.117711e+06 2.102238e+06 6.250251e+06 5.372655e+06 3.517616e+06 4.056749e+06 1.581358e+06 3.625519e+06 3.056170e+06 2.753247e+06 5.226409e+06 6.187968e+06 2.519205e+06 2.906419e+06 3.845439e+06 1.457218e+06 1.959006e+06 2.696802e+06 C15 H31 N O9_1.797 5.549285e+04 4.408034e+05 3.295254e+05 1.861543e+05 6.540862e+04 5.030396e+05 2.504777e+05 3.513359e+05 81089.56 5.291135e+05 3.624109e+05 2.502415e+05 79747.45 3.550743e+05 3.657109e+05 1.872621e+05 1.576838e+05 4.498981e+05 3.760977e+05 3.634109e+05 1.759317e+05 2.774343e+05 4.247736e+05 4.975595e+05 103920.142 2.947545e+05 3.626737e+05 3.220737e+05 1.003930e+05 2.579661e+05 2.028472e+05 5.121671e+05 128497.84 1.939608e+05 3.566460e+05 3.405680e+05 1.353824e+05 3.047201e+05 2.113281e+05 1.987800e+05 1.122082e+05 2.207570e+05 3.519093e+05 4.361461e+05 6.126397e+04 4.672512e+05 2.356472e+05 2.318640e+05 3.569579e+05 3.076935e+05 2.943177e+05 3.138763e+05 3.331432e+05 4.462822e+05 1.723730e+05 2.908141e+05 1.850296e+05 2.597831e+05 5.205833e+05 3.303832e+05 4.682036e+05 2.129360e+05 2.694584e+05 2.212632e+05 2.671946e+05 8.789225e+05 2.219629e+05 2.111775e+05 2.139358e+05 2.628844e+05 4.787648e+05 2.139398e+05 3.482019e+05 2.525940e+05 7.723379e+05 4.180372e+05 6.470601e+05 6.677397e+05 1.826034e+05 1.024470e+06 5.586076e+05 4.936967e+05 7.193383e+05 6.355158e+05 4.215928e+05 7.793643e+05 7.398742e+05 3.140091e+05 7.676602e+05 6.254155e+05 3.997192e+05 8.802821e+05 4.023856e+05 2.241608e+05 2.506468e+05 1.778065e+05 1.993370e+05 1.937394e+05 1.651887e+05 3.420907e+05 1.681803e+05 3.043524e+05 1.984812e+05 2.945307e+05 2.264339e+05 3.934976e+05 3.914908e+05 2.415988e+05 1.664386e+05 1.937723e+05 2.385188e+05 3.022958e+05 2.634287e+05 1.830788e+05 4.194696e+05 1.565425e+05 2.307684e+05 2.450763e+05 1.988091e+05 2.229510e+05 1.723986e+05 1.579150e+05 1.679337e+05 1.975224e+05 2.197965e+05 1.917227e+05 2.485671e+05 2.464456e+05 1.578755e+05 2.182211e+05 3.198879e+05 1.829425e+05 1.716493e+05 3.682952e+05 1.978673e+05 3.086784e+05 4.380976e+05 2.290970e+05 1.843244e+05 2.378804e+05 2.991997e+05 2.622810e+05 4.437487e+05 2.959978e+05 2.037905e+05 1.964708e+05 2.786421e+05 2.211358e+05 2.259788e+05 2.941019e+05 2.450349e+05 7.205843e+05 3.792649e+05 4.169690e+05 1.954826e+05 1.970838e+05 3.535908e+05 2.215981e+05 2.109121e+05 2.555847e+05 1.941053e+05 1.970632e+05 1.632697e+05 4.089680e+05 7.491313e+05 6.134784e+05 1.706247e+05 5.165505e+05 3.651977e+05 2.217451e+05 6.963815e+05 1.488208e+05 1.852979e+05 3.298092e+05 7.910827e+05 4.814131e+05 2.099880e+05 2.588338e+05 1.619773e+05 1.883372e+05 8.450906e+05 8.518615e+05 3.439090e+05 7.382957e+05 3.518742e+05 2.465964e+05 4.885100e+05 2.393791e+05 5.775178e+05 5.155111e+05 8.377032e+05 4.520905e+05 2.003426e+05 3.026687e+05 5.259190e+05 2.254938e+05 8.413350e+05 8.535011e+05 7.555277e+05 8.749431e+05 9.944550e+05 7.297564e+05 2.128060e+05 7.907188e+05 5.055957e+05 3.050711e+05 6.660173e+05 1.943865e+05 8.214362e+05 4.957425e+05 3.005584e+05 2.974926e+05 7.471171e+05 1.003208e+06 2.554396e+05 6.238971e+05 1.221503e+06 2.843890e+05 6.769389e+05 6.069569e+05 1.247659e+06 4.856782e+05 3.186705e+05 5.014719e+05 2.237235e+05 5.307031e+05 3.256341e+05 2.114706e+05 4.656556e+05 5.468623e+05 2.956330e+05 5.300964e+05 2.369896e+05 2.602237e+05 2.645039e+05 4.617520e+05 4.516535e+05 4.721948e+05 2.348518e+05 2.981499e+05 4.891641e+06 3.181632e+05 2.418955e+05 4.076348e+05 4.560481e+05 4.230653e+05 3.867068e+05 1.794609e+05 3.104198e+05 2.467168e+05 6.042752e+05 4.161244e+05 3.458975e+05 3.251105e+05 5.615652e+05 4.083611e+05 6.089870e+05 2.794763e+05 3.134574e+05 4.256505e+05 3.062280e+05 2.165699e+05 C17 H29 N5 O2_1.797 2.394417e+04 4.573027e+05 4.856044e+05 5.248939e+05 2.808929e+04 4.768632e+05 4.312934e+05 5.917401e+05 41215.74 4.643337e+05 4.266078e+05 4.777665e+05 48672.28 4.535988e+05 5.496524e+05 4.881498e+05 8.101553e+04 3.877339e+05 5.027109e+05 5.983161e+05 1.298942e+05 4.777852e+05 3.828644e+05 4.180889e+05 73506.151 5.524642e+05 4.401307e+05 4.303099e+05 6.282043e+04 6.223890e+05 5.686914e+05 6.094983e+05 91027.71 2.282550e+05 3.634119e+05 4.239888e+05 8.704852e+04 5.654269e+05 6.435536e+05 5.230813e+05 6.554051e+04 3.122313e+05 5.044451e+05 4.890975e+05 4.257295e+04 5.272083e+05 6.046299e+05 3.147469e+05 3.155565e+05 4.093715e+05 2.773907e+05 5.835732e+05 2.757389e+05 6.285100e+05 4.634925e+05 1.999600e+05 2.245408e+05 2.702345e+05 6.691779e+05 5.839711e+05 5.802823e+05 5.224898e+05 5.353516e+05 3.373493e+05 2.741965e+05 2.277229e+05 1.816533e+05 2.877215e+05 4.045459e+05 3.910339e+05 2.211753e+05 1.976690e+05 2.121220e+05 5.421198e+05 3.316865e+05 1.930128e+05 2.238650e+05 2.690811e+05 6.869032e+06 1.146076e+05 2.092219e+05 1.554234e+05 1.302593e+05 1.977441e+05 1.771849e+05 2.197431e+05 1.304077e+05 9.354580e+04 1.110526e+05 2.451646e+05 4.094691e+05 9.709628e+04 5.867435e+05 3.689021e+05 4.802427e+05 4.574705e+05 4.460491e+05 2.224330e+05 4.347850e+05 4.558876e+05 2.295756e+05 4.764667e+05 2.128054e+05 1.472862e+05 4.086971e+05 4.373078e+05 4.151767e+05 7.111466e+05 2.169545e+05 2.017955e+05 1.991268e+05 4.679760e+05 3.452021e+05 2.134444e+05 1.129952e+05 1.734562e+05 2.360819e+05 1.185239e+05 1.447224e+05 6.700675e+05 2.494680e+05 1.958924e+05 1.044651e+05 1.761753e+05 1.283269e+05 1.157406e+05 1.618719e+05 1.869240e+05 1.936883e+05 1.724312e+05 5.680989e+05 7.429089e+05 3.255918e+05 5.183842e+05 4.367494e+05 2.995848e+05 5.591244e+05 5.813184e+05 5.523190e+05 5.571856e+05 9.755588e+05 4.123990e+05 5.892261e+05 1.063927e+06 1.517427e+06 1.496865e+06 1.921147e+06 1.582236e+06 2.168908e+06 2.068864e+06 1.725385e+06 9.010435e+05 4.448404e+05 3.065244e+05 1.584140e+05 3.178696e+05 3.108031e+05 5.562303e+05 5.592136e+05 3.463155e+05 4.884450e+05 3.462099e+05 3.831002e+05 7.002341e+05 1.308220e+06 6.603658e+05 4.319408e+05 8.411794e+05 8.255090e+05 6.160923e+05 5.645971e+05 3.215995e+05 8.094710e+05 9.169670e+05 8.662831e+05 6.287663e+05 4.694692e+05 5.001886e+05 5.454519e+05 4.136001e+05 3.383003e+05 3.909925e+05 2.774684e+05 2.716348e+05 9.245343e+05 1.650861e+05 2.405761e+05 1.623497e+05 3.242888e+05 1.506541e+05 4.462588e+05 1.673503e+05 1.470130e+05 5.384492e+05 9.763129e+05 2.655880e+05 3.252285e+05 4.784088e+05 3.599399e+05 1.903747e+05 2.157389e+05 2.496732e+05 3.685993e+05 2.292986e+05 1.638279e+05 1.321098e+05 3.287640e+05 1.042292e+05 2.158740e+05 2.893284e+05 1.712480e+05 1.688462e+05 3.687534e+05 1.619310e+05 1.122955e+06 1.660075e+05 5.181097e+05 1.551635e+05 3.814643e+05 1.058471e+06 1.335384e+05 1.400041e+05 1.309094e+05 3.578496e+05 5.872164e+05 1.651962e+05 4.691727e+05 2.610521e+05 3.082291e+05 1.110548e+06 1.855632e+05 1.735525e+05 2.451112e+05 2.549766e+05 3.292335e+05 1.243137e+05 2.381126e+05 1.764643e+05 1.124338e+05 5.429337e+05 8.848386e+05 4.197558e+05 1.620118e+05 3.787959e+05 2.414437e+05 3.273329e+05 4.019858e+05 5.937426e+05 3.781279e+05 3.770631e+05 4.505453e+05 8.209912e+05 2.074061e+05 2.746572e+05 7.377710e+05 7.584904e+05 7.279393e+05 5.311074e+05 5.433773e+05 2.287358e+06 6.283546e+05 1.980203e+05 C11 H21 N6 O5 P_1.798 3.687291e+04 4.336711e+06 3.858158e+06 4.210975e+06 4.051812e+04 2.958769e+06 5.850716e+06 5.355898e+06 44725.53 3.413264e+06 4.263691e+06 4.582650e+06 51834.67 3.537635e+06 4.214174e+06 3.531035e+06 9.702924e+04 3.989152e+06 4.876353e+06 4.001429e+06 1.342996e+05 2.385979e+06 5.946960e+06 6.412859e+06 76526.107 2.557079e+06 4.433263e+06 3.604453e+06 8.070615e+04 3.830463e+06 4.179427e+06 5.742111e+06 124636.27 2.913900e+06 3.921126e+06 4.713405e+06 1.332371e+05 3.877731e+06 4.944728e+06 4.338258e+06 1.037928e+05 3.172135e+06 4.768135e+06 5.221065e+06 5.712981e+04 2.678237e+06 4.914706e+06 4.010234e+06 1.737182e+05 1.253302e+05 1.649764e+05 7.408312e+05 4.021472e+05 2.925457e+05 7.216262e+05 2.153159e+05 2.326025e+05 5.767468e+05 6.355520e+05 1.533931e+06 3.542116e+06 9.198873e+05 9.457030e+05 2.207437e+05 1.762863e+06 3.531587e+05 6.824120e+05 1.050545e+06 1.971556e+05 2.913041e+05 1.353379e+06 8.499068e+05 3.558644e+05 7.651696e+05 6.869949e+05 1.255347e+06 1.025887e+06 1.342111e+05 1.552144e+06 7.175898e+05 4.922823e+05 3.481630e+05 2.169371e+05 9.444569e+05 1.643490e+06 2.804505e+05 1.645542e+05 1.025082e+05 1.118134e+05 8.263737e+05 6.231005e+05 9.558045e+05 1.790511e+05 1.958781e+05 2.056317e+05 5.465783e+05 3.643514e+05 1.739954e+06 1.205103e+06 9.116050e+05 1.388565e+05 6.863589e+05 8.195602e+05 4.464004e+05 6.897492e+05 2.250107e+05 1.900491e+05 2.113887e+05 2.356646e+07 5.551238e+05 2.697301e+05 8.191928e+05 2.005340e+05 7.606930e+05 9.869472e+05 2.957332e+05 6.371331e+05 1.714211e+05 3.606828e+05 4.804503e+06 3.595710e+05 1.798816e+05 1.373172e+05 1.587385e+05 2.299969e+05 3.145407e+05 5.236728e+05 1.880641e+05 5.877815e+05 2.554099e+06 4.006228e+05 1.312363e+05 1.886194e+05 1.134770e+06 5.932199e+05 5.742197e+05 7.771521e+05 2.423848e+05 1.589908e+05 1.314551e+06 1.609300e+05 2.000933e+05 6.711715e+05 5.559255e+05 5.361098e+05 2.871396e+05 7.236810e+05 3.810049e+05 1.324276e+05 3.551300e+05 6.660546e+05 4.710443e+05 1.528116e+05 9.251575e+05 1.658538e+05 1.371921e+05 6.541118e+05 7.156608e+05 1.222160e+06 8.431092e+05 1.720986e+05 5.167665e+05 2.727938e+05 1.589939e+05 3.297826e+05 1.154261e+06 3.372303e+05 5.761757e+05 1.911479e+05 1.972565e+05 1.819951e+06 1.503307e+05 4.851158e+05 2.760620e+05 1.622414e+05 6.082429e+05 6.412253e+05 3.004744e+05 2.859848e+05 5.961061e+05 2.425438e+06 1.897220e+05 1.746552e+05 7.478378e+05 1.532166e+05 2.806838e+05 3.554125e+05 3.430573e+05 1.656935e+05 4.713810e+05 4.067046e+05 2.357302e+05 8.077477e+05 2.731029e+05 3.407085e+06 1.039241e+06 2.850805e+05 3.061781e+05 7.632683e+05 2.119947e+05 2.031370e+05 6.176332e+05 3.267803e+05 1.778364e+06 2.345010e+05 2.355040e+06 1.209223e+06 1.145084e+05 1.168084e+06 4.825374e+05 1.113075e+06 3.806887e+05 2.076813e+05 3.030913e+05 1.919852e+05 4.353568e+05 6.147175e+05 7.509230e+05 3.227730e+06 2.021460e+06 3.898739e+05 4.932753e+05 1.507568e+06 4.959403e+05 7.402237e+05 1.154506e+06 2.452973e+05 2.104723e+05 2.255674e+05 3.148291e+05 5.870054e+06 3.627001e+05 2.123924e+05 8.357723e+05 1.361817e+06 1.932631e+05 2.420470e+05 3.129004e+05 7.220745e+05 9.472292e+05 9.462607e+05 2.106761e+06 6.833183e+05 7.985893e+05 9.710733e+05 1.532908e+06 9.104360e+05 1.788440e+06 2.657166e+05 4.729316e+05 2.470495e+06 1.219389e+06 2.167553e+06 8.335094e+05 2.151534e+06 5.060244e+06 6.749022e+05 6.560926e+06 1.793194e+05 2.540372e+05 6.922480e+05 2.381079e+06 SALICYLAMIDE 1.301409e+06 6.141399e+05 5.531431e+05 6.979531e+05 8.482379e+04 4.161136e+05 5.833160e+05 5.954797e+05 89621.61 5.601747e+05 6.384147e+05 7.023546e+05 85397.27 4.774564e+05 5.536473e+05 6.230496e+05 2.804535e+05 5.493437e+05 6.127579e+05 5.003190e+05 3.718094e+05 4.694603e+05 5.991975e+05 8.143279e+05 125870.275 5.972637e+05 4.798979e+05 5.588151e+05 1.293510e+05 4.810378e+05 5.777592e+05 8.472824e+05 195786.74 3.923121e+05 6.462442e+05 5.282589e+05 2.246186e+05 5.717730e+05 5.708926e+05 4.195694e+05 1.785968e+05 3.080276e+05 7.309921e+05 7.512847e+05 1.263898e+05 4.379088e+05 6.488975e+05 4.781665e+05 6.408826e+05 7.402650e+05 5.251875e+05 5.604510e+05 6.497739e+05 3.098298e+05 5.838560e+05 5.643048e+05 5.081165e+05 4.715955e+05 2.411012e+06 2.407319e+05 5.229874e+05 1.034221e+06 5.944656e+05 8.923340e+05 5.494607e+05 6.718822e+05 7.977413e+05 3.202813e+05 5.089473e+05 3.282539e+05 3.246660e+05 6.990471e+05 1.334418e+06 3.570132e+05 5.986882e+05 3.274532e+05 9.731181e+05 3.788066e+05 7.710295e+05 9.720420e+05 5.562944e+05 4.364866e+05 7.195338e+05 7.176965e+05 3.483201e+05 5.262037e+05 5.638740e+05 3.955833e+05 3.719810e+05 1.199279e+06 7.214892e+05 3.434316e+05 3.284017e+05 1.045554e+06 3.995182e+05 4.734518e+05 3.188906e+05 6.736829e+05 2.920468e+05 3.413342e+05 5.505721e+05 4.869201e+05 3.171062e+05 3.057409e+05 6.788785e+05 3.704275e+05 4.014590e+05 6.584255e+05 4.945492e+05 5.766937e+05 2.373616e+05 3.878565e+05 6.437683e+05 1.751896e+06 6.976210e+05 2.866199e+05 9.312113e+05 5.135515e+05 4.738243e+05 1.076418e+06 3.794450e+05 2.923338e+05 3.248114e+05 4.710816e+05 1.000177e+06 5.184630e+05 3.185443e+05 4.863881e+05 3.049403e+05 5.909655e+05 4.363050e+05 9.330904e+05 8.567643e+05 4.422051e+05 6.073349e+05 6.048622e+05 5.446665e+05 3.234903e+05 3.020594e+05 3.619027e+05 2.662693e+05 4.030229e+05 5.276601e+05 5.944827e+05 5.706668e+05 2.908414e+05 3.079521e+05 3.442687e+05 2.424759e+05 5.853999e+05 5.112446e+05 4.529451e+05 7.636809e+05 3.866116e+05 8.418704e+05 8.055293e+05 4.673514e+05 6.788146e+05 2.815758e+05 2.552021e+05 5.413922e+05 6.170458e+05 4.056708e+05 5.463392e+05 3.068654e+05 4.208927e+05 2.529919e+06 6.747732e+05 2.873664e+05 1.944110e+06 1.041197e+06 4.737672e+05 5.178371e+05 2.076696e+05 8.021829e+05 3.962694e+05 9.935918e+05 5.873100e+05 4.184877e+05 3.359562e+05 7.762510e+05 3.772755e+05 8.414527e+05 3.498540e+05 6.327816e+05 3.654801e+05 2.353367e+05 5.287884e+05 9.802597e+05 9.694378e+05 1.058510e+06 1.169300e+06 3.277644e+05 5.907205e+05 5.888258e+05 2.627388e+05 1.227573e+06 4.834858e+05 7.062477e+05 5.664893e+05 3.508729e+05 6.231271e+05 4.175185e+05 3.434285e+05 3.060174e+05 3.483410e+05 4.645886e+05 2.547557e+05 7.713445e+05 2.848958e+05 3.172715e+05 1.004952e+06 4.442128e+05 3.421853e+05 8.927059e+05 4.547837e+05 1.322233e+06 8.434747e+05 5.240287e+05 4.431432e+05 3.622269e+05 4.180027e+05 5.216048e+05 6.219180e+05 5.567229e+05 4.336192e+05 6.487117e+05 7.665435e+05 3.249711e+05 4.530598e+05 2.979118e+05 7.410019e+05 9.067734e+05 5.251854e+05 6.438452e+05 5.783548e+05 4.208427e+05 3.881446e+05 2.321908e+06 9.593176e+05 6.984487e+05 1.180523e+07 5.082214e+05 3.265609e+06 2.572252e+05 4.655685e+05 4.849263e+05 2.617512e+06 1.058822e+06 5.182485e+05 6.324255e+06 6.578638e+05 6.145993e+05 1.124573e+06 4.436302e+05 4.820654e+05 4.587288e+05 4.291999e+05 5.854939e+05 4.736205e+05 3.593651e+05 6.194114e+05 C11 H21 N O4_1.799 3.533511e+04 3.465620e+05 2.469094e+05 3.254071e+05 4.041992e+04 2.088979e+05 2.657554e+05 1.304956e+05 50006.70 3.655991e+05 2.891627e+05 2.554358e+05 55548.97 2.784072e+05 2.870967e+05 1.655804e+05 2.088618e+05 3.371891e+05 1.757450e+05 2.567505e+05 1.494304e+05 3.846040e+05 3.244913e+05 1.821582e+05 86682.152 2.603893e+05 1.545520e+05 2.913935e+05 6.450197e+04 4.041708e+05 2.773517e+05 3.326923e+05 91136.07 1.387035e+05 3.080579e+05 1.941827e+05 1.252503e+05 2.792401e+05 2.984567e+05 2.916797e+05 1.071051e+05 1.860799e+05 4.226168e+05 2.583631e+05 5.846085e+04 2.964862e+05 2.722469e+05 1.834446e+05 1.814630e+05 1.773492e+05 1.728663e+05 1.928987e+05 2.708199e+05 1.658932e+05 2.315829e+05 2.329113e+05 1.459273e+05 2.710846e+05 2.569464e+05 1.485905e+05 2.426388e+05 1.840702e+05 2.376273e+05 2.202952e+05 1.899294e+05 1.703398e+05 2.322382e+05 1.954547e+05 2.272159e+05 2.073311e+05 3.790743e+05 2.703023e+05 7.103169e+05 3.766142e+05 1.201745e+05 1.279197e+05 1.715953e+05 1.989564e+05 7.644578e+06 1.824037e+05 1.836560e+05 2.074173e+05 1.726547e+05 1.441493e+05 1.252898e+05 1.822503e+05 1.703745e+05 1.070816e+05 1.287338e+05 1.445927e+05 2.775730e+05 1.248687e+05 2.738935e+05 1.121954e+05 3.231379e+05 3.219233e+05 1.854482e+05 1.890071e+05 3.171618e+05 3.285743e+05 2.619197e+05 1.945022e+05 1.240418e+05 2.909169e+05 3.034239e+05 2.753675e+05 1.732247e+05 1.387943e+05 1.053109e+05 8.980236e+04 1.099882e+05 3.402220e+05 2.231302e+05 1.655210e+05 1.621524e+05 9.132115e+04 1.813530e+05 1.773453e+05 1.175867e+05 2.467183e+05 2.044797e+05 1.689433e+05 1.555424e+05 1.205541e+05 1.774026e+05 1.862726e+05 1.230936e+05 2.023794e+05 1.422482e+05 1.403982e+05 1.458810e+05 4.083446e+05 1.610963e+05 1.124449e+05 1.025229e+05 2.049856e+05 3.146100e+05 2.196121e+05 1.403189e+05 1.599915e+05 2.794382e+05 3.979936e+05 1.812917e+05 2.149743e+05 3.667450e+05 3.450072e+05 8.688594e+05 5.285557e+05 3.634917e+05 4.251802e+05 5.655444e+05 2.563869e+05 2.397544e+05 1.586408e+05 1.558170e+05 2.127967e+05 1.891309e+05 1.359552e+05 2.484795e+05 2.258080e+05 2.321548e+05 1.412207e+05 1.205709e+05 2.364211e+05 2.508330e+05 1.202284e+05 1.660859e+05 2.094535e+05 1.724454e+05 2.825051e+05 1.442581e+05 1.396815e+05 1.718860e+05 1.345260e+05 2.449608e+05 2.454170e+05 1.360017e+05 1.889996e+05 1.494217e+05 1.738749e+05 1.837944e+06 1.894166e+05 1.816338e+05 9.286524e+05 2.422961e+05 1.949557e+05 1.242306e+05 1.789441e+05 9.210847e+05 1.950643e+05 1.338821e+06 1.567353e+05 2.876608e+05 2.114354e+05 2.009648e+06 2.032367e+05 2.657178e+06 2.029743e+06 1.335733e+05 8.425287e+05 8.893640e+05 9.093382e+05 2.310048e+05 1.503470e+05 1.311482e+05 1.517815e+05 1.762277e+05 1.520184e+05 2.405984e+05 2.417572e+05 1.803507e+05 1.884610e+05 1.400221e+05 1.606496e+05 2.901523e+05 1.950353e+05 7.821543e+05 2.312928e+05 2.944833e+05 5.057498e+05 1.573297e+05 1.605595e+05 1.394969e+05 2.103937e+05 2.067625e+05 1.897290e+05 2.538160e+05 2.131345e+05 2.450451e+05 1.408988e+05 2.066446e+05 3.016714e+05 3.090248e+05 1.820134e+05 2.044256e+05 2.276712e+05 1.515948e+05 1.888954e+05 1.521632e+05 1.501640e+05 4.281186e+05 1.222201e+05 1.738512e+05 3.214357e+05 2.983521e+05 2.722505e+05 2.276612e+05 1.213690e+05 3.205934e+05 3.954776e+05 1.323747e+05 1.124415e+05 2.569725e+05 1.224549e+05 4.160087e+05 1.334553e+05 1.217870e+05 1.585645e+05 2.764668e+05 5.685121e+05 1.377781e+05 3.828542e+05 cis-2-Carboxycyclohexyl-acetic acid_1.799 2.301203e+05 1.135808e+09 1.052318e+09 1.041201e+09 2.591666e+05 6.381741e+08 1.082176e+09 1.102613e+09 252105.62 9.824787e+08 1.014611e+09 1.069644e+09 231944.47 9.903258e+08 9.755828e+08 9.408185e+08 4.581305e+05 9.517891e+08 9.728792e+08 1.039433e+09 5.384195e+05 9.378151e+08 1.205827e+09 1.213475e+09 389101.488 8.552716e+08 1.167973e+09 1.976164e+08 4.459468e+05 1.197694e+09 1.298316e+09 1.513604e+09 558254.52 1.862762e+08 1.204961e+09 1.077026e+09 5.381725e+05 9.492310e+08 1.135310e+09 1.003522e+09 3.813099e+05 7.906425e+08 1.041527e+09 1.136175e+09 2.034216e+05 1.003853e+09 1.025541e+09 9.235094e+08 5.162956e+08 6.857606e+08 6.390664e+08 9.204958e+08 8.265614e+08 8.417262e+08 7.633286e+08 7.063212e+08 8.929601e+08 9.048708e+08 1.074818e+09 8.659220e+08 1.533914e+09 8.272890e+08 8.897655e+08 2.647869e+08 9.712775e+08 5.190794e+08 8.999093e+08 9.203993e+08 8.994288e+08 1.181632e+09 1.232061e+09 1.314662e+09 1.445112e+09 2.001828e+08 1.137842e+09 1.205065e+09 9.791645e+08 8.692974e+08 1.368225e+08 8.869144e+08 8.562200e+08 7.805382e+08 6.384495e+08 7.043816e+08 6.683812e+08 9.457435e+08 7.777595e+08 5.354912e+08 8.000430e+08 1.056301e+09 1.101249e+09 8.528128e+08 1.186022e+09 8.199654e+08 8.629835e+08 7.945753e+08 1.014088e+09 5.827034e+08 9.347506e+08 8.495576e+08 7.934078e+08 1.340287e+09 6.826334e+08 1.084806e+09 1.081485e+09 1.051561e+09 9.244985e+08 1.482908e+09 3.573675e+08 6.551813e+08 8.821158e+08 1.514992e+08 1.434846e+09 7.011728e+08 8.579630e+08 8.054785e+08 9.234260e+08 8.279487e+08 8.999995e+08 7.201828e+08 6.497375e+08 4.473561e+08 5.345559e+08 3.049287e+08 7.457944e+08 7.984840e+08 9.711579e+08 4.910777e+08 7.109672e+08 7.085298e+08 1.057161e+09 1.928613e+07 7.471755e+08 8.925366e+08 6.713749e+08 7.461160e+08 1.120615e+09 1.075449e+09 9.351953e+08 7.332048e+08 4.097586e+08 1.823628e+09 9.751219e+08 5.553169e+08 6.255725e+08 9.356227e+08 8.279503e+08 1.040652e+09 1.452318e+09 1.246757e+09 7.758215e+08 1.323575e+09 8.561503e+08 1.027392e+09 7.131912e+08 8.770647e+08 1.155331e+09 9.616450e+08 1.390111e+08 9.563698e+08 1.033630e+09 9.467376e+08 5.411558e+08 6.016229e+08 6.579825e+08 6.152479e+08 1.897822e+08 6.639010e+08 5.881416e+08 7.062201e+08 8.579543e+08 6.070328e+08 6.583408e+08 6.773791e+08 8.045221e+08 7.752693e+08 1.296734e+09 1.594019e+08 8.228792e+08 1.129150e+09 2.178042e+09 1.110724e+09 1.099922e+09 1.946346e+09 1.291150e+09 1.421455e+09 1.347278e+09 1.060301e+09 2.019128e+09 3.121847e+08 2.788220e+09 1.596758e+09 1.193983e+09 1.486267e+09 2.307187e+09 1.179123e+09 2.103009e+09 2.666677e+09 1.617644e+09 1.890997e+09 2.034134e+09 2.422131e+09 7.399121e+08 1.190571e+09 1.316459e+09 1.006014e+09 1.793733e+09 1.075970e+09 1.590930e+09 1.146877e+09 8.191010e+08 1.235222e+09 1.083326e+09 1.902375e+09 1.507671e+09 1.398859e+09 2.294863e+09 3.876697e+08 1.787107e+08 1.295595e+09 1.438492e+09 1.151055e+09 1.278939e+09 1.439037e+09 1.412977e+09 1.717003e+09 1.597791e+09 3.900110e+08 1.586778e+09 1.262808e+09 1.540367e+09 1.603623e+09 1.588109e+09 1.211057e+09 1.942924e+09 1.328081e+09 1.671304e+09 1.626721e+09 1.357263e+09 7.883816e+08 9.040005e+08 9.198673e+08 1.384558e+09 1.267616e+09 7.665483e+08 6.831206e+08 1.279201e+09 9.906050e+08 1.065305e+09 1.272506e+09 9.070399e+08 1.023625e+09 7.068895e+08 8.195407e+08 1.162662e+09 4.192159e+08 4.645253e+08 5.453892e+08 9.478849e+08 2.560237e+08 1.275618e+09 1.325444e+09 C6 H6 O2_1.799 7.992986e+04 9.067536e+06 8.772971e+06 7.171308e+06 5.351950e+04 6.047345e+06 2.037163e+07 7.364282e+06 94321.51 6.880317e+06 7.831665e+06 7.917731e+06 72388.93 6.641808e+06 1.930300e+07 6.841665e+06 8.490155e+04 6.926060e+06 9.625568e+06 8.478974e+06 1.563723e+05 7.881685e+06 9.443892e+06 1.222882e+07 102972.182 8.276301e+06 9.315911e+06 9.107905e+06 1.282336e+05 9.315238e+06 8.241140e+06 1.161230e+07 158760.97 8.850204e+06 1.104056e+07 8.240824e+06 1.408015e+05 7.535418e+06 9.836170e+06 8.253717e+06 1.056551e+05 7.234523e+06 1.194096e+07 7.408620e+06 4.857379e+04 1.536943e+07 6.524210e+06 8.561642e+06 6.238340e+06 5.108805e+06 9.510423e+06 6.941858e+06 5.815671e+06 8.533719e+06 5.036216e+06 7.661234e+06 8.490131e+06 7.768344e+06 8.798677e+06 6.726967e+06 1.034353e+07 2.454745e+06 6.958077e+06 1.328167e+07 9.091534e+06 5.574758e+06 8.038635e+06 7.956663e+06 8.075947e+06 9.604499e+06 9.046382e+06 1.266184e+07 3.182416e+07 1.113037e+07 7.893624e+06 7.779533e+06 7.485004e+06 8.720258e+06 4.277652e+05 7.496510e+06 5.708657e+06 6.720226e+06 5.747774e+06 5.568077e+06 6.414476e+06 7.563924e+06 7.423704e+06 3.796842e+06 7.465564e+06 1.004281e+07 6.963708e+06 5.700944e+06 9.557780e+06 5.732815e+06 1.491797e+07 7.294593e+06 1.004315e+07 4.181249e+06 7.015232e+06 4.850607e+06 5.604363e+06 7.654450e+06 6.542881e+06 7.711882e+06 9.972957e+06 9.385712e+06 5.867425e+06 1.125149e+07 3.756606e+06 3.630872e+06 4.780741e+06 1.089099e+07 1.191654e+07 4.600090e+06 6.587027e+06 5.653472e+06 1.004281e+07 5.478931e+06 6.667242e+06 9.619002e+06 5.881652e+06 5.078556e+06 1.147375e+07 1.003250e+07 6.171482e+06 8.511406e+06 6.940386e+06 7.025145e+06 4.879119e+06 5.272385e+06 8.328232e+06 2.762105e+05 7.554948e+06 4.333324e+06 4.257795e+06 6.534671e+06 7.640117e+06 8.965985e+06 9.644787e+06 5.703916e+06 2.325307e+06 4.070977e+07 6.508762e+06 4.774385e+06 4.647727e+06 3.786405e+06 1.034592e+07 7.050476e+06 9.839812e+06 1.296413e+07 6.219636e+06 6.277951e+06 8.876762e+06 7.517752e+06 7.290178e+06 6.231369e+06 8.839340e+06 7.696814e+06 8.385459e+06 7.088609e+06 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1.280854e+06 9.288026e+05 9.260197e+05 4.221186e+05 4.445809e+05 6.342268e+05 1.136672e+06 1.016066e+06 1.033490e+06 9.314279e+05 1.119946e+06 7.105791e+05 7.345235e+05 4.721869e+05 6.198561e+05 6.197557e+05 7.530693e+05 4.252199e+05 6.319629e+05 5.039406e+05 6.122498e+05 8.228267e+05 1.157336e+06 1.040190e+06 1.328094e+06 1.547794e+06 1.222178e+06 1.098731e+06 1.584385e+06 1.248994e+06 1.208785e+06 1.855294e+06 1.258069e+06 3.278423e+05 1.114107e+06 6.989520e+05 1.624821e+06 2.910334e+05 2.305947e+05 3.354304e+05 5.240148e+05 1.079145e+06 9.817425e+05 1.371916e+06 C14 H24 O5_1.8 1.744777e+05 1.186027e+07 9.457187e+06 5.093099e+06 1.088965e+05 6.172233e+06 9.537116e+06 9.919801e+06 99931.42 8.910290e+06 8.738718e+06 9.604768e+06 94163.21 7.477769e+06 8.578078e+06 8.224773e+06 1.452861e+05 8.662547e+06 8.813921e+06 9.195058e+06 2.184362e+05 7.205171e+06 8.937590e+06 1.142602e+07 135553.172 7.160865e+06 8.107670e+06 8.542569e+06 1.329365e+05 8.645039e+06 8.128879e+06 1.100238e+07 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5.928252e+06 4.637304e+06 1.336795e+07 4.020512e+06 1.158699e+07 8.011054e+06 4.275484e+06 8.316203e+06 2.349776e+07 6.020012e+06 1.415918e+07 1.504807e+07 4.499924e+06 9.400295e+06 9.819960e+06 1.416255e+07 4.601636e+06 4.573940e+06 5.436823e+06 4.063119e+06 6.365634e+06 3.123949e+06 7.128995e+06 4.789642e+06 2.891016e+06 4.862758e+06 3.948643e+06 5.182096e+06 2.293651e+07 6.370741e+06 1.677378e+07 4.218219e+06 9.224829e+06 2.369358e+07 5.874245e+06 4.495799e+06 3.049364e+06 7.960052e+06 9.696906e+06 8.256500e+06 7.755674e+06 6.153406e+06 5.957266e+06 2.045672e+07 6.423004e+06 6.705186e+06 5.405364e+06 3.692112e+06 6.086863e+06 5.027854e+06 5.899363e+06 6.243778e+06 2.679409e+06 9.805902e+06 2.022042e+07 7.234229e+06 8.556061e+06 9.419916e+06 5.478410e+06 6.243504e+06 7.293313e+06 5.569290e+06 7.332508e+06 1.031521e+07 8.559607e+06 9.237340e+06 4.844178e+06 7.526936e+06 1.834906e+07 1.002661e+07 1.211475e+07 6.657853e+06 1.117948e+07 1.173146e+07 9.380676e+06 6.317340e+06 C37 H62 N4 O8_1.801 1.104984e+05 8.790019e+05 9.449932e+05 1.029430e+06 1.262670e+05 6.004432e+05 9.159747e+05 1.039552e+06 140397.00 8.123424e+05 8.337552e+05 9.557302e+05 135666.16 8.843868e+05 7.215644e+05 1.096406e+06 1.562202e+05 8.362686e+05 8.810823e+05 1.104802e+06 3.174337e+05 5.588315e+05 7.886448e+05 1.033823e+06 183276.091 9.375619e+05 7.986502e+05 7.727587e+05 1.656298e+05 1.041179e+06 9.067988e+05 9.517428e+05 232238.97 7.919802e+05 8.446491e+05 8.159321e+05 2.423505e+05 9.600939e+05 8.991818e+05 8.246975e+05 1.803821e+05 7.777389e+05 9.782300e+05 9.245604e+05 9.990120e+04 9.475598e+05 1.100072e+06 5.966389e+05 3.342509e+05 3.121563e+05 2.774290e+05 3.151347e+05 3.401242e+05 3.086507e+05 2.748511e+05 3.757418e+05 3.274031e+05 3.859760e+05 3.631451e+05 3.479663e+05 4.303993e+05 3.305360e+05 3.572297e+05 3.976107e+05 3.222290e+05 3.045721e+05 3.163876e+05 3.388953e+05 3.434694e+05 3.477931e+05 4.503213e+05 4.157925e+05 4.704969e+05 4.619247e+05 2.999594e+05 3.060495e+05 3.706163e+05 3.986774e+05 2.892073e+05 3.160985e+05 3.841862e+05 1.454592e+06 3.139193e+05 2.796672e+05 2.741831e+05 2.937887e+05 3.077153e+05 2.495594e+05 2.803717e+05 3.821913e+05 3.259465e+05 3.179234e+05 3.436859e+05 3.007315e+05 3.596889e+05 3.154068e+05 3.087776e+05 2.879955e+05 3.347646e+05 2.809058e+05 3.028633e+05 3.275821e+05 2.780400e+05 3.418531e+05 3.570592e+05 3.406657e+05 3.170785e+05 2.238822e+06 2.361260e+05 2.373702e+05 2.910183e+05 4.470278e+05 3.738728e+05 2.788288e+05 3.613287e+05 2.747439e+05 5.140895e+05 3.018366e+05 2.799410e+05 3.570486e+05 2.627065e+05 2.871259e+05 2.387356e+05 3.157047e+05 2.757020e+05 3.145661e+05 3.541095e+05 4.091536e+05 2.526710e+05 2.738621e+05 3.383478e+05 2.316838e+05 2.946802e+05 2.733060e+05 2.408265e+05 3.122335e+05 3.828115e+05 3.033919e+05 3.930526e+05 3.332000e+05 2.582786e+05 4.598570e+05 3.701513e+05 2.608554e+05 2.694845e+05 2.784527e+05 2.894470e+05 2.881531e+05 3.811310e+05 4.504345e+05 3.384263e+05 3.611262e+05 3.369475e+05 3.834445e+05 2.924808e+05 2.878346e+05 3.446943e+05 3.865082e+05 4.268995e+05 3.285251e+05 3.192226e+05 3.434412e+05 3.184175e+05 2.856924e+05 3.126416e+05 2.762917e+05 2.856711e+05 3.198558e+05 2.903455e+05 2.947557e+05 3.467869e+05 4.456641e+05 2.677641e+05 3.037681e+05 3.215775e+05 3.208656e+05 3.214241e+05 3.259196e+05 3.222730e+05 3.739444e+05 4.840236e+05 4.701621e+05 3.924715e+05 5.310850e+05 3.931257e+05 3.955138e+05 3.585061e+05 4.083737e+06 5.249440e+05 4.000270e+05 5.058069e+05 1.608039e+06 3.630386e+05 3.905691e+05 5.982328e+05 3.833928e+05 7.080049e+05 5.007760e+05 3.507522e+05 4.800658e+05 5.603712e+05 6.326274e+05 3.388034e+05 4.054426e+05 3.999821e+05 3.440755e+05 4.219650e+05 1.267551e+08 5.391063e+05 4.267649e+05 2.559425e+06 4.190843e+05 3.140750e+05 4.251957e+05 4.881762e+05 5.014734e+05 5.619061e+05 4.346118e+05 5.063720e+05 4.368022e+05 6.418531e+05 4.276736e+05 8.723407e+05 1.503120e+06 8.222443e+05 5.806745e+05 1.157699e+06 2.296104e+06 1.615344e+06 4.688985e+05 8.998358e+06 4.316180e+05 4.745867e+05 3.960330e+05 4.439262e+05 4.280420e+05 1.647079e+06 1.366802e+06 4.160488e+05 2.885574e+05 3.604872e+05 3.754476e+05 1.448714e+06 4.170181e+05 3.165586e+05 3.732994e+05 3.708635e+05 3.101337e+05 3.878598e+05 5.742661e+05 3.696925e+05 2.973520e+05 5.751643e+05 2.906368e+05 5.472392e+05 2.346974e+05 2.419407e+05 2.806100e+05 4.056618e+05 4.099115e+05 3.270742e+05 4.905669e+05 C9 H10 O2_1.801 4.596499e+04 9.152164e+05 8.241915e+05 6.936547e+05 5.120087e+04 1.026617e+06 9.501608e+05 1.007139e+06 70465.12 8.349856e+05 7.557736e+05 9.081590e+05 56431.05 9.866808e+05 9.319916e+05 8.005318e+05 8.744192e+04 7.714984e+05 8.096779e+05 1.116171e+06 1.885822e+05 7.833311e+05 8.232334e+05 1.016861e+06 104066.084 9.129842e+05 8.322831e+05 9.475103e+05 7.888267e+04 8.409103e+05 6.488331e+05 9.532420e+05 118493.25 9.862551e+05 1.000341e+06 8.883264e+05 1.356882e+05 7.709413e+05 9.336756e+05 7.300362e+05 9.742091e+04 7.398788e+05 8.820971e+05 1.057878e+06 4.427827e+04 1.039834e+06 8.165417e+05 8.140001e+05 4.001102e+05 4.974126e+05 5.187406e+05 8.712407e+05 4.804621e+05 7.891589e+05 6.177302e+05 1.107807e+06 6.533448e+05 9.034590e+05 6.844575e+05 5.187641e+05 9.805218e+05 3.335934e+05 8.562000e+05 9.143905e+05 7.599290e+05 2.566967e+05 6.045925e+05 6.641693e+05 6.487580e+05 5.815866e+05 8.857926e+05 6.216505e+05 6.655303e+05 9.317570e+05 5.104873e+05 4.199544e+05 4.781443e+05 4.230702e+05 2.945043e+07 6.052817e+05 4.035672e+05 4.292218e+05 3.392164e+05 3.683010e+05 1.783921e+05 4.138195e+05 1.305384e+05 2.513903e+05 4.989250e+05 4.286241e+05 9.595359e+05 4.601403e+05 6.416130e+05 4.425847e+05 7.285243e+05 6.570193e+05 6.939844e+05 4.028316e+05 1.015508e+06 5.473529e+05 3.489086e+05 6.029622e+05 3.226839e+05 5.068211e+05 5.792068e+05 6.576856e+05 5.929237e+05 9.193250e+05 3.457697e+05 4.614033e+05 3.103222e+05 8.887195e+05 6.935444e+05 2.965413e+05 4.795411e+05 2.570107e+05 4.587829e+05 5.126354e+05 2.159636e+05 7.797057e+05 2.808015e+05 1.442144e+05 2.453101e+05 4.968758e+05 3.185510e+05 3.809537e+05 6.140943e+05 2.672731e+05 3.100396e+05 3.881193e+05 4.871480e+05 3.804834e+06 5.884004e+05 6.319936e+05 5.177749e+05 6.305458e+05 6.149868e+05 8.481086e+05 5.651844e+05 6.546783e+05 9.912173e+05 1.094091e+06 8.692488e+05 1.200168e+06 1.554370e+06 1.712919e+06 2.119615e+06 3.379575e+06 7.485095e+06 1.941661e+06 9.893058e+05 9.407523e+05 5.122145e+05 4.445142e+05 4.105070e+05 3.980164e+05 5.995776e+05 8.918867e+05 7.582410e+05 5.291703e+05 4.280772e+05 5.208906e+05 4.944982e+05 5.126451e+05 1.051640e+06 6.856329e+05 4.597839e+05 6.980095e+05 6.134124e+05 6.767518e+05 6.607993e+05 2.556577e+05 8.293365e+05 6.254179e+05 8.008954e+05 1.161897e+06 8.401603e+05 1.015952e+06 9.136521e+05 9.365606e+05 6.460733e+06 4.458334e+05 5.030063e+05 3.338886e+06 1.842472e+06 4.592160e+05 3.906592e+05 3.344308e+05 5.998300e+06 4.038951e+05 7.575256e+06 5.004599e+05 3.948474e+05 5.596408e+05 5.045061e+06 4.340694e+05 8.367925e+06 9.133080e+06 3.247985e+05 6.455373e+06 5.602064e+06 4.963706e+06 3.840760e+05 3.104657e+05 4.282816e+05 4.347931e+05 4.464861e+05 2.623354e+05 4.580421e+05 1.723808e+05 6.418185e+05 3.507016e+05 2.885409e+05 6.879625e+05 1.124794e+06 5.437140e+05 6.672430e+06 5.919566e+05 6.062974e+05 1.837460e+06 4.318701e+05 6.206594e+05 2.150603e+05 4.423469e+05 5.361166e+05 5.474291e+05 9.092153e+05 4.949645e+05 4.779397e+05 8.339438e+05 5.768890e+05 5.867375e+05 6.405621e+05 3.431659e+05 5.196003e+05 6.950109e+05 5.082338e+05 5.304637e+05 3.801325e+05 7.219955e+05 4.596162e+06 5.193863e+05 6.543925e+05 7.156967e+05 7.052651e+05 4.716044e+05 8.025734e+05 4.746071e+05 6.919012e+05 1.066665e+06 7.647578e+05 5.928134e+05 5.688056e+05 4.605480e+05 9.549284e+05 6.598706e+05 4.601207e+05 6.759560e+05 7.540991e+05 8.724272e+05 7.745813e+05 7.745538e+05 Homovanillyl alcohol_1.801 1.185731e+05 3.665692e+06 3.776753e+06 3.637682e+06 2.096119e+05 2.809669e+06 3.974957e+06 3.816741e+06 144304.68 3.286826e+06 3.501625e+06 3.940559e+06 124983.73 3.729438e+06 3.513794e+06 3.189876e+06 1.910046e+05 3.057704e+06 3.220910e+06 2.464264e+06 3.272945e+05 6.545381e+06 3.256509e+06 3.999608e+06 260052.396 2.488506e+06 3.399455e+06 3.590504e+06 2.167282e+05 3.276172e+06 3.063964e+06 3.181850e+06 234025.47 2.665999e+06 7.477758e+06 2.600923e+06 2.892255e+05 2.987385e+06 3.575538e+06 3.099556e+06 2.453099e+05 3.519409e+06 3.769464e+06 3.654336e+06 2.235424e+05 2.546397e+06 2.798571e+06 4.647992e+06 1.500271e+06 1.828845e+06 1.155710e+06 2.486851e+06 1.068174e+06 1.822526e+06 6.211307e+06 2.689684e+06 2.253302e+06 2.595690e+06 1.826166e+06 2.161783e+06 2.039765e+06 2.154357e+06 2.902195e+06 9.371570e+06 2.632886e+06 1.652254e+06 3.547113e+06 1.454422e+06 2.548263e+06 8.517349e+06 3.584289e+06 2.471990e+06 1.024538e+06 2.318327e+06 2.476194e+06 1.781226e+06 2.037666e+06 1.522642e+06 6.753623e+07 2.206417e+06 2.350539e+06 2.179581e+06 1.904667e+06 1.236666e+06 1.329127e+06 2.908530e+06 1.513412e+06 1.314165e+06 1.768033e+06 6.952599e+06 2.250689e+06 2.466110e+06 2.720402e+06 2.187528e+06 3.119563e+06 2.071146e+06 3.148859e+06 1.861114e+06 3.376869e+06 2.879837e+06 2.033629e+06 2.245961e+06 1.462214e+06 7.071217e+06 2.936173e+06 1.984485e+06 1.757641e+06 4.078436e+06 1.011791e+06 6.156784e+05 1.307523e+06 3.821697e+06 3.608524e+06 1.637313e+06 2.462632e+06 1.426444e+06 2.207104e+06 2.199213e+06 4.883299e+06 1.509739e+06 1.765815e+06 1.103421e+06 1.158646e+06 2.668182e+06 1.085337e+06 2.037348e+06 3.147913e+06 2.784599e+06 2.156467e+06 1.834846e+06 2.611627e+06 8.258038e+06 2.335253e+06 1.203133e+06 1.415754e+06 3.078546e+06 2.137151e+06 3.478519e+06 2.046307e+06 2.141235e+06 2.638569e+06 5.759568e+06 3.092844e+06 3.052471e+06 4.765842e+06 5.122593e+06 6.965759e+06 5.383809e+06 2.047973e+07 1.500470e+07 5.257399e+06 3.364022e+06 8.237788e+06 1.608964e+06 1.498883e+06 1.957896e+06 1.826498e+06 2.611004e+06 3.954758e+06 2.546432e+06 7.764317e+05 2.147378e+06 1.256416e+06 1.732828e+06 1.923890e+06 2.393890e+06 1.629100e+06 2.652779e+06 7.740652e+06 1.901311e+06 2.359131e+06 1.839062e+06 1.749499e+06 2.225515e+06 1.975475e+06 3.688586e+06 3.179606e+06 3.930889e+06 2.450016e+06 8.403758e+06 1.209722e+07 2.043744e+06 2.959840e+06 2.774816e+07 9.957280e+06 7.041601e+06 2.246019e+06 1.305357e+06 8.364231e+06 2.110148e+06 1.309299e+07 4.715951e+06 1.764613e+06 4.058831e+06 2.967901e+07 7.842771e+06 3.168724e+07 3.304588e+07 2.957782e+06 1.963428e+07 2.289616e+07 2.201475e+07 2.020467e+06 1.992692e+06 2.584928e+06 3.044495e+06 2.883320e+06 1.362088e+06 2.709420e+06 7.315350e+05 2.167463e+06 2.582642e+06 2.957994e+06 2.495911e+06 7.098639e+06 7.789889e+06 2.790786e+07 2.762422e+06 3.704187e+06 1.397914e+07 3.589238e+06 3.070523e+06 2.435616e+06 3.088282e+06 2.447961e+06 4.102069e+06 1.338630e+07 2.676063e+06 3.049873e+06 4.364732e+06 2.895091e+06 3.423761e+06 3.728753e+06 2.174096e+06 3.760643e+06 3.291006e+06 4.105017e+06 3.017306e+06 5.081676e+06 1.896188e+06 8.085918e+06 1.897926e+06 3.773456e+06 3.456080e+06 2.531479e+06 1.530481e+06 8.977655e+06 1.923055e+06 8.187452e+06 3.747398e+06 2.334938e+06 2.252387e+06 2.554421e+06 1.576959e+06 4.050163e+06 1.555162e+06 1.400177e+06 1.657193e+06 2.046115e+06 4.895376e+06 2.445565e+06 3.080879e+06 C11 H20 N2 O2_1.802 6.440478e+05 9.728355e+05 7.709658e+05 6.627292e+05 8.798220e+04 6.749359e+05 8.195721e+05 9.722956e+05 86180.17 8.026193e+05 6.648385e+05 8.880833e+05 90136.06 8.780290e+05 6.987656e+05 7.623511e+05 2.003110e+05 8.507800e+05 7.458911e+05 8.737978e+05 2.551324e+05 7.745486e+05 6.999209e+05 9.682762e+05 143687.933 7.960674e+05 8.258711e+05 7.886274e+05 1.449780e+05 5.575816e+05 7.809339e+05 1.057345e+06 199812.50 7.698580e+05 7.929046e+05 8.194929e+05 1.668413e+05 7.242044e+05 8.108613e+05 9.327910e+05 1.497352e+05 6.458369e+05 6.997139e+05 1.048970e+06 7.390774e+04 6.574306e+05 8.335461e+05 7.812454e+05 4.814154e+05 6.430350e+05 7.851696e+05 7.564044e+05 6.649908e+05 6.733577e+05 8.183559e+05 8.956509e+05 1.671134e+06 1.243969e+06 9.970434e+05 1.160427e+06 1.165201e+06 9.649294e+05 1.079970e+06 8.050892e+05 7.904606e+05 4.859549e+05 1.182703e+06 6.935700e+05 8.749381e+05 1.158622e+06 1.124911e+06 1.375892e+06 1.031013e+06 1.273793e+06 9.093212e+05 1.063558e+06 8.032005e+05 1.014872e+06 4.200861e+05 9.994255e+05 7.184569e+05 8.655309e+05 6.702925e+05 8.656401e+05 5.656905e+05 7.395877e+05 5.011842e+05 4.801723e+05 1.146424e+06 9.245762e+05 8.977060e+05 6.288473e+05 8.919984e+05 5.253569e+05 9.453402e+05 5.347040e+05 8.841217e+05 6.578441e+05 6.696461e+05 6.461302e+05 8.870946e+05 9.012962e+05 7.626972e+05 4.888077e+05 6.814738e+05 5.495794e+05 5.665095e+05 1.005760e+06 8.020669e+05 5.718906e+05 7.608965e+05 1.020706e+06 1.113217e+06 7.046664e+05 1.215363e+06 6.415571e+05 1.733265e+06 8.882961e+05 1.078059e+06 1.890914e+06 6.653787e+05 5.383649e+05 4.336242e+05 1.232472e+06 6.761585e+05 1.051509e+06 1.483349e+06 7.870786e+05 9.222515e+05 9.224477e+05 1.646120e+06 2.494989e+05 1.119501e+06 1.300949e+06 1.285396e+06 1.393249e+06 1.504510e+06 2.011772e+06 1.607411e+06 1.789205e+06 9.122970e+05 6.685955e+06 3.790694e+06 5.855084e+05 8.137162e+05 1.099301e+06 1.169239e+06 9.015255e+05 1.453063e+06 3.056529e+06 1.303488e+06 1.040423e+06 9.125018e+05 8.102663e+05 4.946145e+05 6.568977e+05 6.504527e+05 9.384539e+05 1.588982e+06 6.482205e+05 7.422887e+05 6.759730e+05 9.100202e+05 4.867956e+05 5.884928e+05 9.578193e+05 4.463305e+05 7.681736e+05 6.140136e+05 3.848382e+05 5.863223e+05 7.116171e+05 7.104241e+05 4.987545e+05 5.395019e+05 6.521710e+05 1.001370e+06 9.162305e+05 1.148478e+06 1.467201e+06 4.202459e+05 2.783890e+05 9.096906e+05 8.724799e+05 6.428377e+05 1.330238e+06 1.693470e+06 4.321995e+05 6.324749e+05 2.430477e+05 5.962684e+05 7.288848e+05 2.436512e+05 7.047840e+05 8.518917e+05 3.767159e+05 7.024841e+05 7.633119e+05 5.319897e+05 4.929040e+05 1.653327e+06 7.797385e+05 3.507977e+05 5.721220e+05 7.434158e+05 3.476196e+05 8.352833e+05 4.364907e+05 1.156069e+06 4.542391e+05 5.607599e+05 6.147234e+05 5.149328e+05 4.723154e+05 1.074175e+06 8.126886e+05 4.287265e+05 7.005476e+05 6.973460e+05 4.633506e+05 4.742220e+05 4.649424e+05 5.797974e+05 5.331463e+05 6.697061e+05 7.496046e+05 1.193167e+06 6.728684e+05 9.398755e+05 4.761188e+05 7.110570e+05 4.391659e+05 7.141240e+05 7.764821e+05 8.383397e+05 4.456094e+05 1.100611e+06 4.434868e+05 1.405117e+06 6.169965e+05 1.331923e+06 8.748625e+05 1.542030e+06 1.314374e+06 8.734118e+05 9.242124e+05 1.652101e+06 9.174966e+05 1.289614e+06 1.938216e+06 1.378698e+06 5.896815e+05 9.295364e+05 7.375054e+05 3.009881e+06 7.107675e+05 4.815609e+05 6.447151e+05 7.067978e+05 9.270762e+05 1.221417e+06 1.482659e+06 C14 H22 O4_1.803 1.041425e+05 1.331070e+06 1.325755e+06 1.202240e+06 4.947107e+04 8.814021e+05 1.309795e+06 1.478534e+06 53258.12 1.230325e+06 1.098202e+06 1.323132e+06 51836.17 1.238371e+06 1.275945e+06 1.111243e+06 5.590390e+04 1.006891e+06 1.260420e+06 1.004036e+06 8.779008e+04 8.371065e+05 2.452980e+06 1.349770e+06 54458.480 6.855010e+05 1.169619e+06 1.108541e+06 6.471452e+04 1.066519e+06 1.088948e+06 1.600736e+06 95598.75 1.104596e+06 1.373251e+06 1.095577e+06 1.062995e+05 1.235118e+06 1.456926e+06 1.157306e+06 8.859342e+04 9.628350e+05 1.240373e+06 1.342455e+06 4.646149e+04 1.103769e+06 1.570419e+06 1.019240e+06 1.038983e+06 9.312329e+05 7.375579e+05 1.172466e+06 7.494740e+05 1.380048e+06 1.075686e+06 8.324978e+05 7.244843e+05 9.275703e+05 1.326189e+06 1.325277e+06 1.421238e+06 1.272689e+06 1.028750e+06 1.117526e+06 1.057588e+06 6.998083e+05 8.424540e+05 1.142505e+06 1.061636e+06 8.218349e+05 1.367223e+06 9.160159e+05 1.493143e+06 1.236429e+06 7.281637e+05 7.246635e+05 7.973744e+05 5.937647e+05 1.273740e+07 9.269646e+05 1.118351e+06 7.769046e+05 6.039700e+05 8.322203e+05 4.757080e+05 7.522692e+05 6.304733e+05 5.242214e+05 5.221277e+05 5.468485e+05 1.306273e+06 8.164236e+05 3.962119e+06 1.046042e+06 1.428958e+06 1.077541e+06 1.395378e+06 5.812046e+05 1.184653e+06 1.213037e+06 7.932965e+05 1.223168e+06 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1.137029e+06 3.903001e+06 1.120680e+06 9.020332e+05 2.067336e+06 2.094784e+06 9.747657e+05 1.093211e+06 1.065140e+06 2.389485e+06 9.542507e+05 2.243197e+06 1.545725e+06 7.028077e+05 1.502361e+06 5.101745e+06 1.101536e+06 3.605434e+06 2.737421e+06 8.707724e+05 1.697290e+06 2.447964e+06 2.119186e+06 9.651935e+05 9.489329e+05 1.111499e+06 7.676644e+05 1.146710e+06 6.120559e+05 9.299558e+05 7.992609e+05 8.408929e+05 6.860421e+05 6.745043e+05 1.099121e+06 6.228883e+06 8.941945e+05 2.618660e+06 1.096243e+06 1.818128e+06 1.741954e+06 1.205558e+06 8.772907e+05 6.654418e+05 1.652388e+06 1.112725e+06 2.106621e+06 1.455746e+06 1.913581e+06 1.021902e+06 2.387837e+06 9.398222e+05 1.653555e+06 9.227276e+05 6.728900e+05 1.077945e+06 8.538832e+05 1.010251e+06 9.922152e+05 7.248572e+05 1.156429e+06 4.344131e+06 9.640570e+05 9.390469e+05 1.178441e+06 7.177240e+05 8.202324e+05 9.985208e+05 7.693335e+05 8.041025e+05 1.196331e+06 1.222338e+06 1.293220e+06 7.961780e+05 1.039374e+06 2.584061e+06 1.094041e+06 1.284930e+06 9.635416e+05 1.655128e+06 1.754267e+06 1.303186e+06 9.019085e+05 C14 H26 O6_1.803 1.735554e+05 1.363977e+07 1.108361e+07 7.472482e+06 1.505452e+05 7.264043e+06 1.143653e+07 1.156027e+07 142922.99 1.081234e+07 1.077616e+07 1.157354e+07 136148.37 8.924273e+06 1.015983e+07 1.007773e+07 1.796098e+05 1.043263e+07 1.044702e+07 1.114770e+07 3.173328e+05 8.726056e+06 1.087482e+07 1.369899e+07 199003.448 8.637548e+06 9.635255e+06 1.003653e+07 1.977386e+05 1.067634e+07 9.882094e+06 1.348671e+07 289339.31 8.012414e+06 1.074445e+07 9.765639e+06 3.130593e+05 9.939200e+06 1.189125e+07 1.062982e+07 2.380406e+05 8.354708e+06 9.561032e+06 1.329260e+07 1.264041e+05 1.028434e+07 1.148191e+07 8.602644e+06 5.699372e+06 6.860336e+06 5.480448e+06 8.844754e+06 5.104387e+06 1.507360e+07 7.546731e+06 3.869027e+06 8.360145e+06 8.134254e+06 1.033970e+07 7.912473e+06 1.260763e+07 7.603782e+06 1.014652e+07 7.824448e+06 8.939327e+06 3.747563e+06 5.817160e+06 9.375453e+06 9.207737e+06 7.748168e+06 1.123826e+07 8.868727e+06 1.057656e+07 1.243788e+07 4.315680e+06 6.010101e+06 4.947379e+06 5.275460e+06 1.614277e+08 5.947960e+06 5.386217e+06 4.615614e+06 3.850312e+06 4.607616e+06 3.143851e+06 3.572654e+06 3.001439e+06 2.385539e+06 3.254997e+06 4.254804e+06 7.727678e+06 4.287339e+06 1.337320e+07 7.241621e+06 8.945711e+06 8.369315e+06 9.414959e+06 3.099989e+06 9.199988e+06 8.381397e+06 4.406116e+06 8.751765e+06 2.869071e+06 6.447996e+06 7.915273e+06 8.441721e+06 6.158706e+06 9.718439e+06 5.182047e+06 2.503044e+06 3.655469e+06 1.122137e+07 9.928812e+06 3.814053e+06 4.681764e+06 3.448837e+06 4.554976e+06 4.415672e+06 3.107240e+06 1.072806e+07 2.512898e+06 2.072246e+06 2.039555e+06 2.815353e+06 2.980039e+06 3.150170e+06 6.286458e+06 2.205937e+06 3.766213e+06 3.484222e+06 9.403730e+06 1.832859e+07 8.151293e+06 7.966290e+06 6.991248e+06 6.029352e+06 1.181317e+07 1.255137e+07 9.389603e+06 1.072418e+07 1.779808e+07 1.396443e+07 1.069882e+07 2.163163e+07 3.010955e+07 3.077751e+07 3.155022e+07 3.497813e+07 5.381574e+07 4.702710e+07 3.154268e+07 1.620780e+07 9.982364e+06 7.931984e+06 6.181278e+06 8.670220e+06 1.285456e+07 1.336023e+07 1.466959e+07 6.919583e+06 6.433193e+06 7.576345e+06 6.514839e+06 1.263271e+07 2.080510e+07 1.298057e+07 4.409900e+06 1.429508e+07 1.039636e+07 1.032070e+07 1.452382e+07 4.976317e+06 1.487693e+07 1.448194e+07 1.778655e+07 1.598512e+07 1.000967e+07 1.031407e+07 1.140150e+07 9.813179e+06 2.282586e+07 7.750834e+06 5.721856e+06 1.316085e+07 2.248091e+07 7.433598e+06 6.786543e+06 5.213290e+06 1.521500e+07 4.799875e+06 1.341955e+07 9.567603e+06 5.104278e+06 9.876107e+06 2.748398e+07 7.132314e+06 1.547886e+07 1.632879e+07 5.373092e+06 1.106782e+07 1.058061e+07 1.545167e+07 5.362486e+06 5.348845e+06 5.966636e+06 4.639912e+06 6.863834e+06 3.456035e+06 8.704974e+06 5.793580e+06 3.537673e+06 6.076855e+06 4.433508e+06 5.882452e+06 2.903438e+07 7.501291e+06 1.806377e+07 5.002218e+06 1.076134e+07 2.905381e+07 7.241059e+06 5.331529e+06 3.634680e+06 8.770702e+06 1.174415e+07 8.443402e+06 9.173866e+06 6.541092e+06 6.757675e+06 2.450324e+07 7.441262e+06 7.698874e+06 6.649344e+06 4.201614e+06 6.889347e+06 6.155440e+06 6.806803e+06 7.649827e+06 3.182921e+06 1.192154e+07 2.427959e+07 8.820429e+06 9.910380e+06 1.119681e+07 6.744040e+06 7.795763e+06 8.784333e+06 7.093586e+06 9.426785e+06 1.235248e+07 1.010386e+07 1.151082e+07 5.821461e+06 9.340049e+06 2.176011e+07 1.232504e+07 1.510503e+07 8.101085e+06 1.307880e+07 2.533265e+07 1.140406e+07 7.172597e+06 C7 H5 N O_1.803 3.641611e+05 3.523314e+05 4.356234e+05 3.742229e+05 4.891963e+04 2.905767e+05 3.769855e+05 4.268404e+05 48826.36 4.307300e+05 3.716692e+05 4.128187e+05 48785.29 2.847265e+05 4.243603e+05 3.812731e+05 7.827013e+04 3.701785e+05 3.524023e+05 3.478872e+05 1.195706e+05 3.334809e+05 4.063477e+05 5.128129e+05 72066.770 3.434883e+05 3.883458e+05 3.285932e+05 7.442668e+04 2.859862e+05 3.607949e+05 6.935171e+05 109332.99 2.154315e+05 3.973201e+05 2.209487e+05 1.283614e+05 3.711725e+05 4.918807e+05 1.959522e+05 8.987571e+04 1.543512e+05 4.639610e+05 4.879471e+05 4.700702e+04 1.528680e+05 4.240867e+05 2.437941e+05 3.207212e+05 4.615758e+05 3.007453e+05 3.518456e+05 4.912319e+05 1.625129e+05 3.933873e+05 2.742768e+05 3.849113e+05 3.273563e+05 4.487757e+05 1.273641e+05 3.333626e+05 6.389577e+05 4.232358e+05 6.756423e+05 1.660552e+05 4.315393e+05 5.213906e+05 1.674712e+05 2.678879e+05 1.704504e+05 1.614179e+05 4.705379e+05 4.198293e+05 1.709785e+05 2.702606e+05 1.330181e+05 3.173915e+05 2.632326e+05 4.686044e+05 6.926750e+05 3.259907e+05 2.835607e+05 4.019924e+05 4.619993e+05 2.563654e+05 3.008901e+05 3.873090e+05 2.491509e+05 2.508152e+05 5.965237e+05 5.561886e+05 1.557870e+05 1.607390e+05 7.454156e+05 1.688755e+05 3.288414e+05 1.570993e+05 2.177538e+05 2.216454e+05 2.496668e+05 3.268384e+05 3.537128e+05 2.191790e+05 1.698544e+05 3.785494e+05 1.569181e+05 2.597474e+05 3.260807e+05 2.756920e+05 3.299764e+05 1.341220e+05 2.320545e+05 4.212455e+05 9.854803e+05 4.324889e+05 1.635843e+05 6.244102e+05 4.099656e+05 2.821829e+05 6.624277e+05 1.907448e+05 1.369631e+05 1.633932e+05 1.440204e+05 5.757451e+05 2.248376e+05 1.853849e+05 2.039424e+05 1.903328e+05 2.611587e+05 3.133516e+05 5.226080e+05 4.889349e+05 2.636445e+05 3.308459e+05 4.307586e+05 3.004447e+05 1.929618e+05 1.837780e+05 2.407448e+05 1.235998e+05 1.894804e+05 3.337394e+05 4.061520e+05 2.265915e+05 1.660340e+05 1.394989e+05 1.567989e+05 1.335155e+05 4.003692e+05 2.989199e+05 3.662914e+05 4.350696e+05 2.110516e+05 5.237505e+05 4.732059e+05 1.804906e+05 3.653997e+05 1.589970e+05 1.457915e+05 4.092485e+05 4.246817e+05 2.577986e+05 2.911956e+05 1.632229e+05 2.508222e+05 1.511070e+06 4.289022e+05 1.428033e+05 1.244111e+06 5.964048e+05 2.488440e+05 3.527399e+05 1.199432e+05 3.903363e+05 2.527601e+05 5.890883e+05 2.576147e+05 2.424407e+05 2.034094e+05 3.284876e+05 1.798734e+05 1.817297e+05 2.324479e+05 3.915502e+05 3.255502e+05 3.248871e+05 1.973931e+05 5.531120e+05 2.660435e+05 2.785663e+05 7.372552e+05 2.100128e+05 3.844114e+05 3.073769e+05 1.332999e+05 3.611866e+05 2.209209e+05 4.876385e+05 4.047023e+05 1.985142e+05 4.359978e+05 1.794882e+05 2.112016e+05 1.567537e+05 1.393665e+05 3.138168e+05 1.364730e+05 3.419680e+05 1.706624e+05 1.760092e+05 6.773787e+05 1.862178e+05 1.954968e+05 4.830420e+05 2.414653e+05 4.245555e+05 4.078042e+05 1.955450e+05 2.140982e+05 1.488951e+05 2.445361e+05 3.598706e+05 2.752154e+05 4.708083e+05 1.780971e+05 2.167862e+05 3.689612e+05 1.700024e+05 2.971682e+05 1.715145e+05 3.192577e+05 5.486878e+05 3.710868e+05 4.746995e+05 3.128051e+05 1.947601e+05 2.211493e+05 1.395597e+06 5.536540e+05 4.503586e+05 7.068317e+06 1.613580e+05 1.832255e+06 1.156184e+05 1.621138e+05 3.110699e+05 1.692648e+06 3.126461e+05 3.682258e+05 4.098713e+06 4.951493e+05 4.336755e+05 6.733933e+05 1.997583e+05 3.033314e+05 2.394050e+05 2.687828e+05 3.862291e+05 2.140838e+05 2.007396e+05 3.334558e+05 3-(4-Hydroxy-3-methoxyphenyl)-2-methylpropanoic acid_1.803 1.482643e+05 2.502181e+06 2.833474e+06 2.400749e+06 1.100359e+05 1.526980e+06 2.488876e+06 2.578277e+06 127493.93 2.159457e+06 2.284075e+06 2.197283e+06 115230.26 2.371646e+06 2.349202e+06 2.019199e+06 1.479596e+05 2.764390e+06 2.750401e+06 1.963995e+06 2.225119e+05 2.320314e+06 1.875217e+06 3.581622e+06 134618.476 1.493854e+06 2.859886e+06 2.261637e+06 1.355743e+05 1.690835e+06 3.083528e+06 2.640612e+06 221026.00 1.542754e+06 2.714208e+06 2.571270e+06 2.569971e+05 1.825824e+06 2.196063e+06 1.630072e+06 1.672858e+05 2.122001e+06 2.983416e+06 3.173067e+06 7.876171e+04 2.273795e+06 2.407599e+06 1.749501e+06 1.390585e+06 2.101747e+06 1.338181e+06 3.606016e+06 2.000601e+06 2.176678e+06 1.878443e+06 1.846609e+06 2.021031e+06 1.954209e+06 2.904881e+06 3.658765e+06 3.340128e+06 3.066542e+06 3.746869e+06 3.344958e+06 3.053807e+06 1.337287e+06 4.189357e+06 2.521911e+06 2.342338e+06 2.845732e+06 4.664090e+06 4.583689e+06 4.774807e+06 5.861804e+06 1.871745e+06 3.901915e+06 2.731384e+06 2.111995e+06 3.012309e+05 3.838953e+06 3.313753e+06 2.042232e+06 2.314370e+06 2.335549e+06 1.622594e+06 2.638351e+06 1.316083e+06 1.214952e+06 3.593288e+06 2.892477e+06 5.702298e+06 3.852231e+06 2.799443e+06 4.763022e+06 5.012072e+06 2.555728e+06 3.408178e+06 1.409435e+06 3.773418e+06 2.198580e+06 3.416973e+06 4.518357e+06 1.497008e+06 5.827975e+06 5.414317e+06 4.166001e+06 2.897668e+06 5.934318e+06 1.028780e+06 2.686651e+06 2.263766e+06 5.280627e+06 5.057668e+06 2.299301e+06 3.739435e+06 2.062170e+06 3.203986e+06 2.079584e+06 1.729153e+06 5.915147e+06 1.773726e+06 1.692184e+06 1.627332e+06 2.505405e+06 2.038278e+06 2.250888e+06 4.796002e+06 1.979026e+06 2.504005e+06 3.605126e+06 2.964766e+06 3.147564e+05 1.747258e+06 1.981730e+06 2.917791e+06 1.915419e+06 3.278458e+06 2.980955e+06 1.519671e+06 3.417737e+06 1.066087e+06 5.289348e+06 4.005616e+06 1.064980e+06 1.884444e+06 1.892097e+06 1.684947e+06 3.552270e+06 5.223429e+06 5.666087e+06 2.613755e+06 2.044823e+06 2.011461e+06 1.968630e+06 2.006436e+06 1.773695e+06 3.600265e+06 3.705925e+06 2.379339e+06 1.907618e+06 1.864377e+06 4.544111e+06 1.120058e+06 1.104144e+06 2.005742e+06 1.067056e+06 1.649294e+06 1.218677e+06 1.439278e+06 1.695301e+06 1.802753e+06 1.364770e+06 1.730443e+06 1.147003e+06 1.637245e+06 2.747561e+06 2.790193e+06 3.231750e+06 2.852675e+06 4.885531e+06 1.390013e+07 9.531743e+05 8.953257e+05 1.762298e+07 7.058925e+05 9.570054e+05 1.103480e+06 1.338123e+06 1.256323e+07 1.347115e+06 1.397532e+07 3.367303e+06 9.285444e+05 1.556494e+06 7.185851e+06 1.395427e+06 1.259638e+07 1.366747e+07 1.126270e+06 1.348031e+07 1.711945e+07 1.536678e+07 1.104453e+06 9.231185e+05 1.247227e+06 7.079029e+05 1.456174e+06 1.075657e+06 1.025225e+06 7.810970e+05 1.581776e+06 9.828876e+05 6.744826e+05 1.097884e+06 1.255844e+06 1.010424e+06 6.213451e+06 9.189572e+05 1.474342e+06 7.732279e+05 1.509152e+06 1.414866e+06 8.782239e+05 1.441315e+06 1.174827e+06 1.111089e+06 1.603821e+06 1.666194e+06 1.404530e+06 1.229254e+06 1.370726e+06 1.518513e+06 2.086614e+06 1.184597e+06 1.525375e+06 1.451566e+06 1.501428e+06 1.695078e+06 1.764066e+06 1.625265e+06 1.258080e+06 2.770266e+06 2.097099e+06 2.302260e+06 1.583764e+06 1.609450e+06 1.642736e+06 1.876283e+06 2.032510e+06 3.546809e+06 3.376340e+06 1.346687e+06 1.828391e+06 1.585116e+06 5.380283e+06 8.970868e+05 9.509602e+05 1.749687e+06 9.719824e+05 2.174711e+06 2.251404e+06 1.958885e+06 C8 H10 O3_1.803 2.066072e+05 1.168877e+09 1.084190e+09 1.072544e+09 1.961951e+05 6.555606e+08 1.113738e+09 1.135695e+09 176779.48 1.011873e+09 1.045037e+09 1.103061e+09 162784.77 1.020460e+09 1.007742e+09 9.754452e+08 1.341647e+06 9.868568e+08 1.010094e+09 1.076038e+09 3.663792e+05 9.647929e+08 1.221749e+09 1.185000e+09 233927.822 8.153861e+08 1.022561e+09 1.017278e+09 2.405898e+05 9.628436e+08 1.043878e+09 1.245019e+09 368979.33 8.840107e+08 1.077339e+09 1.034530e+09 3.367593e+05 9.297523e+08 1.156626e+09 1.039797e+09 2.585838e+05 8.175363e+08 1.081664e+09 1.180445e+09 1.523135e+05 1.037130e+09 1.059414e+09 9.486690e+08 5.357855e+08 7.111750e+08 6.614720e+08 9.512105e+08 7.079970e+08 7.657845e+08 7.915196e+08 7.290545e+08 9.294368e+08 9.450034e+08 1.030460e+09 8.996634e+08 1.249159e+09 8.583018e+08 9.265161e+08 1.085975e+09 1.005386e+09 5.405485e+08 9.336107e+08 8.127401e+08 9.416134e+08 1.070189e+09 1.273324e+09 1.368156e+09 1.493188e+09 1.208423e+09 9.433893e+08 1.016606e+09 1.017494e+09 8.970642e+08 7.851206e+07 9.063353e+08 8.813535e+08 8.155584e+08 6.472282e+08 7.341941e+08 6.959619e+08 9.835824e+08 8.021065e+08 5.539893e+08 8.185824e+08 1.045961e+09 9.014698e+08 8.734577e+08 1.020965e+09 8.514951e+08 9.007264e+08 8.249725e+08 1.052901e+09 6.033428e+08 9.689596e+08 8.795891e+08 8.276211e+08 1.078223e+09 6.384837e+08 9.559846e+08 1.010623e+09 8.491116e+08 7.858064e+08 1.192986e+09 3.105402e+08 5.326668e+08 7.148571e+08 1.216195e+09 1.252766e+09 7.317015e+08 8.838564e+08 8.270938e+08 9.365115e+08 8.509919e+08 7.313413e+08 6.742731e+08 6.733055e+08 4.643674e+08 5.571778e+08 2.414724e+08 7.750563e+08 8.052156e+08 1.012868e+09 5.029961e+08 7.303838e+08 7.322326e+08 9.379692e+08 9.720503e+06 7.726359e+08 7.165642e+08 6.925861e+08 7.733952e+08 1.158433e+09 9.888210e+08 8.552715e+08 7.409899e+08 4.256113e+08 1.597046e+09 1.006160e+09 5.018416e+08 6.435604e+08 7.556562e+08 8.558125e+08 8.408279e+08 1.470303e+09 1.166672e+09 8.081693e+08 1.062808e+09 8.715758e+08 8.917478e+08 7.392293e+08 9.006622e+08 1.044173e+09 1.034247e+09 9.045469e+08 9.835288e+08 8.763127e+08 8.741533e+08 5.662036e+08 6.265957e+08 6.293651e+08 6.415219e+08 5.277229e+08 6.903473e+08 6.097828e+08 7.236884e+08 8.863559e+08 6.397366e+08 6.844593e+08 6.379388e+08 8.304527e+08 7.973684e+08 1.059501e+09 1.036499e+09 8.629098e+08 1.162050e+09 2.225024e+09 1.140044e+09 1.136007e+09 1.969508e+09 1.301466e+09 1.232339e+09 1.387098e+09 1.091802e+09 2.068494e+09 1.101098e+09 2.217128e+09 1.629315e+09 1.081286e+09 1.477995e+09 2.338228e+09 1.206074e+09 2.146892e+09 2.149973e+09 1.293394e+09 1.945503e+09 2.075489e+09 2.467267e+09 7.379570e+08 1.231225e+09 1.352629e+09 1.034899e+09 1.529404e+09 1.109990e+09 1.601284e+09 1.181164e+09 7.532098e+08 1.206678e+09 1.016467e+09 1.522286e+09 1.539914e+09 1.443171e+09 2.352258e+09 1.509646e+09 1.505573e+09 1.266250e+09 1.482855e+09 1.183002e+09 1.068617e+09 1.489178e+09 1.435452e+09 1.761215e+09 1.655405e+09 4.060523e+08 1.647622e+09 1.298202e+09 1.548965e+09 1.653253e+09 1.341811e+09 1.254534e+09 1.612315e+09 1.307658e+09 1.716132e+09 1.401778e+09 1.392335e+09 8.148477e+08 9.036440e+08 9.491363e+08 1.245688e+09 1.314051e+09 7.933243e+08 7.156891e+08 1.064641e+09 8.216288e+08 1.097438e+09 1.318118e+09 9.445573e+08 8.203051e+08 7.296767e+08 8.464593e+08 1.205338e+09 4.340624e+08 4.806816e+08 5.565507e+08 9.739909e+08 1.538088e+09 1.023911e+09 1.371432e+09 C16 H35 N O7_1.803 4.274391e+04 5.453065e+05 6.339291e+05 5.579640e+05 4.939575e+04 3.619959e+05 5.884808e+05 6.520344e+05 57602.39 3.877951e+05 5.401765e+05 6.005543e+05 54753.77 5.208896e+05 5.721998e+05 4.727561e+05 6.057582e+04 4.644331e+05 5.792042e+05 4.494626e+05 1.069467e+05 5.787744e+05 6.000751e+05 7.328659e+05 65632.404 3.965853e+05 5.359563e+05 4.767819e+05 6.742951e+04 4.994064e+05 5.074207e+05 5.291998e+05 90135.75 5.555266e+05 5.707773e+05 5.698776e+05 9.014058e+04 5.373671e+05 5.217888e+05 4.308864e+05 7.183933e+04 5.988817e+05 6.138407e+05 3.715514e+05 4.085871e+04 7.321183e+05 3.547535e+05 6.311921e+05 2.651128e+05 4.206639e+05 1.138655e+05 1.805714e+05 4.173246e+05 5.425611e+05 2.891776e+05 6.331028e+05 1.669797e+06 1.654002e+05 2.775147e+05 6.869651e+05 2.345345e+05 5.774520e+05 2.647395e+05 3.131609e+05 2.342014e+05 2.915326e+05 5.318489e+05 3.191727e+05 2.561597e+05 2.027921e+05 5.494161e+05 4.381816e+05 1.749680e+05 1.520221e+05 4.703671e+05 2.732378e+05 2.984439e+05 5.866793e+05 4.771527e+05 4.709838e+05 4.426455e+05 4.875300e+05 4.208582e+05 4.326729e+05 3.156177e+05 6.796453e+05 4.057559e+05 2.774410e+05 4.661101e+05 4.578861e+05 7.277651e+05 6.479108e+05 3.317532e+05 3.464208e+05 2.403276e+05 2.451012e+05 4.274012e+05 4.522693e+05 3.078417e+05 3.601665e+05 3.035269e+05 5.836220e+05 2.569757e+05 4.553815e+05 6.311234e+05 4.048581e+05 2.957946e+05 3.660267e+05 3.399225e+05 4.156112e+05 4.466660e+05 7.769693e+05 6.006615e+05 5.532629e+05 5.510048e+05 4.683278e+05 5.225021e+05 4.401784e+05 4.022461e+05 8.121476e+05 4.315701e+05 2.361742e+05 3.363007e+05 5.847637e+05 4.880370e+05 6.961446e+05 1.095087e+06 5.534337e+05 7.471553e+05 6.832111e+05 5.470082e+05 2.808006e+05 6.634310e+05 7.223852e+05 6.321302e+05 8.477711e+05 7.316697e+05 7.124184e+05 5.642854e+05 6.717325e+05 1.349534e+05 1.054403e+06 1.132162e+06 2.839969e+05 2.630786e+05 2.498192e+05 3.586794e+05 1.315018e+05 2.687090e+05 4.355866e+05 4.552343e+05 5.238342e+05 2.484223e+05 5.005098e+05 5.705898e+05 3.981526e+05 4.676733e+05 6.437647e+05 5.713788e+05 3.665387e+05 3.176913e+05 3.137209e+05 2.936918e+05 3.117437e+05 4.703324e+05 4.233143e+05 2.994901e+05 2.336014e+05 4.181368e+05 3.842832e+05 3.971654e+05 2.781718e+05 4.781441e+05 4.126805e+05 6.656269e+05 8.161298e+05 4.951438e+05 1.461414e+05 3.484209e+05 2.433767e+05 1.334316e+06 4.272299e+05 3.298657e+05 1.702145e+06 3.953266e+05 9.621732e+05 2.544131e+05 5.712525e+05 1.971509e+06 4.174303e+05 1.542752e+06 5.325825e+05 3.252420e+05 5.652933e+05 1.114089e+06 3.773283e+05 1.823260e+06 1.522961e+06 3.791594e+05 1.431413e+06 1.776964e+06 1.597704e+06 3.725491e+05 4.676417e+05 6.494246e+05 3.032278e+05 2.823546e+05 1.913988e+05 5.660234e+05 5.965804e+05 1.847378e+05 2.919736e+05 3.447877e+05 6.427325e+05 4.744014e+05 6.245766e+05 2.512318e+06 4.554099e+05 7.451818e+05 4.253151e+05 6.740985e+05 4.755402e+05 1.512695e+05 6.688509e+05 4.191899e+05 5.916707e+05 5.492048e+05 6.002861e+05 5.815980e+05 4.778837e+05 3.694629e+05 7.883940e+05 3.582706e+05 4.729399e+05 8.007376e+05 2.727117e+05 6.431555e+05 1.989880e+05 4.832506e+05 5.677663e+05 8.716219e+05 3.117040e+06 2.846427e+06 2.918488e+06 1.976964e+06 1.904595e+06 3.329838e+06 2.079406e+06 2.828445e+06 3.215728e+06 3.073987e+06 1.812541e+05 2.958412e+06 3.710142e+05 5.929761e+06 2.159480e+05 2.575680e+05 1.749418e+05 2.921780e+05 1.281437e+06 2.734522e+06 3.112811e+06 Diethyl(2R_3R)-2-methyl-3-hydroxysuccinate_1.804 2.223552e+05 1.283164e+09 1.262462e+09 1.241567e+09 1.922925e+05 7.692703e+08 1.285435e+09 1.302940e+09 194471.70 1.158906e+09 1.202562e+09 1.275953e+09 185560.51 1.160328e+09 1.156070e+09 1.118445e+09 2.998026e+05 1.132246e+09 1.158943e+09 1.230679e+09 4.581123e+05 1.099761e+09 1.382756e+09 1.379918e+09 668431.750 9.549377e+08 1.201091e+09 1.065148e+09 2.878120e+05 1.140665e+09 1.258860e+09 1.497794e+09 644958.68 9.137291e+08 1.137253e+09 1.230937e+09 6.275595e+05 1.087489e+09 1.329398e+09 1.224050e+09 3.027798e+05 9.721881e+08 1.170731e+09 1.381998e+09 5.541031e+05 1.185608e+09 1.270267e+09 1.030329e+09 6.440170e+08 8.090046e+08 7.899408e+08 1.085956e+09 8.527584e+08 9.154757e+08 9.037483e+08 8.560569e+08 1.063003e+09 1.083290e+09 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2.661674e+06 4.161059e+06 6.896338e+06 4.384908e+06 6.391760e+06 4-(Acetyloxy)-ë±-ethenylbenzenemethanol_1.805 1.008271e+06 1.880015e+06 1.687490e+06 1.363343e+06 5.276772e+04 1.567344e+06 2.146913e+06 1.597161e+06 65632.65 1.576516e+06 1.562429e+06 1.501504e+06 61617.59 1.675649e+06 1.417289e+06 1.484682e+06 5.883608e+04 2.159754e+06 2.132963e+06 1.146093e+06 1.090303e+05 1.758631e+06 1.231735e+06 2.742093e+06 66004.646 8.917575e+05 2.172590e+06 1.570210e+06 6.864865e+04 9.952640e+05 2.387132e+06 1.833476e+06 115375.36 1.372918e+06 1.793816e+06 1.464285e+06 1.442952e+05 1.240742e+06 1.643799e+06 1.169385e+06 8.596757e+04 1.357057e+06 2.420557e+06 2.482273e+06 4.052141e+04 1.258371e+06 1.919513e+06 9.993899e+05 1.063820e+06 1.406052e+06 1.005588e+06 3.029368e+06 1.845668e+06 1.588625e+06 1.060625e+06 1.508232e+06 1.363120e+06 1.444447e+06 2.442305e+06 2.896017e+06 1.982209e+06 2.514573e+06 2.910056e+06 2.287533e+06 2.164627e+06 8.653894e+05 2.041658e+06 1.630372e+06 1.457439e+06 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4.764107e+04 3.746654e+05 6.845846e+05 7.713741e+05 53090.30 5.973432e+05 6.058589e+05 7.214487e+05 50509.57 6.716027e+05 4.992946e+05 8.546834e+05 5.745094e+04 6.311493e+05 6.500107e+05 8.754992e+05 1.180625e+05 3.379633e+05 5.610456e+05 7.688404e+05 69040.264 7.365328e+05 5.764998e+05 5.594437e+05 6.104339e+04 8.112709e+05 6.633269e+05 7.285235e+05 87229.34 5.724656e+05 5.947059e+05 6.098928e+05 9.114857e+04 7.409201e+05 6.565839e+05 5.881546e+05 6.661700e+04 5.735210e+05 7.399403e+05 7.123161e+05 3.651322e+04 6.877327e+05 8.937781e+05 3.589833e+05 1.293629e+05 1.157684e+05 1.075100e+05 1.144475e+05 1.282235e+05 1.155646e+05 1.011529e+05 1.524849e+05 1.219252e+05 1.431382e+05 1.338142e+05 1.288988e+05 1.608317e+05 1.212406e+05 1.317521e+05 1.489395e+05 1.194457e+05 1.119951e+05 1.171937e+05 1.279490e+05 1.269985e+05 1.279536e+05 1.705584e+05 1.543694e+05 1.767553e+05 1.718889e+05 1.103998e+05 1.125763e+05 1.371172e+05 1.264303e+05 1.459323e+05 1.178878e+05 1.144645e+05 1.220729e+06 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1.372014e+06 1.081468e+06 1.575728e+05 1.091754e+05 1.335125e+05 1.326006e+05 1.180571e+06 1.579231e+05 1.173320e+05 1.236538e+05 1.364706e+05 1.161673e+05 1.431670e+05 1.667283e+05 1.217365e+05 1.104081e+05 1.276222e+05 1.099877e+05 2.071820e+05 8.632893e+04 9.163569e+04 9.999942e+04 1.492522e+05 1.531858e+05 1.209997e+05 1.508124e+05 C24 H58 N9 O7 P_1.806 3.839519e+04 1.815596e+06 1.971168e+06 1.793940e+06 4.531213e+04 1.569978e+06 1.835183e+06 1.988987e+06 51514.84 1.644145e+06 1.693680e+06 2.410034e+06 50363.66 1.728617e+06 1.496777e+06 1.517084e+06 6.046121e+04 1.911702e+06 2.008052e+06 1.808047e+06 1.151789e+05 1.547074e+06 1.949333e+06 1.996194e+06 68090.777 1.779592e+06 1.819662e+06 1.705732e+06 6.440966e+04 1.964547e+06 1.521683e+06 1.996747e+06 89283.75 1.652033e+06 1.826697e+06 1.876464e+06 9.001545e+04 1.988844e+06 1.767604e+06 1.475328e+06 6.922247e+04 1.632033e+06 2.063223e+06 1.950748e+06 3.782716e+04 2.055489e+06 1.742329e+06 1.595093e+06 1.031368e+06 1.983355e+06 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1.598552e+06 1.505336e+06 2.282515e+06 1.087043e+06 3.068028e+06 2.269001e+06 1.552849e+06 2.095119e+06 1.522457e+06 1.953019e+06 2.026136e+06 1.853120e+06 5.151769e+06 2.242179e+06 2.327032e+06 2.559193e+06 1.950228e+06 1.442945e+06 1.111471e+06 2.269913e+06 2.929953e+06 2.915568e+06 2.038802e+06 2.725997e+06 2.212874e+06 1.699848e+06 2.659682e+06 1.880065e+06 1.769684e+06 1.991118e+06 2.235811e+06 1.249233e+06 1.666277e+06 1.421004e+06 1.909916e+06 1.775313e+06 2.726677e+06 3.852051e+06 4.388285e+06 4.067984e+06 2.850836e+06 3.234319e+06 4.590574e+06 2.997724e+06 3.728377e+06 3.787389e+06 3.785174e+06 1.124418e+06 3.210077e+06 1.920634e+06 7.179269e+06 1.080710e+06 8.718484e+05 1.031334e+06 1.339746e+06 3.072890e+06 3.494725e+06 4.078585e+06 C7 H10_1.807 1.161732e+05 7.278189e+05 7.532210e+05 8.715709e+05 6.204941e+04 3.125291e+05 8.023800e+05 8.184039e+05 179728.05 7.021969e+05 6.517229e+05 7.594278e+05 69531.69 6.805792e+05 6.648848e+05 4.120914e+05 9.739895e+04 9.414850e+05 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1.415921e+06 1.307063e+06 5.900154e+05 1.120969e+06 1.392924e+06 9.464511e+05 1.012700e+06 1.128201e+06 1.149835e+06 1.099995e+06 9.246048e+05 1.415440e+06 1.651010e+06 1.533634e+06 2.785620e+06 1.902089e+06 2.242418e+06 3.276076e+06 1.678399e+06 1.947719e+06 3.493283e+06 2.590499e+06 6.263314e+05 2.048989e+06 1.017727e+06 3.228807e+06 5.886457e+05 6.321809e+05 6.415176e+05 7.916261e+05 1.733672e+06 1.718847e+06 2.074936e+06 C9 H29 N10 O2 P3 S2_1.808 5.137900e+04 2.871553e+06 2.613283e+06 2.631550e+06 5.789476e+04 1.843024e+06 2.510348e+06 2.968365e+06 53124.37 2.521346e+06 2.619840e+06 2.601649e+06 47913.31 2.545618e+06 2.899710e+06 1.971220e+06 5.523054e+04 2.496142e+06 2.534245e+06 2.776653e+06 1.058928e+05 2.693477e+06 2.577236e+06 2.667616e+06 68377.387 2.398359e+06 2.610983e+06 2.759059e+06 6.975037e+04 2.530820e+06 1.966063e+06 2.961157e+06 100815.85 2.920295e+06 1.752865e+06 3.039355e+06 1.055108e+05 2.571661e+06 2.730071e+06 2.029301e+06 8.074162e+04 2.761901e+06 2.622809e+06 2.744317e+06 4.324428e+04 2.409929e+06 2.946978e+06 2.262703e+06 1.647269e+06 1.855748e+06 1.854314e+06 2.133471e+06 2.026082e+06 1.949941e+06 2.065650e+06 1.377212e+06 2.608301e+06 2.437376e+06 2.705685e+06 1.763162e+06 2.393099e+06 2.056667e+06 2.049510e+06 2.811435e+06 2.032181e+06 1.478918e+06 2.351771e+06 2.750266e+06 2.353279e+06 2.125126e+06 2.860064e+06 3.032399e+06 3.385503e+06 2.585515e+06 2.242813e+06 2.349429e+06 2.667079e+06 2.283217e+06 8.190348e+04 2.126108e+06 2.240382e+06 2.202179e+06 1.772105e+06 1.889112e+06 2.221353e+06 2.306565e+06 1.642739e+06 2.122182e+06 2.058871e+06 2.893903e+06 2.346999e+06 2.445601e+06 2.553884e+06 2.249800e+06 1.747441e+06 2.287945e+06 3.010252e+06 2.403645e+06 2.287202e+06 2.232460e+06 2.372606e+06 2.171164e+06 1.870739e+06 2.001737e+06 2.694027e+06 1.866915e+06 2.106808e+06 2.291031e+06 7.046722e+05 1.427011e+06 1.874424e+06 2.266522e+06 2.937699e+06 2.114133e+06 2.217665e+06 2.492043e+06 2.128558e+06 2.452194e+06 2.244975e+06 2.076631e+06 1.916140e+06 1.524914e+06 1.836030e+06 2.887811e+06 2.101683e+06 2.521891e+06 2.092871e+06 1.155615e+06 1.830655e+06 2.070529e+06 2.079343e+06 1.042714e+05 1.862660e+06 2.041048e+06 1.796176e+06 2.360450e+06 3.363328e+06 2.266936e+06 1.641082e+06 1.990477e+06 1.143783e+06 3.693958e+06 2.422379e+06 1.217159e+06 1.770129e+06 1.810460e+06 2.161661e+06 1.902039e+06 3.401090e+06 2.464534e+06 1.825541e+06 2.350064e+06 2.594455e+06 2.165611e+06 2.261039e+06 2.767015e+06 2.415578e+06 2.357741e+06 2.468052e+06 2.553769e+06 2.070715e+06 1.599174e+06 1.518482e+06 2.052887e+06 1.511087e+06 2.075591e+06 1.347163e+06 2.248128e+06 1.494335e+06 1.644630e+06 2.340014e+06 1.537442e+06 1.773129e+06 1.919720e+06 2.193054e+06 2.119410e+06 2.443211e+06 2.658941e+06 2.075504e+06 3.183691e+06 3.682143e+06 3.664422e+06 3.385612e+06 3.525477e+06 3.431639e+06 3.640413e+06 3.584463e+06 3.040832e+06 3.394435e+06 3.082731e+06 3.013036e+06 3.615880e+06 3.585421e+06 3.434746e+06 4.080454e+06 2.860680e+06 3.223029e+06 4.493972e+06 3.579418e+06 3.850969e+06 2.922980e+06 3.308701e+06 2.173017e+06 2.612714e+06 3.527977e+06 3.222271e+06 3.749116e+06 2.586425e+06 4.621439e+06 2.301199e+06 1.852233e+06 4.218452e+06 3.206142e+06 3.239385e+06 4.219029e+06 3.611755e+06 3.331167e+06 3.912820e+06 4.357052e+06 2.679083e+06 3.884844e+06 2.852743e+06 2.707443e+06 3.824770e+06 3.613230e+06 4.417216e+06 2.196596e+06 3.807347e+06 3.850074e+06 3.207250e+06 3.590041e+06 6.818272e+06 3.557730e+06 3.263463e+06 4.101807e+06 3.345922e+06 4.204117e+06 3.992674e+06 3.729126e+06 2.130361e+06 1.846974e+06 2.284814e+06 3.077839e+06 3.183889e+06 2.425973e+06 2.140666e+06 2.388025e+06 2.070533e+06 3.211516e+06 2.582803e+06 2.376990e+06 2.236130e+06 2.332184e+06 2.087269e+06 3.198836e+06 1.008188e+06 1.428960e+06 1.839786e+06 3.100020e+06 3.378100e+06 2.248936e+06 3.107327e+06 NPPB_1.809 2.894696e+05 3.424790e+06 6.923354e+06 7.502419e+06 1.359485e+05 4.648267e+06 8.609315e+06 1.134381e+07 108065.02 4.891019e+06 7.624578e+06 6.704471e+06 149533.18 2.942697e+06 6.999988e+06 6.478382e+06 2.314021e+05 3.215488e+06 8.114119e+06 9.459078e+06 3.093901e+05 2.883979e+06 6.629438e+06 1.417698e+07 180590.571 2.548581e+06 7.189233e+06 5.213711e+06 2.336671e+05 3.292395e+06 5.529325e+06 9.530711e+06 333375.92 5.361241e+06 9.288123e+06 6.105181e+06 3.577390e+05 5.299784e+06 7.730962e+06 6.464863e+06 2.819867e+05 4.129429e+06 5.520568e+06 1.357613e+07 1.479749e+05 3.571710e+06 5.031917e+06 6.953673e+06 7.407627e+05 7.112655e+05 8.518729e+05 1.932523e+06 5.382433e+05 6.125698e+05 1.931923e+06 1.093102e+06 3.520219e+05 1.076827e+06 1.544707e+06 1.343086e+06 6.733062e+06 2.952878e+06 2.155576e+06 1.222029e+06 3.061039e+06 7.334840e+05 8.537047e+05 2.216086e+06 7.104580e+05 9.587022e+05 3.851267e+06 2.306656e+06 1.398412e+06 1.375990e+06 1.196165e+06 1.150480e+06 1.601168e+06 5.533173e+05 3.019795e+06 1.239940e+06 7.172014e+05 8.454910e+05 9.105887e+05 1.580594e+06 2.025805e+06 6.761027e+05 7.514671e+05 3.670549e+05 5.535479e+05 1.165162e+06 2.055930e+06 7.788071e+05 6.921279e+05 7.402208e+05 1.198901e+06 8.274444e+05 6.627087e+05 2.068872e+06 1.377708e+06 1.395700e+06 8.291439e+05 1.006502e+06 1.079987e+06 9.044477e+05 1.056136e+06 1.086585e+06 6.706326e+05 6.729083e+05 2.599446e+07 8.674873e+05 8.001944e+05 7.730285e+05 4.844352e+05 1.071628e+06 1.072655e+06 5.224402e+05 8.590344e+05 1.001434e+06 7.494062e+05 4.322411e+06 6.345645e+05 7.817377e+05 4.859612e+05 4.786019e+05 5.361629e+05 7.037452e+05 5.969365e+05 1.043383e+06 9.152704e+05 2.892883e+06 9.140279e+05 3.477500e+05 7.351174e+05 1.837761e+06 1.162670e+06 6.413054e+05 1.316083e+06 6.094584e+05 3.691310e+05 1.864891e+06 6.271425e+05 5.922250e+05 1.121664e+06 7.421871e+05 8.879520e+05 1.058475e+06 1.285110e+06 9.574457e+05 3.295574e+05 9.313173e+05 6.604604e+05 6.755490e+05 3.432363e+05 1.669228e+06 4.566842e+05 6.675965e+05 1.664936e+06 1.374338e+06 2.071886e+06 1.388056e+06 6.288622e+05 1.503398e+06 6.311032e+05 4.047411e+05 7.272268e+05 2.270873e+06 1.597036e+06 9.762310e+05 5.450997e+05 9.998274e+05 1.692597e+06 5.694070e+05 8.153638e+05 6.668993e+05 7.563051e+05 8.513125e+05 1.263033e+06 1.264280e+06 8.445214e+05 9.057129e+05 2.579421e+06 4.963744e+05 4.945348e+05 9.737543e+05 5.195686e+05 1.068504e+06 1.078495e+06 9.503518e+05 2.924685e+06 1.513563e+06 1.414313e+06 4.284409e+05 8.938427e+05 6.770037e+05 7.109857e+06 1.225641e+06 7.329292e+05 2.095880e+06 1.398622e+06 1.780839e+06 1.831326e+06 9.284602e+05 5.447117e+05 1.865952e+06 8.027515e+05 1.725760e+06 1.935744e+06 3.576867e+05 1.997427e+06 1.316321e+06 2.208938e+06 8.062692e+05 5.353279e+05 1.262522e+06 5.704415e+05 9.492363e+05 1.081197e+06 1.650843e+06 3.252474e+06 2.747780e+06 1.058551e+06 8.979591e+05 1.593219e+06 1.084204e+06 9.602420e+05 3.003618e+06 1.358627e+06 7.143460e+05 8.700026e+05 6.845639e+05 3.009607e+06 6.264385e+05 8.553899e+05 8.907291e+05 3.893034e+06 7.357184e+05 9.809379e+05 6.993230e+05 9.158700e+05 1.146597e+06 1.738320e+06 7.035046e+06 7.848423e+05 1.471306e+06 1.436366e+06 4.484803e+06 2.237008e+06 3.845056e+06 6.544788e+05 1.042512e+06 3.395781e+06 2.733378e+06 1.739571e+06 1.279728e+06 3.127462e+06 8.486104e+06 1.631363e+06 7.707703e+06 5.649770e+05 6.317583e+05 1.825805e+06 7.592967e+06 C6 H18 N9 P_1.81 1.229359e+05 2.411176e+06 1.675753e+06 2.025471e+06 4.226617e+04 1.132107e+06 1.725812e+06 2.173353e+06 68298.83 1.481652e+06 1.914448e+06 2.093458e+06 65774.36 1.915511e+06 1.636247e+06 1.749751e+06 6.370665e+04 1.740396e+06 1.880962e+06 1.816227e+06 1.244597e+05 1.702341e+06 1.716545e+06 2.456660e+06 67169.571 1.563311e+06 1.836808e+06 1.731242e+06 6.388760e+04 1.713925e+06 1.842802e+06 2.111520e+06 89807.40 1.487303e+06 2.387742e+06 1.475022e+06 1.035298e+05 1.599441e+06 2.233918e+06 1.585134e+06 8.211406e+04 1.345379e+06 2.063015e+06 2.080433e+06 4.120546e+04 1.823765e+06 2.033175e+06 1.566818e+06 1.146342e+06 1.800999e+06 1.047410e+06 1.972173e+06 8.176123e+05 1.405054e+06 1.665627e+06 4.762267e+05 2.412970e+06 1.770566e+06 1.277738e+06 1.820528e+06 1.575448e+06 1.232749e+06 1.920855e+06 1.880987e+06 1.590829e+06 4.142825e+06 4.224521e+06 9.022887e+05 1.928624e+06 1.333403e+06 2.555246e+06 1.998684e+06 1.369532e+06 1.844515e+06 2.834628e+06 1.910167e+06 2.028420e+06 3.042201e+06 2.937094e+06 1.776211e+06 2.139845e+06 3.206404e+06 2.126182e+06 2.363299e+06 2.036266e+06 4.436759e+06 2.606363e+06 1.411469e+06 1.599494e+06 1.958196e+06 3.403072e+06 1.978250e+06 2.649440e+06 1.787490e+06 3.051037e+06 2.603515e+06 3.462287e+06 1.221306e+06 2.208582e+06 2.262321e+06 2.126251e+06 2.019837e+06 1.054432e+06 1.773108e+06 2.748390e+06 2.539944e+06 2.115261e+06 3.117899e+06 1.100350e+06 1.421910e+06 2.267873e+06 3.302453e+06 3.015691e+06 1.587740e+06 1.766424e+06 1.032278e+06 1.934960e+06 1.616195e+06 1.684169e+06 1.679629e+06 1.212019e+06 1.213016e+06 1.128111e+06 9.841061e+05 1.552236e+06 1.680716e+06 3.581809e+06 1.054647e+06 1.503901e+06 1.889850e+06 1.706187e+06 4.307959e+05 1.746058e+06 2.399790e+06 2.120139e+06 2.193743e+06 1.807838e+06 2.542022e+06 1.764270e+06 2.288951e+06 6.049319e+05 2.450082e+06 2.332153e+06 1.126668e+06 1.629398e+06 1.912411e+06 1.979090e+06 1.206281e+06 2.443328e+06 2.707525e+06 2.006549e+06 2.024196e+06 2.370578e+06 1.558335e+06 1.925059e+06 1.379311e+06 2.475790e+06 4.084728e+06 3.145273e+06 2.082259e+06 1.300008e+06 2.200174e+06 1.545988e+06 1.385863e+06 2.113027e+06 1.603016e+06 1.156833e+06 1.544397e+06 1.565083e+06 1.317349e+06 2.303129e+06 1.623083e+06 1.132469e+06 1.178783e+06 1.813452e+06 2.334327e+06 1.465639e+06 1.550356e+06 1.778261e+06 1.649795e+06 1.284183e+06 2.320525e+06 1.341474e+06 3.449300e+06 1.582871e+06 1.167272e+06 2.050684e+06 1.103069e+06 4.437113e+06 1.898597e+06 4.448701e+06 1.743569e+06 1.181184e+06 1.226471e+06 2.234535e+06 1.289521e+06 3.228251e+06 4.536016e+06 2.137089e+06 4.610133e+06 4.111541e+06 1.542981e+06 1.454549e+06 2.573713e+06 2.590237e+06 1.333214e+06 2.058399e+06 8.884739e+05 2.820247e+06 1.210790e+06 1.225751e+06 1.255476e+06 2.279504e+06 2.886571e+06 1.780383e+06 2.730429e+06 7.871015e+06 1.798176e+06 2.522314e+06 1.751284e+06 2.458860e+06 1.681924e+06 1.043442e+06 1.657820e+06 1.544069e+06 2.241640e+06 1.099982e+06 1.261798e+06 1.923395e+06 1.597787e+06 1.393497e+06 1.901559e+06 1.932063e+06 1.541963e+06 1.494930e+06 2.076692e+06 3.551934e+06 1.519214e+06 1.760425e+06 1.378125e+06 7.001587e+06 1.342202e+06 1.758044e+06 2.219934e+06 1.219854e+06 1.777770e+06 2.022075e+06 1.571224e+06 1.745228e+06 3.254305e+06 2.017203e+06 1.743907e+06 1.313217e+06 1.471228e+06 3.850481e+06 9.443857e+05 1.177851e+06 1.953690e+06 8.681271e+05 5.246224e+05 1.607196e+06 2.498913e+06 461.12155_1.81 1.301822e+05 1.136593e+07 1.654865e+07 1.014453e+07 1.239487e+05 2.016145e+07 1.358031e+07 1.848496e+07 71895.84 1.737056e+07 1.225406e+07 1.662235e+07 61300.02 1.746702e+07 1.519407e+07 1.785813e+07 6.197745e+04 1.067859e+07 1.429754e+07 1.539421e+07 1.180203e+05 1.879295e+07 1.761103e+07 1.809222e+07 81505.010 7.282391e+06 1.755284e+07 1.673327e+07 7.413969e+04 1.386868e+07 1.297654e+07 1.723805e+07 87096.91 1.604302e+07 1.552815e+07 1.345712e+07 8.592928e+04 1.931241e+07 1.516135e+07 1.444419e+07 7.455203e+04 1.741894e+07 6.411786e+06 2.133192e+07 4.641386e+04 1.821394e+07 1.783786e+07 1.097571e+07 9.222991e+06 8.451544e+06 1.308487e+07 1.312569e+07 1.109946e+07 1.248548e+07 1.418397e+07 1.227130e+07 1.619768e+07 1.456933e+07 1.268955e+07 1.418895e+07 1.551689e+07 3.533672e+06 1.366601e+07 1.456753e+07 1.268598e+07 8.684568e+06 1.429433e+07 1.360316e+07 1.589547e+07 1.701940e+07 2.135448e+07 1.936755e+07 2.247158e+07 2.008290e+07 1.512264e+07 1.603863e+07 1.677836e+07 1.776911e+07 9.267001e+04 1.242709e+07 8.226516e+06 1.044957e+07 9.906040e+06 1.167291e+07 1.372016e+07 1.464742e+07 1.021623e+07 1.276075e+07 1.575323e+07 1.873959e+07 1.325082e+07 1.673933e+07 1.609890e+07 1.085151e+07 1.397800e+07 1.314901e+07 1.504040e+07 1.294062e+07 1.622131e+07 8.531198e+06 1.483255e+07 1.421732e+07 1.474894e+07 1.147055e+07 1.563588e+07 1.332358e+07 1.298847e+07 1.520754e+07 5.587383e+06 8.506635e+06 1.209812e+07 1.861492e+07 2.110167e+07 1.082476e+07 1.317147e+07 2.101988e+07 1.250508e+07 1.369366e+07 1.151571e+07 1.076286e+07 1.152320e+07 1.083540e+07 1.266554e+07 1.666963e+07 1.389820e+07 1.422564e+07 1.141605e+07 7.724839e+06 1.478704e+07 1.356913e+07 1.602144e+07 8.432780e+04 9.599178e+06 1.168994e+07 1.278408e+07 1.457204e+07 2.201708e+07 1.717130e+07 1.663764e+07 1.400409e+07 3.695186e+06 2.489680e+07 1.401832e+07 1.139928e+07 1.750575e+07 1.134713e+07 1.339939e+07 1.116558e+07 2.083400e+07 1.334842e+07 7.479832e+06 1.915308e+07 1.601622e+07 1.316684e+07 1.692262e+07 1.059978e+07 1.191415e+07 1.142006e+07 1.663807e+07 1.506986e+07 1.167537e+07 7.916938e+06 9.454878e+06 1.172962e+07 8.535476e+06 1.220544e+07 8.508693e+06 1.271237e+07 8.206720e+06 1.211021e+07 1.667194e+07 1.421458e+07 1.123261e+07 1.370783e+07 1.577041e+07 9.942397e+06 1.464884e+07 1.237630e+07 1.234464e+07 1.842694e+07 1.898963e+07 2.501673e+07 1.862530e+07 1.636442e+07 2.037361e+07 1.992681e+07 1.834169e+07 1.982290e+07 8.434750e+06 1.524099e+07 2.177208e+07 2.604065e+07 1.539622e+07 1.636690e+07 1.958254e+07 1.966010e+07 2.087179e+07 2.215106e+07 1.893003e+07 2.029567e+07 1.958494e+07 2.454008e+07 1.234559e+07 1.804855e+07 3.305065e+07 2.046309e+07 2.610692e+07 2.870180e+07 2.609156e+07 1.209257e+07 1.746512e+07 2.299702e+07 2.115776e+07 1.933181e+07 2.854612e+07 1.966304e+07 2.122131e+07 1.796916e+07 2.587107e+07 2.055449e+07 2.482611e+07 9.474932e+06 1.752643e+07 1.879480e+07 1.998626e+07 2.316353e+07 1.904105e+07 1.588498e+07 2.170508e+07 3.038022e+07 2.419460e+07 2.245153e+07 1.787699e+07 2.048328e+07 2.663667e+07 1.486040e+07 1.590523e+07 2.221368e+07 2.779414e+07 1.327860e+07 1.329533e+07 1.264082e+07 2.320164e+07 3.066214e+07 1.387425e+07 7.572153e+06 1.655178e+07 1.199636e+07 1.677157e+07 1.454276e+07 4.000909e+06 1.313929e+07 1.303421e+07 6.092597e+06 1.228311e+07 6.982093e+06 6.306631e+06 9.903091e+06 1.792255e+07 1.980928e+07 1.345338e+07 1.935180e+07 C12 H23 N O5_1.811 1.949058e+05 7.821256e+05 1.103680e+06 1.022019e+06 5.016622e+04 5.166271e+05 8.895706e+05 1.161530e+06 53536.19 8.581085e+05 9.044599e+05 8.144773e+05 60357.81 8.604531e+05 9.323487e+05 6.763169e+05 1.972453e+05 8.448102e+05 1.204256e+06 1.009484e+06 1.228761e+05 6.858901e+05 8.255509e+05 1.072252e+06 75925.939 6.738849e+05 9.508270e+05 9.295694e+05 6.593908e+04 8.870934e+05 8.120201e+05 8.689299e+05 85963.90 1.085699e+06 7.796008e+05 7.852799e+05 9.048774e+04 9.583673e+05 9.841158e+05 8.866660e+05 7.154653e+04 8.081916e+05 8.732341e+05 9.971873e+05 4.043089e+04 8.988908e+05 7.996233e+05 9.222110e+05 1.978818e+06 2.841963e+06 9.484147e+05 9.881074e+05 3.196319e+05 1.206687e+06 1.310013e+06 9.988964e+05 2.093149e+06 7.906133e+05 1.036275e+06 2.469707e+06 8.199393e+05 1.383916e+06 8.111713e+05 8.925943e+05 5.056584e+05 4.978195e+05 4.034766e+05 6.108006e+05 7.533581e+05 8.760332e+05 7.687350e+05 7.372206e+05 5.964092e+05 1.254088e+06 1.751527e+06 3.551176e+05 1.217045e+06 2.454486e+06 9.586340e+04 1.099575e+06 4.032499e+05 6.553558e+05 1.022529e+06 6.365816e+05 1.735822e+06 8.266628e+05 9.182031e+05 4.822578e+05 9.869333e+05 6.507128e+05 3.518526e+05 9.152879e+05 3.612819e+05 4.682477e+05 1.472630e+05 6.927903e+05 2.535262e+05 1.093522e+05 4.225544e+05 1.153311e+05 1.391725e+05 4.708493e+05 1.239778e+05 4.625374e+05 1.320151e+05 5.362773e+05 2.376341e+05 5.672811e+05 6.449130e+05 1.495680e+05 1.523236e+05 8.583330e+05 3.382640e+05 1.050133e+05 1.294394e+05 1.465127e+05 4.467531e+05 1.174261e+05 1.576151e+05 2.099707e+06 1.163926e+05 1.171084e+05 9.727509e+04 1.227630e+05 1.057584e+05 1.193469e+05 1.987922e+05 1.277316e+05 2.475426e+05 2.382367e+05 6.235171e+05 8.899911e+04 1.400137e+06 1.412778e+06 2.095319e+06 6.077968e+05 1.423635e+06 3.520075e+06 1.301105e+06 1.564418e+06 1.381876e+05 3.821867e+06 1.547519e+06 1.307819e+05 1.040851e+05 1.301959e+05 2.903657e+05 2.657108e+05 1.489691e+05 2.207408e+05 1.374280e+05 2.132174e+05 2.458014e+05 4.491398e+05 4.087230e+05 4.077154e+05 4.691554e+05 1.225484e+06 2.276760e+06 3.601236e+05 4.165572e+05 7.438393e+05 2.469294e+06 6.362957e+05 1.141985e+06 8.214333e+05 1.727552e+06 7.107357e+05 6.361381e+05 1.001791e+06 7.880570e+05 2.485189e+06 1.475954e+06 7.100247e+05 1.075206e+06 1.115893e+06 7.672372e+05 6.587891e+05 7.381075e+05 7.013629e+05 1.023423e+06 2.172082e+06 1.019529e+06 8.316505e+05 1.217245e+06 1.337731e+06 1.484115e+06 1.036641e+06 1.026882e+06 6.533140e+05 1.444372e+06 2.010803e+06 8.569215e+05 9.489584e+05 9.301242e+05 1.476293e+06 5.525122e+05 9.963563e+05 2.304791e+06 6.013800e+05 7.257777e+05 6.314562e+05 1.876145e+06 1.633387e+06 1.760121e+06 1.137971e+06 1.072397e+06 5.003951e+05 3.543762e+06 1.163618e+06 1.268550e+06 1.212142e+06 1.288786e+06 1.001758e+06 1.070167e+06 1.127946e+06 8.661112e+05 1.347196e+06 2.376087e+06 1.243123e+06 3.582705e+06 8.111596e+05 1.169119e+06 1.311141e+06 2.246963e+06 5.040687e+06 9.651308e+05 1.706784e+06 1.299079e+06 1.141433e+06 1.704569e+06 2.119004e+06 9.412063e+05 4.144656e+06 2.083832e+06 1.022372e+06 1.376592e+06 9.395543e+05 3.500425e+06 4.759834e+05 1.460303e+06 1.126120e+06 1.665151e+06 1.823094e+06 8.015531e+05 7.075354e+05 1.041859e+06 9.677150e+05 1.095143e+06 3.383167e+06 2.116041e+06 6.468754e+05 1.197269e+06 9.839954e+05 2.753357e+06 5.563472e+05 6.772816e+05 1.168268e+06 4.068170e+05 1.120277e+06 1.838219e+06 1.234212e+06 C4 H16 N9 P_1.811 3.549060e+04 1.338450e+06 7.886288e+05 8.641870e+05 4.754869e+04 7.745670e+05 1.000257e+06 8.113182e+05 54769.58 8.789327e+05 9.859821e+05 1.015522e+06 54688.07 1.189881e+06 8.728127e+05 6.402559e+05 6.093415e+04 1.067970e+06 9.589766e+05 7.146960e+05 1.202778e+05 1.318108e+06 9.510454e+05 9.187494e+05 78272.352 6.439998e+05 1.177933e+06 9.308494e+05 7.373636e+04 1.120016e+06 8.934632e+05 1.140220e+06 113160.49 5.675560e+05 1.030217e+06 7.297272e+05 1.113749e+05 8.396130e+05 1.156149e+06 1.155317e+06 7.656618e+04 8.986786e+05 8.682525e+05 8.289724e+05 4.497663e+04 1.252725e+06 5.135297e+05 1.162923e+06 7.877214e+05 7.249238e+05 8.362688e+05 1.005104e+06 1.034829e+06 1.032454e+06 7.729607e+05 5.853168e+05 8.486247e+05 1.240539e+06 8.310660e+05 9.416010e+05 7.614807e+05 1.150605e+06 1.160331e+06 1.082585e+06 8.310176e+05 3.574694e+05 1.838913e+06 7.632763e+05 1.189785e+06 8.385921e+05 1.463452e+06 1.370565e+06 8.925089e+05 1.165332e+06 8.162911e+05 9.504979e+05 1.045877e+06 6.283768e+05 1.229044e+05 6.837593e+05 8.307973e+05 7.353990e+05 7.054128e+05 8.609945e+05 5.864711e+05 1.110656e+06 1.150486e+06 7.169332e+05 9.632970e+05 7.665047e+05 1.060639e+06 7.556768e+05 8.425293e+05 6.648941e+05 9.456843e+05 8.771677e+05 7.174121e+05 5.940233e+05 9.231110e+05 5.887085e+05 8.232938e+05 7.301740e+05 7.886781e+05 1.149303e+06 1.112304e+06 1.002102e+06 8.384799e+05 1.002210e+06 2.044017e+05 9.084316e+05 6.559340e+05 1.306847e+06 8.941507e+05 7.535522e+05 5.475608e+05 4.821139e+05 9.056733e+05 4.861404e+05 5.882596e+05 9.678077e+05 6.998354e+05 6.714764e+05 7.251383e+05 1.227984e+06 5.816098e+05 9.171954e+05 1.085910e+06 8.434796e+05 6.464671e+05 7.518374e+05 6.311192e+05 1.128758e+05 8.453287e+05 7.411446e+05 7.818506e+05 6.949302e+05 7.732902e+05 6.512570e+05 9.483504e+05 6.425436e+05 6.531481e+05 1.237854e+06 8.815503e+05 6.331108e+05 6.187718e+05 7.313017e+05 8.625010e+05 1.002611e+06 9.307877e+05 7.984541e+05 7.230334e+05 9.629109e+05 8.695476e+05 8.015457e+05 6.676506e+05 8.716399e+05 1.712011e+06 1.109925e+06 1.030948e+06 1.038648e+06 9.958236e+05 9.062877e+05 4.855844e+05 5.943496e+05 7.585872e+05 4.633590e+05 4.593889e+05 5.930853e+05 9.201082e+05 9.505333e+05 6.056950e+05 8.972329e+05 6.246565e+05 7.376279e+05 5.760636e+05 1.001882e+06 1.196050e+06 1.473742e+06 9.393712e+05 9.232867e+05 1.229119e+06 1.251366e+06 1.065828e+06 1.735567e+06 9.379633e+05 1.148533e+06 1.215447e+06 1.136441e+06 4.010320e+06 9.348460e+05 1.764836e+06 1.664710e+06 1.139363e+06 1.154141e+06 1.593552e+06 1.118625e+06 1.887130e+06 1.668897e+06 1.608419e+06 1.960468e+06 1.992920e+06 1.287306e+06 8.348812e+05 1.437897e+06 1.146961e+06 9.587224e+05 1.555060e+06 6.239359e+05 1.430236e+06 9.859040e+05 2.174867e+06 1.553067e+06 8.234390e+05 1.461455e+06 1.416516e+06 1.194770e+06 1.622986e+06 9.332695e+05 1.755604e+06 1.170448e+06 2.214626e+06 9.503506e+05 8.094257e+05 1.253126e+06 1.020956e+06 1.915625e+06 1.291856e+06 1.237690e+06 1.394172e+06 1.042700e+06 1.944548e+06 1.912024e+06 1.533748e+06 9.514507e+05 1.725130e+06 1.176205e+06 1.227985e+06 1.881109e+06 1.078759e+06 6.576379e+05 1.406035e+06 1.117588e+06 1.273247e+06 1.824297e+06 8.011879e+05 8.538222e+05 8.722189e+05 1.564959e+06 9.804729e+05 8.239306e+05 9.141574e+05 9.306088e+05 9.752714e+05 6.675833e+05 1.801765e+06 3.732883e+05 5.929071e+05 4.310163e+05 9.906493e+05 1.091969e+06 9.337385e+05 1.518755e+06 NP-014891 (loss of water)_1.811 5.395089e+04 2.407735e+07 2.328189e+07 2.154281e+07 5.945227e+04 8.680733e+06 2.179238e+07 2.291497e+07 59970.95 1.944822e+07 2.037648e+07 2.424803e+07 60479.10 1.582317e+07 2.106848e+07 2.063376e+07 6.421480e+04 2.002675e+07 1.829761e+07 2.083741e+07 1.247275e+05 1.881068e+07 2.131629e+07 2.479742e+07 78945.548 1.775849e+07 1.915056e+07 2.063653e+07 7.895338e+04 1.809925e+07 2.032147e+07 2.533736e+07 114448.73 1.776894e+07 2.284686e+07 1.358712e+07 1.306631e+05 2.098228e+07 2.451979e+07 1.370967e+07 1.185761e+05 1.808130e+07 2.226318e+07 2.687013e+07 4.551156e+04 1.874391e+07 2.370555e+07 1.488999e+07 2.634158e+07 3.605053e+07 1.842399e+07 3.522637e+07 1.615575e+07 3.240152e+07 2.030796e+07 3.087783e+07 2.792734e+07 2.586372e+07 1.904677e+07 3.662259e+07 3.060126e+07 1.970189e+07 2.532799e+07 3.232217e+07 2.975239e+07 1.050311e+07 2.608789e+07 2.142183e+07 2.215388e+07 2.065702e+07 3.410953e+07 2.665146e+07 3.215920e+07 3.452699e+07 9.926976e+06 1.824901e+07 1.026767e+07 1.731169e+07 2.956585e+06 2.387023e+07 1.832360e+07 1.619907e+07 1.519880e+07 1.263761e+07 1.187200e+07 1.642468e+07 5.079160e+06 9.199383e+06 7.212761e+06 1.327130e+07 3.816586e+07 1.594665e+07 3.765489e+07 2.251077e+07 3.198805e+07 3.489363e+07 3.167621e+07 1.546561e+07 2.179007e+07 2.383758e+07 2.211453e+07 2.611662e+07 7.068748e+06 2.624551e+07 3.120912e+07 2.350260e+07 2.151429e+07 2.331514e+07 8.472289e+06 1.390145e+07 1.283698e+07 3.085934e+07 2.296013e+07 1.728080e+07 1.796584e+07 7.162122e+06 2.219440e+07 1.750633e+07 7.710669e+06 1.970927e+07 1.135365e+07 9.152823e+06 4.372463e+06 1.495221e+07 9.145152e+06 1.494168e+07 2.474225e+07 5.340727e+06 1.305467e+07 1.482601e+07 2.161640e+07 3.062079e+05 9.485012e+06 1.601212e+07 1.724402e+07 1.546591e+07 1.671154e+07 2.015786e+07 1.642570e+07 2.020456e+07 1.110647e+07 2.406975e+07 2.161011e+07 1.402736e+07 1.858116e+07 1.398997e+07 1.251948e+07 1.694406e+07 2.008127e+07 2.788727e+07 1.719112e+07 1.584911e+07 1.369972e+07 2.921797e+07 1.681946e+07 2.071852e+07 3.125968e+07 3.265423e+07 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6.993154e+06 1.073397e+07 7.214866e+06 1.943716e+07 2.242299e+07 2.922680e+07 5.259282e+06 6.347166e+06 5.138324e+06 3.715930e+06 1.187146e+07 6.015439e+06 4.402977e+06 4.158609e+06 1.378904e+07 4.912476e+06 3.300146e+07 5.860872e+06 2.121244e+07 1.064272e+07 1.730875e+07 1.914197e+07 2.929697e+07 1.610685e+07 4.227308e+06 4.212593e+06 5.342857e+06 544.03307_1.812 8.653030e+04 8.398747e+05 1.113805e+06 1.163245e+06 9.918732e+04 8.340128e+05 1.362907e+06 1.122613e+06 61193.46 1.251789e+06 1.032569e+06 9.892476e+05 52184.88 1.287624e+06 1.288267e+06 1.065221e+06 5.622987e+04 1.056244e+06 1.118589e+06 1.288967e+06 1.016212e+05 1.189333e+06 1.210975e+06 1.267902e+06 73494.598 7.752692e+05 1.157532e+06 1.283222e+06 6.468444e+04 9.113552e+05 1.137000e+06 1.230004e+06 75329.05 1.125392e+06 1.210249e+06 1.278970e+06 7.841319e+04 1.142364e+06 1.139481e+06 1.189708e+06 7.140164e+04 9.256325e+05 9.919691e+05 1.322100e+06 4.019105e+04 9.969888e+05 1.547008e+06 8.946827e+05 7.111415e+05 9.045937e+05 9.359410e+05 9.079261e+05 1.028313e+06 1.028927e+06 1.033365e+06 4.221611e+05 1.014804e+06 1.194975e+06 1.190214e+06 1.089110e+06 1.074403e+06 5.014333e+05 9.415141e+05 9.497396e+05 9.780498e+05 6.067636e+05 1.030441e+06 1.050485e+06 1.365552e+06 1.101119e+06 8.101917e+05 1.294320e+06 1.472778e+06 1.336025e+06 1.237793e+06 1.364290e+06 1.506677e+06 1.153240e+06 8.525942e+04 7.955153e+05 1.138237e+06 9.642443e+05 8.509483e+05 1.253828e+06 8.844235e+05 1.208544e+06 7.462202e+05 1.075511e+06 1.178703e+06 1.417331e+06 1.154398e+06 1.050355e+06 1.778994e+06 1.187240e+06 8.669683e+05 8.988365e+05 1.338184e+06 9.005512e+05 1.146752e+06 1.003737e+06 1.323938e+06 1.061210e+06 1.167329e+06 8.874788e+05 1.352507e+06 1.109620e+06 1.187047e+06 1.519368e+06 5.249079e+05 1.160191e+06 9.924609e+05 1.284265e+06 1.408800e+06 7.908817e+05 1.135212e+06 1.790948e+06 9.189807e+05 1.428808e+06 1.240933e+06 7.266529e+05 1.094126e+06 9.156441e+05 1.218590e+06 1.313201e+06 1.562359e+06 1.308781e+06 1.053691e+06 6.027041e+05 9.855689e+05 9.374098e+05 1.294951e+06 7.580698e+04 9.448441e+05 1.079313e+06 8.694268e+05 1.619437e+06 1.535304e+06 1.096750e+06 1.107085e+06 1.069448e+06 9.100989e+05 2.248777e+06 1.158146e+06 8.918167e+05 9.993813e+05 9.434914e+05 1.591375e+06 9.378690e+05 1.214346e+06 9.079485e+05 7.028814e+05 1.343687e+06 1.257538e+06 1.020657e+06 1.355508e+06 1.245921e+06 1.001709e+06 1.020921e+06 9.928841e+05 9.464274e+05 1.009807e+06 4.441610e+05 8.389442e+05 1.020453e+06 6.371238e+05 9.219805e+05 6.506024e+05 9.991555e+05 8.883392e+05 9.837611e+05 1.221028e+06 1.232981e+06 8.734845e+05 1.024428e+06 1.174364e+06 9.900995e+05 1.072315e+06 9.913756e+05 6.490547e+05 1.260107e+06 1.067265e+06 1.729677e+06 1.367957e+06 1.024672e+06 1.732292e+06 1.205311e+06 1.314232e+06 1.557596e+06 5.154848e+05 9.546738e+05 1.362327e+06 1.606112e+06 1.242198e+06 1.283877e+06 1.166000e+06 1.284842e+06 1.030461e+06 1.494082e+06 1.596830e+06 1.254318e+06 1.056298e+06 1.366730e+06 1.129323e+06 1.085498e+06 1.646626e+06 1.823156e+06 2.431578e+06 1.352541e+06 1.758526e+06 3.709466e+05 1.280937e+06 1.704365e+06 1.291779e+06 1.525898e+06 2.710936e+06 1.597105e+06 4.510496e+05 1.401151e+06 1.530534e+06 1.259169e+06 1.479561e+06 1.323457e+06 1.493827e+06 1.426112e+06 1.620493e+06 1.267279e+06 1.611732e+06 1.540810e+06 1.482516e+06 1.593137e+06 1.964804e+06 1.177785e+06 1.394080e+06 1.594175e+06 2.431507e+06 1.294333e+06 1.557985e+06 1.376799e+06 1.552280e+06 1.088312e+06 7.388798e+05 9.794508e+05 1.281562e+06 1.557296e+06 1.148366e+06 9.599992e+05 1.063133e+06 1.040963e+06 1.247727e+06 9.872315e+05 6.449364e+05 1.073867e+06 8.033258e+05 1.479680e+06 7.751487e+05 5.220310e+05 9.799673e+05 7.754552e+05 1.653247e+06 1.336081e+06 1.019352e+06 1.146616e+06 C4 H12 N7 O3 P3_1.812 5.937703e+04 2.744132e+06 3.308034e+06 2.342883e+06 6.817600e+04 2.147710e+06 1.942095e+06 2.583916e+06 73514.18 2.662023e+06 2.967310e+06 3.223690e+06 74506.26 2.547029e+06 2.054509e+06 2.438199e+06 8.276616e+04 2.286088e+06 3.067731e+06 2.409394e+06 1.598221e+05 2.527143e+06 2.842762e+06 2.869409e+06 98392.474 2.262143e+06 2.514816e+06 2.760411e+06 8.965930e+04 1.922802e+06 3.326753e+06 2.745320e+06 119133.45 2.279231e+06 2.821455e+06 2.456706e+06 1.271544e+05 2.044607e+06 2.799372e+06 2.446307e+06 9.269015e+04 2.525085e+06 3.204764e+06 2.638882e+06 5.260846e+04 2.108835e+06 3.370942e+06 1.941498e+06 1.709959e+06 2.181295e+06 2.284273e+06 2.350244e+06 2.617897e+06 2.631108e+06 2.088913e+06 2.130269e+06 3.444636e+06 2.427920e+06 2.220858e+06 1.965857e+06 2.899251e+06 2.466472e+06 1.822861e+06 2.702515e+06 3.396293e+06 1.627202e+06 2.242644e+06 3.399464e+06 2.424674e+06 2.401809e+06 2.059698e+06 3.495631e+06 3.151835e+06 2.827775e+06 2.879213e+06 2.028852e+06 2.405081e+06 2.671840e+06 1.221656e+05 2.393543e+06 2.477862e+06 2.983077e+06 2.421441e+06 2.424413e+06 1.739260e+06 2.415523e+06 2.103552e+06 2.372324e+06 2.734026e+06 2.639303e+06 2.573229e+06 2.265708e+06 2.406964e+06 2.131235e+06 2.371350e+06 2.189204e+06 2.431380e+06 1.930757e+06 3.537723e+06 2.634327e+06 2.254286e+06 2.366550e+06 2.484528e+06 2.274372e+06 2.551707e+06 2.457648e+06 2.730661e+06 3.255139e+06 1.293771e+06 2.101656e+06 2.459943e+06 2.728004e+06 2.977091e+06 2.489289e+06 2.577251e+06 3.636973e+06 2.188639e+06 3.272578e+06 2.364158e+06 2.118486e+06 2.926745e+06 2.061753e+06 1.953416e+06 2.562089e+06 2.961434e+06 4.132466e+06 2.319506e+06 2.055032e+06 2.806804e+06 2.079071e+06 2.280594e+06 1.259595e+05 2.470058e+06 2.330504e+06 1.715690e+06 3.008845e+06 3.091744e+06 2.664172e+06 2.837329e+06 1.995934e+06 2.019822e+06 4.316575e+06 4.637757e+06 2.525228e+06 2.089416e+06 1.909956e+06 2.537529e+06 2.420530e+06 3.146802e+06 2.265730e+06 2.230642e+06 2.435948e+06 3.449039e+06 2.648222e+06 2.844373e+06 3.275926e+06 2.363100e+06 2.015193e+06 2.013660e+06 2.871560e+06 2.440977e+06 2.139981e+06 1.732131e+06 1.921559e+06 1.715551e+06 2.012489e+06 2.250584e+06 2.323429e+06 2.955907e+06 2.368439e+06 2.371145e+06 2.376584e+06 2.262991e+06 1.932992e+06 2.359616e+06 2.322845e+06 3.117774e+06 2.682989e+06 2.230066e+06 4.197894e+06 2.351134e+06 3.642637e+06 2.918322e+06 1.970982e+06 4.004590e+06 2.929254e+06 3.356973e+06 3.041498e+06 2.211328e+06 2.474416e+06 3.278198e+06 2.589066e+06 2.501461e+06 3.203141e+06 2.817128e+06 2.249241e+06 2.763966e+06 2.640153e+06 3.027280e+06 3.191296e+06 2.532217e+06 2.386553e+06 2.481065e+06 3.403066e+06 2.572635e+06 2.688724e+06 2.857004e+06 2.496960e+06 4.124990e+06 2.129191e+06 2.741605e+06 3.260716e+06 2.855654e+06 3.278814e+06 5.225141e+06 2.831347e+06 2.373223e+06 4.673984e+06 2.589595e+06 2.452136e+06 3.089526e+06 2.608704e+06 2.546192e+06 3.002724e+06 3.056813e+06 2.344566e+06 2.765932e+06 2.846550e+06 2.820448e+06 2.796304e+06 3.524290e+06 3.135177e+06 2.832568e+06 3.698827e+06 3.264962e+06 3.449456e+06 2.693668e+06 4.147083e+06 2.823140e+06 2.277101e+06 2.453763e+06 2.289930e+06 2.682382e+06 2.759332e+06 2.312032e+06 2.137812e+06 2.711986e+06 2.854137e+06 2.569923e+06 2.116216e+06 2.407880e+06 2.233190e+06 2.369533e+06 1.969872e+06 2.948027e+06 1.746266e+06 2.465744e+06 2.305976e+06 2.473291e+06 3.225924e+06 2.365933e+06 2.692218e+06 460.12318_1.813 1.008791e+05 5.097915e+07 5.788805e+07 6.326347e+07 1.139173e+05 4.159128e+07 6.633168e+07 6.737118e+07 76036.01 6.595112e+07 4.892886e+07 6.034271e+07 69284.69 6.616768e+07 6.147311e+07 5.869196e+07 6.988388e+04 4.201615e+07 5.270421e+07 5.539670e+07 1.213639e+05 7.721764e+07 6.648847e+07 6.825353e+07 80307.912 4.142795e+07 6.624730e+07 5.422396e+07 7.892152e+04 4.719085e+07 4.605400e+07 6.375793e+07 88959.59 7.315424e+07 5.793878e+07 4.556510e+07 8.611877e+04 7.492103e+07 6.237009e+07 4.732752e+07 7.452877e+04 6.671113e+07 4.367715e+07 6.857013e+07 4.826076e+04 6.371091e+07 6.639182e+07 4.781691e+07 3.131206e+07 3.804203e+07 3.087468e+07 4.392328e+07 3.802644e+07 4.210251e+07 5.396323e+07 3.790967e+07 5.708750e+07 5.038770e+07 4.684500e+07 5.889746e+07 5.765863e+07 3.840650e+07 4.972964e+07 5.637277e+07 4.587580e+07 2.488095e+07 4.927762e+07 4.927160e+07 5.794708e+07 6.482941e+07 5.607079e+07 7.500769e+07 6.040570e+07 7.005372e+07 5.126808e+07 5.327044e+07 6.413648e+07 6.535221e+07 1.469398e+05 4.171019e+07 4.745952e+07 4.118547e+07 3.657393e+07 4.214965e+07 3.645311e+07 5.652790e+07 3.453556e+07 4.899320e+07 4.926762e+07 7.097758e+07 4.025768e+07 5.986843e+07 6.382054e+07 4.991717e+07 4.987767e+07 3.644152e+07 4.413557e+07 1.296773e+07 5.776893e+07 4.398453e+07 5.390949e+07 5.580531e+07 5.564686e+07 4.495944e+07 6.141892e+07 3.815154e+07 4.425433e+07 6.091951e+07 2.002764e+07 3.123611e+07 3.628268e+07 5.501711e+07 8.665411e+07 3.054664e+07 5.006815e+07 7.448160e+07 4.634825e+07 5.151516e+07 4.041257e+07 3.856215e+07 4.134859e+07 2.929438e+07 3.270574e+07 5.587029e+07 5.200361e+07 5.623242e+07 4.557052e+07 2.720085e+07 4.429750e+07 3.645336e+07 6.094216e+07 8.471623e+04 3.382618e+07 4.799079e+07 3.866349e+07 5.670550e+07 7.232736e+07 5.965671e+07 6.318832e+07 4.232713e+07 2.103066e+07 9.853123e+07 5.112310e+07 3.576095e+07 4.746972e+07 4.391185e+07 3.898955e+07 4.218552e+07 7.012877e+07 4.973457e+07 3.759896e+07 5.594018e+07 5.878989e+07 4.507527e+07 5.302874e+07 6.261955e+07 4.739612e+07 4.646447e+07 5.965659e+07 5.232146e+07 4.453338e+07 2.783747e+07 2.949447e+07 3.810120e+07 2.658799e+07 3.839806e+07 3.317818e+07 4.437253e+07 3.421965e+07 4.396695e+07 5.004939e+07 4.321919e+07 3.785340e+07 4.435897e+07 5.383492e+07 4.020767e+07 5.269605e+07 4.564253e+07 4.065742e+07 7.024280e+07 2.341426e+07 8.439279e+07 6.932370e+07 6.128632e+07 7.512275e+07 6.181747e+07 6.674837e+07 6.371848e+07 6.594013e+07 5.061430e+07 8.944268e+07 8.111762e+07 5.941742e+07 6.209810e+07 6.843290e+07 6.822244e+07 6.986077e+07 9.326942e+07 7.891882e+07 5.316338e+07 7.486104e+07 8.775726e+07 4.687953e+07 6.786802e+07 1.097741e+08 8.081447e+07 1.025113e+08 7.358799e+07 1.026695e+08 6.290780e+07 4.361888e+07 9.094611e+07 7.105811e+07 8.097516e+07 1.088547e+08 6.404151e+07 6.652499e+07 6.738186e+07 8.907172e+07 6.911494e+07 8.765723e+07 6.724752e+07 6.929533e+07 7.434138e+07 7.431052e+07 8.551488e+07 6.788464e+07 5.682394e+07 8.803504e+07 7.350626e+07 9.127500e+07 2.411978e+07 6.917609e+07 7.037261e+07 1.099837e+08 5.774418e+07 9.581337e+07 6.292952e+07 9.423211e+07 5.250844e+07 4.750037e+07 4.648352e+07 7.617881e+07 8.943244e+07 5.879493e+07 3.612455e+07 5.891656e+07 4.021832e+07 6.451303e+07 5.694476e+07 3.608523e+07 4.514359e+07 5.025474e+07 4.518669e+07 7.001432e+07 2.246513e+07 3.090488e+07 3.169229e+07 4.361375e+07 6.881481e+07 4.976608e+07 7.762832e+07 C8 H12 O2_1.813 2.542210e+05 2.112728e+06 2.267953e+06 6.069281e+06 7.580550e+04 1.660190e+06 3.882232e+06 2.861508e+06 98397.82 2.913216e+06 3.299275e+06 3.539753e+06 198160.62 3.501715e+06 2.860860e+06 3.074813e+06 1.473705e+05 2.590318e+06 3.098490e+06 2.495059e+06 2.095408e+05 2.496982e+06 3.987662e+06 5.368452e+06 119104.247 2.037682e+06 3.264771e+06 2.565791e+06 1.397789e+05 2.168999e+06 2.917290e+06 4.731223e+06 344933.15 2.653681e+06 3.697361e+06 3.186063e+06 3.535954e+05 2.746540e+06 2.599795e+06 2.608632e+06 1.531665e+05 2.135400e+06 2.373972e+06 6.181692e+06 7.210908e+04 2.239896e+06 4.186872e+06 1.694685e+06 1.004474e+06 3.034383e+06 1.999286e+06 3.240356e+06 1.963098e+06 2.448467e+06 4.205157e+06 1.473789e+06 2.702974e+06 3.342019e+06 3.324576e+06 3.755093e+06 4.392730e+06 2.050046e+06 3.569784e+06 5.273583e+06 3.793630e+06 1.000306e+06 4.735674e+06 2.175765e+06 3.671561e+06 2.181577e+06 3.508049e+06 4.303551e+06 4.698478e+06 4.569035e+06 3.143817e+06 4.024499e+06 2.399498e+06 3.277802e+06 3.636370e+06 2.935129e+06 2.952936e+06 3.988857e+06 1.918327e+06 2.220362e+06 1.761189e+06 1.395736e+06 9.405837e+05 1.699831e+06 2.935294e+06 5.892401e+06 5.807740e+06 3.243305e+06 4.105672e+06 3.445173e+06 2.094941e+06 2.758711e+06 2.912207e+06 7.122073e+05 4.258463e+06 3.324602e+06 2.759230e+06 3.924026e+06 8.199516e+05 4.484736e+06 3.246007e+06 4.604850e+06 1.912104e+06 2.384500e+06 8.693045e+05 1.333908e+06 1.632153e+06 4.957008e+06 5.246109e+06 1.865076e+06 2.424834e+06 1.002316e+06 2.434893e+06 1.431418e+06 1.198126e+06 1.889229e+06 7.335974e+05 8.357219e+05 7.061509e+05 4.151990e+06 1.331734e+06 2.300518e+06 4.361645e+06 8.531530e+05 1.502506e+06 2.618563e+06 2.099155e+06 2.488315e+05 1.119227e+06 3.043249e+06 1.688567e+06 2.036304e+06 3.035304e+06 2.024346e+06 1.011859e+06 2.007429e+06 1.472241e+06 4.843093e+06 1.779287e+06 1.311466e+06 1.633281e+06 1.669404e+06 2.308040e+06 1.571717e+06 6.087950e+06 3.377414e+06 1.637803e+06 2.921024e+06 1.088277e+06 2.040815e+06 2.475790e+06 3.443996e+06 4.667535e+06 3.696615e+06 5.173633e+06 2.945647e+06 2.392632e+06 2.425951e+06 3.445606e+06 1.159678e+06 7.718767e+06 2.130224e+06 2.024009e+06 1.508073e+06 1.234286e+06 2.240996e+06 5.414472e+06 2.054126e+06 2.951568e+06 1.679514e+06 1.131065e+06 1.710794e+06 2.902066e+06 7.985964e+06 3.930529e+06 6.625753e+06 7.297514e+06 2.131102e+06 2.849375e+06 5.068864e+06 6.081360e+06 4.525221e+06 3.446613e+06 2.226832e+06 8.277863e+06 2.543364e+06 8.315668e+06 2.783795e+06 2.210989e+06 4.303825e+06 2.073664e+07 3.216021e+06 7.302559e+06 5.807318e+06 7.284705e+06 1.027313e+07 8.478159e+06 8.377448e+06 4.182546e+06 4.535899e+06 4.758929e+06 4.358060e+06 3.780879e+06 2.596079e+06 4.017476e+06 4.467879e+06 3.189861e+06 6.592916e+06 3.012650e+06 3.743686e+06 2.063337e+06 5.123254e+06 4.699718e+06 2.545118e+06 6.820997e+06 3.158627e+06 3.547255e+06 4.207522e+06 2.454707e+06 2.188159e+06 6.139245e+06 6.182499e+06 4.130185e+06 6.139624e+06 1.495830e+07 5.971113e+06 6.292771e+06 3.830173e+06 2.489085e+06 5.646211e+06 4.373949e+06 3.367979e+06 1.896747e+06 2.132484e+06 2.921632e+06 2.123052e+06 3.260744e+06 2.282004e+06 2.568701e+06 3.992414e+06 2.112902e+06 1.537261e+06 5.642584e+06 1.784212e+06 2.931726e+06 4.176373e+06 4.470199e+06 5.457254e+06 2.897915e+06 2.177812e+06 9.690700e+06 1.530413e+06 1.372373e+06 2.088808e+06 2.800478e+06 2.986533e+06 3.245161e+06 3.075172e+06 C19 H45 N4 O P3_1.813 8.678479e+04 4.417637e+06 3.809793e+06 4.128924e+06 8.707047e+04 1.938405e+06 4.143437e+06 4.295601e+06 80948.40 4.034493e+06 3.829802e+06 4.041072e+06 97244.07 3.840931e+06 3.764838e+06 3.301323e+06 1.203844e+05 2.768674e+06 3.778102e+06 4.417647e+06 1.964337e+05 3.517257e+06 4.201827e+06 4.153353e+06 123473.692 3.779623e+06 3.984674e+06 2.548265e+06 1.253851e+05 4.334466e+06 3.738560e+06 3.828001e+06 172710.70 3.886547e+06 3.631448e+06 3.635420e+06 1.724300e+05 3.796437e+06 4.255375e+06 3.938262e+06 1.309147e+05 2.687701e+06 4.576311e+06 4.074658e+06 7.481584e+04 3.534928e+06 4.839097e+06 2.544392e+06 2.675144e+06 4.520573e+06 1.129428e+06 1.360948e+06 8.968562e+05 3.105985e+06 1.011190e+06 1.052306e+06 9.097402e+05 9.069482e+05 1.312779e+06 4.045029e+06 1.631421e+06 1.676734e+06 2.356104e+06 1.469852e+06 1.312624e+06 2.185944e+06 3.750836e+06 1.179510e+06 1.362263e+06 1.276802e+06 1.442064e+06 1.857109e+06 2.093290e+06 2.146265e+06 3.395972e+06 3.903800e+06 4.080344e+06 4.231437e+06 9.579563e+05 3.942751e+06 3.967163e+06 4.010819e+06 2.929749e+06 4.697830e+06 2.666283e+06 3.380850e+06 2.489814e+06 1.836710e+06 2.156637e+06 2.845294e+06 4.682896e+06 3.540760e+06 4.069351e+06 2.708312e+06 4.103109e+06 3.326969e+06 3.482388e+06 3.795053e+06 2.926907e+06 3.121643e+06 2.704616e+06 3.758723e+06 3.063192e+06 2.927294e+06 2.730002e+06 3.339834e+06 2.185257e+06 3.298727e+06 2.032889e+06 2.599470e+06 4.460246e+06 4.349692e+06 3.297381e+06 3.628233e+06 4.766851e+06 3.247581e+06 5.772698e+06 3.569628e+06 3.805624e+06 3.966079e+06 1.806178e+06 1.841984e+06 1.640048e+06 5.392481e+06 4.511112e+06 3.711827e+06 8.010024e+06 2.365254e+06 4.215685e+06 5.086534e+06 4.221928e+06 3.454102e+05 2.720731e+06 3.882950e+06 3.433987e+06 5.164898e+06 4.936727e+06 5.119746e+06 3.962515e+06 4.505723e+06 6.127687e+05 5.778020e+06 6.627893e+06 3.997791e+05 6.313711e+05 1.188048e+06 1.201530e+06 1.227162e+06 1.413931e+06 1.557974e+06 1.443624e+06 2.585326e+06 2.092921e+06 3.781384e+06 2.565108e+06 3.284744e+06 6.117990e+06 6.209895e+06 3.659497e+06 3.782983e+06 3.360435e+06 4.060587e+06 2.235163e+06 3.126382e+06 3.870637e+06 3.434887e+06 1.928227e+06 2.909168e+06 2.722739e+06 3.369453e+06 2.979794e+06 2.272281e+06 4.071481e+06 2.767771e+06 5.925854e+06 4.773540e+06 2.197448e+06 1.790090e+06 2.087938e+06 1.907607e+06 3.818636e+06 3.629115e+06 3.110249e+06 3.789172e+06 4.262675e+06 4.788293e+06 3.949913e+06 4.124609e+06 6.057169e+06 2.186514e+06 4.410623e+06 2.678663e+06 8.225217e+05 5.371319e+06 6.217566e+06 2.959815e+06 3.975605e+06 5.488972e+06 3.300406e+06 3.774340e+06 4.946629e+06 5.080911e+06 3.317638e+06 2.148784e+06 3.378989e+06 3.459863e+06 4.845742e+06 2.296355e+06 5.272656e+06 1.988378e+06 2.378085e+06 4.116088e+06 3.235832e+06 4.661114e+06 5.120771e+06 4.784910e+06 7.380655e+06 5.475363e+06 5.276991e+06 3.592380e+06 5.432401e+06 3.826579e+06 2.981312e+06 5.060652e+06 5.588324e+06 6.022564e+06 6.751779e+06 5.491131e+06 6.264246e+06 4.824131e+06 5.840784e+06 3.920303e+06 1.803357e+06 4.859697e+06 6.002430e+06 2.662756e+06 2.859935e+06 2.473920e+06 4.281465e+06 2.388049e+06 4.613387e+06 9.787921e+06 1.125568e+07 1.128526e+07 7.471118e+06 8.661618e+06 1.248068e+07 9.093063e+06 1.056949e+07 1.501897e+07 1.021895e+07 1.354429e+06 9.435858e+06 3.636708e+06 2.077196e+07 1.470139e+06 9.316177e+05 1.159469e+06 3.763700e+06 8.078078e+06 9.333116e+06 1.201009e+07 Isoscoparin_1.813 8.491040e+04 5.039219e+07 5.269991e+07 6.033754e+07 1.011545e+05 2.410434e+07 6.261478e+07 5.590396e+07 77319.40 5.038943e+07 4.899326e+07 5.347307e+07 72201.86 5.541674e+07 5.236636e+07 5.361869e+07 7.346998e+04 3.230960e+07 4.798824e+07 4.776718e+07 1.268186e+05 6.820121e+07 5.599649e+07 5.573825e+07 82423.597 3.877396e+07 5.489669e+07 5.426586e+07 7.846365e+04 3.847815e+07 4.441629e+07 5.110282e+07 90624.06 6.111592e+07 5.229276e+07 4.047656e+07 8.721522e+04 6.279374e+07 4.991363e+07 4.494608e+07 7.321762e+04 6.098811e+07 3.551347e+07 5.822309e+07 4.910414e+04 6.082150e+07 5.627950e+07 3.747532e+07 2.261703e+07 3.661279e+07 2.542228e+07 3.779858e+07 3.590099e+07 4.141948e+07 5.016179e+07 2.051759e+07 5.119973e+07 4.748008e+07 3.902208e+07 5.265782e+07 4.831660e+07 2.631680e+07 4.358592e+07 4.669393e+07 3.784049e+07 2.352220e+07 4.473086e+07 4.256364e+07 4.944354e+07 5.221507e+07 4.696167e+07 6.262357e+07 7.079870e+07 6.037280e+07 4.909297e+07 4.974160e+07 4.889413e+07 5.394142e+07 1.516160e+05 3.671005e+07 4.180599e+07 2.977613e+07 3.112839e+07 3.895596e+07 2.822251e+07 4.681853e+07 3.366071e+07 4.339656e+07 5.111398e+07 5.920306e+07 2.894712e+07 5.147058e+07 5.113476e+07 5.854939e+07 4.223692e+07 3.068330e+07 4.479998e+07 3.707732e+07 5.371451e+07 4.180921e+07 4.799929e+07 4.430946e+07 4.703393e+07 3.664368e+07 5.464914e+07 4.419729e+07 4.236806e+07 5.413188e+07 1.967448e+07 2.563531e+07 2.736113e+07 5.671883e+07 7.219672e+07 2.126249e+07 4.130229e+07 6.523680e+07 4.374433e+07 4.217471e+07 3.509097e+07 3.518013e+07 3.384149e+07 2.296035e+07 2.598636e+07 5.072288e+07 4.304981e+07 4.678023e+07 4.235685e+07 2.695689e+07 3.589969e+07 2.588783e+07 5.025647e+07 8.608094e+04 3.251458e+07 4.113645e+07 3.247706e+07 5.109176e+07 6.378789e+07 5.212911e+07 5.390130e+07 3.250021e+07 1.716081e+07 7.825847e+07 4.935082e+07 2.602007e+07 3.371874e+07 3.921226e+07 3.904655e+07 3.560086e+07 5.972688e+07 4.292562e+07 3.468288e+07 4.597591e+07 4.824173e+07 4.023342e+07 5.471422e+07 5.912314e+07 3.753473e+07 4.572407e+07 4.945944e+07 4.638860e+07 3.785225e+07 2.106656e+07 2.864002e+07 3.168017e+07 2.112670e+07 3.016134e+07 3.396503e+07 3.861768e+07 2.722823e+07 3.682020e+07 5.146416e+07 4.723859e+07 3.373683e+07 4.184362e+07 5.066825e+07 3.929967e+07 4.722802e+07 3.920090e+07 3.803245e+07 5.897215e+07 5.720682e+07 8.525821e+07 6.316707e+07 6.121329e+07 6.085238e+07 5.340143e+07 6.453483e+07 6.273306e+07 7.609035e+07 3.848500e+07 7.271038e+07 8.136577e+07 5.107456e+07 5.409071e+07 5.776130e+07 5.579609e+07 6.855680e+07 7.208307e+07 6.588435e+07 6.736500e+07 5.900855e+07 7.975055e+07 3.964083e+07 5.209683e+07 7.390982e+07 6.925252e+07 8.439871e+07 6.130862e+07 8.300530e+07 7.233076e+07 5.341563e+07 7.503575e+07 6.682575e+07 6.547614e+07 9.829622e+07 5.567720e+07 7.143654e+07 5.397351e+07 8.484516e+07 6.531545e+07 6.754005e+07 3.879891e+07 5.806916e+07 5.656928e+07 6.363223e+07 7.328679e+07 5.023356e+07 5.605751e+07 6.966848e+07 7.161208e+07 7.560997e+07 5.528262e+07 5.828513e+07 6.637531e+07 8.680499e+07 5.194439e+07 1.016401e+08 7.167711e+07 7.297864e+07 4.576722e+07 4.230911e+07 4.385292e+07 7.442969e+07 6.206300e+07 5.345790e+07 3.167710e+07 5.486735e+07 4.071454e+07 5.460947e+07 5.054692e+07 3.562132e+07 3.957851e+07 4.915720e+07 4.747961e+07 7.067732e+07 2.262954e+07 3.163564e+07 2.825545e+07 5.736444e+07 6.318934e+07 4.625485e+07 6.343761e+07 C21 H45 N O9_1.814 5.732438e+04 3.997990e+06 3.429509e+06 3.714552e+06 4.739989e+04 1.583958e+06 3.748210e+06 3.862523e+06 44782.93 3.644734e+06 3.463628e+06 3.513180e+06 57988.78 3.381090e+06 3.428575e+06 2.964673e+06 6.791223e+04 2.385697e+06 3.352414e+06 3.943412e+06 1.090714e+05 3.281178e+06 3.699092e+06 3.646546e+06 68156.127 3.440361e+06 3.554151e+06 2.182358e+06 6.890108e+04 3.962172e+06 3.446919e+06 3.312340e+06 95477.39 3.546231e+06 3.176023e+06 3.144971e+06 9.523882e+04 3.473360e+06 3.829043e+06 3.576039e+06 7.156026e+04 2.328791e+06 4.133007e+06 3.506427e+06 4.084357e+04 3.292846e+06 4.409542e+06 2.153693e+06 2.382486e+06 3.971340e+06 9.202826e+05 1.228374e+06 7.683214e+05 2.791716e+06 9.185199e+05 8.083315e+05 8.005837e+05 7.750412e+05 1.099713e+06 3.559539e+06 1.239851e+06 1.417929e+06 2.142997e+06 1.055963e+06 1.113863e+06 1.736212e+06 3.253569e+06 1.052717e+06 1.243348e+06 1.073848e+06 1.276907e+06 1.510737e+06 1.905467e+06 1.983961e+06 3.000502e+06 3.474761e+06 3.685217e+06 3.747122e+06 8.719462e+05 3.546678e+06 3.572458e+06 3.609527e+06 2.693101e+06 4.255397e+06 2.413427e+06 3.019422e+06 2.210369e+06 1.731986e+06 1.773955e+06 2.494957e+06 4.136617e+06 3.084854e+06 3.658062e+06 2.444901e+06 3.611564e+06 2.955881e+06 2.992903e+06 3.337827e+06 2.565218e+06 2.871856e+06 2.435273e+06 3.501851e+06 2.838829e+06 2.717006e+06 2.484191e+06 2.979506e+06 2.053253e+06 2.969099e+06 1.819438e+06 2.284716e+06 4.051624e+06 3.747260e+06 2.983478e+06 3.214330e+06 4.218941e+06 2.947055e+06 5.173523e+06 3.260984e+06 3.463723e+06 3.400758e+06 1.659544e+06 1.633063e+06 1.539354e+06 4.562453e+06 4.035727e+06 3.312613e+06 6.811338e+06 2.196697e+06 3.808669e+06 4.574568e+06 3.790836e+06 2.591614e+05 2.554380e+06 3.487588e+06 3.008927e+06 4.631749e+06 4.295265e+06 4.547816e+06 3.557417e+06 3.895837e+06 5.069067e+05 4.941668e+06 5.829688e+06 3.075905e+05 4.919560e+05 1.070022e+06 1.032729e+06 1.106091e+06 1.267482e+06 1.340208e+06 1.326104e+06 2.211874e+06 1.968049e+06 3.457855e+06 2.416991e+06 2.969747e+06 5.530756e+06 5.588499e+06 2.590887e+06 3.427914e+06 3.142005e+06 3.584402e+06 1.899657e+06 2.721719e+06 3.320336e+06 3.102131e+06 1.767479e+06 2.621155e+06 2.424709e+06 3.040755e+06 2.581395e+06 1.953218e+06 3.593191e+06 2.451972e+06 5.189251e+06 4.335661e+06 2.011892e+06 1.396004e+06 1.719366e+06 1.781382e+06 3.486083e+06 3.281960e+06 2.704227e+06 3.545274e+06 3.790768e+06 4.396871e+06 3.512312e+06 3.696123e+06 5.491783e+06 2.023020e+06 4.134898e+06 2.343160e+06 6.928839e+05 4.792173e+06 5.435068e+06 2.541152e+06 3.237132e+06 4.880718e+06 3.120828e+06 3.152388e+06 4.463812e+06 4.588839e+06 3.160318e+06 1.870550e+06 3.121277e+06 3.125041e+06 4.429927e+06 2.133380e+06 4.714439e+06 1.804222e+06 2.097438e+06 3.627503e+06 2.947794e+06 4.239594e+06 4.493813e+06 4.216954e+06 6.996045e+06 4.984469e+06 4.678043e+06 3.117372e+06 4.902460e+06 3.547110e+06 2.819163e+06 4.539400e+06 4.955373e+06 5.344113e+06 6.046853e+06 4.930535e+06 5.475479e+06 4.354597e+06 5.189673e+06 3.212223e+06 1.620789e+06 4.238346e+06 5.248900e+06 2.469369e+06 2.609620e+06 2.282508e+06 3.726949e+06 2.044400e+06 4.106815e+06 8.417246e+06 9.656322e+06 9.753431e+06 6.508889e+06 7.617032e+06 1.071906e+07 7.911934e+06 9.138791e+06 1.366699e+07 9.041103e+06 1.225508e+06 8.057943e+06 3.281493e+06 1.761096e+07 1.340405e+06 8.417557e+05 8.407567e+05 3.544070e+06 6.955047e+06 8.036076e+06 1.075578e+07 C29 H42 N6 O2 P2 S_1.815 7.163319e+04 8.891168e+05 9.163580e+05 1.036555e+06 3.353470e+04 6.412234e+05 1.133431e+06 1.146213e+06 34263.30 8.211594e+05 8.808513e+05 1.159876e+06 43325.49 8.436644e+05 8.223171e+05 9.220371e+05 5.151195e+04 8.313925e+05 9.584082e+05 1.031994e+06 9.123213e+04 6.166040e+05 1.053172e+06 1.330710e+06 55837.617 7.533602e+05 9.736457e+05 8.147385e+05 5.712528e+04 8.109777e+05 8.698948e+05 1.366731e+06 77722.01 6.725217e+05 1.036770e+06 8.558380e+05 9.447880e+04 8.148262e+05 1.056315e+06 1.088159e+06 7.424681e+04 5.441217e+05 9.447670e+05 1.270946e+06 3.661934e+04 7.817170e+05 1.046906e+06 7.988137e+05 2.285269e+05 2.527034e+05 1.849703e+05 9.124981e+05 1.217379e+05 1.125966e+05 6.712699e+05 1.868421e+05 9.772338e+04 3.026263e+05 2.034404e+05 4.023027e+05 2.647118e+06 1.625780e+06 8.347946e+05 6.569327e+05 1.134557e+06 4.453869e+05 1.008326e+05 1.181450e+06 1.107612e+05 4.006532e+05 1.543975e+06 1.070443e+06 3.290345e+05 5.899587e+05 2.574412e+05 4.560845e+05 8.453634e+05 1.108791e+05 1.395225e+06 3.504508e+05 2.842495e+05 2.120482e+05 4.010152e+05 4.889987e+05 1.081368e+06 1.163524e+05 1.650383e+05 9.941235e+04 9.230517e+04 3.377177e+05 5.205204e+05 2.805198e+05 1.110668e+05 1.839451e+05 1.257225e+05 3.385477e+05 2.001425e+05 1.424105e+06 6.028259e+05 7.792832e+05 9.786213e+04 1.691803e+05 8.401622e+05 1.213383e+05 3.077040e+05 2.006179e+05 1.128904e+05 1.238881e+05 9.258224e+06 2.212047e+05 1.585438e+05 1.355051e+05 1.764318e+05 3.024798e+05 1.600846e+05 1.695278e+05 3.233560e+05 3.176668e+05 2.606020e+05 1.723309e+06 3.603989e+05 1.165122e+05 8.525457e+04 1.089040e+05 2.184137e+05 1.934110e+05 2.425556e+05 3.161166e+05 2.431412e+05 1.030080e+06 4.673425e+05 1.073807e+05 1.165113e+05 7.449737e+05 4.649220e+05 1.010467e+05 6.881587e+05 9.071167e+04 1.571696e+05 1.322279e+06 1.321949e+05 1.407831e+05 2.596697e+05 1.132433e+05 1.231915e+05 1.751247e+05 1.234324e+05 1.008234e+05 1.068571e+05 1.911041e+05 2.441097e+05 2.065005e+05 9.452170e+04 7.308141e+05 1.324985e+05 7.887904e+04 1.606377e+05 5.053110e+05 7.072701e+05 6.671688e+05 1.133809e+05 3.933586e+05 7.531177e+04 1.103660e+05 2.213470e+05 1.096712e+06 1.042533e+06 2.188516e+05 1.151559e+05 3.193642e+05 4.805790e+05 2.919012e+05 2.844807e+05 2.084466e+05 2.417310e+05 2.503627e+05 1.153726e+05 1.794859e+05 2.008286e+05 3.338546e+05 3.461641e+05 1.274096e+05 1.296708e+05 3.527627e+05 2.676706e+05 2.141956e+05 3.445328e+05 1.968762e+05 9.243347e+05 6.711918e+05 2.555498e+05 1.790908e+05 1.301985e+05 2.142572e+05 9.570013e+05 3.019967e+05 1.795894e+05 1.671086e+05 3.977896e+05 8.290754e+05 4.275674e+05 1.895641e+05 1.706716e+05 8.525253e+05 1.154453e+05 3.413212e+05 8.730219e+05 1.025764e+05 1.622221e+06 1.247905e+05 1.375323e+06 2.734567e+05 1.976256e+05 1.239544e+05 1.331028e+05 1.351034e+05 3.751779e+05 5.778429e+05 4.068864e+05 1.536937e+06 3.250472e+05 2.953360e+05 4.305297e+05 1.425354e+05 2.171822e+05 7.294826e+05 3.161031e+05 2.082990e+05 1.381678e+05 2.794809e+05 1.435837e+06 1.694862e+05 1.402742e+05 1.485273e+05 1.480668e+06 1.850111e+05 1.948766e+05 1.628734e+05 2.285387e+05 5.188099e+05 7.701931e+05 2.356330e+06 1.235957e+05 7.398939e+05 1.975086e+05 2.129862e+06 7.690463e+05 1.368704e+06 1.514493e+05 1.650502e+05 7.372464e+05 1.226501e+06 4.809324e+05 3.825183e+05 1.309693e+06 5.451073e+06 8.736462e+05 2.866077e+06 1.329245e+05 2.085533e+05 8.741181e+05 2.175216e+06 N-Acetylgalactosamine 6-sulfate_1.815 7.894468e+04 8.177170e+06 7.921885e+06 5.964740e+06 1.057089e+05 3.717619e+06 6.235287e+06 7.486867e+06 76462.66 5.832636e+06 8.683302e+06 7.110201e+06 76000.90 5.803339e+06 6.376126e+06 7.218089e+06 8.641486e+04 5.669584e+06 6.020824e+06 6.504222e+06 1.751845e+05 7.058020e+06 7.511093e+06 6.344879e+06 111929.250 6.849813e+06 6.234775e+06 6.822834e+06 1.072601e+05 6.400272e+06 5.707633e+06 7.996715e+06 139891.87 6.675840e+06 6.203694e+06 6.471365e+06 1.441625e+05 6.389772e+06 7.829975e+06 5.758330e+06 1.150267e+05 6.683788e+06 6.326869e+06 7.364071e+06 6.688115e+04 6.410361e+06 7.481171e+06 5.809404e+06 5.704008e+06 5.122282e+06 6.113146e+06 6.195468e+06 5.295188e+06 6.525519e+06 6.917931e+06 7.039756e+06 7.404291e+06 7.561849e+06 6.263416e+06 5.205232e+06 6.855523e+06 5.915183e+06 5.569687e+06 5.977624e+06 5.818659e+06 5.004918e+06 5.995418e+06 6.584755e+06 6.347330e+06 6.331838e+06 9.431608e+06 5.997236e+06 8.570032e+06 7.398781e+06 6.276428e+06 6.021813e+06 6.453515e+06 7.422294e+06 1.254195e+05 5.718443e+06 5.972780e+06 6.470539e+06 5.786884e+06 6.038583e+06 5.933952e+06 5.657815e+06 4.668446e+06 6.057306e+06 6.422693e+06 6.110880e+06 5.809340e+06 5.886330e+06 5.912914e+06 5.937677e+06 6.662545e+06 5.915135e+06 6.450056e+06 5.647895e+06 5.580868e+06 5.350121e+06 7.349196e+06 5.691153e+06 6.307862e+06 5.000653e+06 7.564299e+06 6.156705e+06 7.054163e+06 7.345612e+06 3.945481e+06 5.584470e+06 5.504540e+06 5.961260e+06 6.850564e+06 5.478265e+06 7.507915e+06 7.347927e+06 6.298011e+06 5.969092e+06 5.207906e+06 6.372941e+06 5.336843e+06 5.288213e+06 5.904993e+06 6.005584e+06 6.036422e+06 6.809064e+06 5.541784e+06 5.207699e+06 5.087048e+06 5.193526e+06 6.139966e+06 1.427066e+05 5.398588e+06 5.863326e+06 5.368716e+06 6.608653e+06 8.141367e+06 6.553209e+06 6.876509e+06 4.989956e+06 5.077954e+06 8.812097e+06 6.124407e+06 5.161988e+06 5.450717e+06 5.776048e+06 7.215143e+06 5.380500e+06 5.880506e+06 6.328379e+06 5.360474e+06 5.351445e+06 5.725421e+06 6.925247e+06 6.625003e+06 6.643639e+06 5.610960e+06 5.859984e+06 7.449703e+06 5.990543e+06 4.650157e+06 5.096250e+06 5.419992e+06 8.050380e+06 5.351708e+06 5.438880e+06 4.588003e+06 6.485924e+06 5.259640e+06 6.075330e+06 5.914295e+06 6.005735e+06 5.544078e+06 5.870566e+06 6.781522e+06 6.352937e+06 6.611426e+06 5.981661e+06 7.069742e+06 6.982740e+06 5.416656e+06 9.057020e+06 7.629111e+06 4.875829e+06 5.882385e+06 7.587886e+06 5.499855e+06 8.353763e+06 6.224253e+06 5.074708e+06 7.175428e+06 6.692892e+06 7.992479e+06 6.528030e+06 5.538072e+06 5.832508e+06 8.049187e+06 6.714895e+06 8.293079e+06 6.623544e+06 5.405642e+06 6.613108e+06 5.468914e+06 9.416070e+06 8.812207e+06 7.976980e+06 9.818071e+06 4.769799e+06 7.858990e+06 6.556215e+06 6.511482e+06 9.962085e+06 6.311627e+06 8.225081e+06 1.095700e+07 7.002291e+06 1.145811e+06 7.718512e+06 9.603598e+06 6.627015e+06 7.238269e+06 7.014996e+06 5.966957e+06 7.374529e+06 6.553893e+06 5.304704e+06 6.830035e+06 8.564484e+06 7.798536e+06 7.807539e+06 7.821187e+06 7.750988e+06 7.285300e+06 6.566068e+06 8.618454e+06 5.605740e+06 9.112072e+06 8.213403e+06 6.524419e+06 6.501719e+06 6.435776e+06 6.236996e+06 6.793472e+06 7.939286e+06 5.645945e+06 8.813246e+06 6.905659e+06 6.212414e+06 6.913409e+06 6.491505e+06 6.039627e+06 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1.507308e+06 1.501648e+06 1.214939e+06 1.520983e+06 1.579040e+06 1.768928e+06 1.617915e+06 1.436058e+06 1.685846e+06 1.254275e+06 2.133647e+06 2.342258e+06 2.160552e+06 1.857427e+06 2.348458e+06 2.016501e+06 1.603837e+06 1.594230e+06 2.490984e+06 1.934714e+06 1.819596e+06 1.805553e+06 9.341966e+05 1.583122e+06 1.914837e+06 2.114731e+06 1.796998e+06 1.538720e+06 1.733502e+06 1.967059e+06 1.000299e+06 1.544513e+06 1.306303e+06 1.655201e+06 1.247212e+06 1.672686e+06 2.309564e+06 2.056580e+06 6.395223e+05 1.683598e+06 2.335900e+06 2.064161e+06 1.478775e+06 2.795452e+06 1.297862e+06 2.008106e+06 1.885238e+06 1.434046e+06 1.326372e+06 1.988116e+06 2.085382e+06 1.550888e+06 1.585683e+06 1.794660e+06 1.213054e+06 1.737525e+06 1.396765e+06 1.152241e+06 1.432807e+06 1.398718e+06 1.943535e+06 1.661726e+06 9.277768e+05 1.443651e+06 9.687888e+05 1.346504e+06 1.969645e+06 1.660570e+06 1.609694e+06 C8 H17 O5 P_1.818 3.461189e+04 3.311289e+05 3.489134e+05 2.613630e+05 3.979434e+04 1.571095e+05 2.661267e+05 3.171811e+05 39808.14 3.013844e+05 3.013435e+05 3.200041e+05 47867.71 3.056657e+05 2.816905e+05 1.991443e+05 5.620871e+04 2.417943e+05 2.825804e+05 3.458859e+05 8.857073e+04 1.488918e+05 4.250523e+05 2.970730e+05 54268.679 2.820254e+05 3.090367e+05 2.827986e+05 6.449818e+04 2.158697e+05 1.781868e+05 3.788182e+05 97561.80 1.515146e+05 3.121307e+05 2.452745e+05 1.213079e+05 3.808133e+05 1.876803e+05 2.224160e+05 9.663113e+04 1.548684e+05 1.765922e+05 3.959608e+05 4.450324e+04 2.183618e+05 4.143889e+05 1.694267e+05 1.546170e+05 2.587371e+05 1.987710e+05 7.249455e+05 4.865612e+05 2.169418e+05 1.033511e+05 8.492216e+05 2.805688e+05 3.559596e+05 3.024833e+05 4.421271e+05 5.621717e+05 4.173386e+05 5.767585e+05 3.152814e+05 4.532463e+05 3.555605e+05 3.039244e+05 1.680876e+05 2.821248e+05 1.074419e+05 8.759450e+05 2.722544e+05 8.702726e+05 9.357720e+05 1.091243e+05 5.945796e+05 3.821418e+05 3.428496e+05 8.227021e+04 5.573442e+05 5.025934e+05 1.973751e+05 1.641019e+05 1.362824e+05 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1.454886e+05 7.391607e+04 2.672311e+05 1.902503e+05 9.562311e+04 3.242728e+05 1.924565e+05 1.483172e+05 1.531908e+05 1.117151e+05 7.748632e+04 1.542193e+05 1.956373e+05 1.303158e+05 4.647272e+05 3.438134e+05 2.740489e+05 3.742107e+05 1.191724e+06 2.630149e+06 4.233520e+05 1.276061e+05 7.422345e+05 1.098374e+05 1.720574e+05 1.180629e+05 1.485611e+05 2.726090e+05 1.727186e+05 3.423808e+05 4.067006e+05 3.654289e+05 2.017690e+05 6.400039e+06 1.086562e+05 1.634240e+06 1.357839e+06 1.428706e+05 2.202979e+05 1.757072e+05 2.554641e+05 1.739481e+05 1.142255e+05 1.382552e+05 1.209269e+05 1.418970e+05 1.229734e+05 1.380083e+05 1.490113e+05 1.520813e+05 1.184599e+05 8.628332e+04 1.503873e+05 2.181915e+05 1.365733e+05 2.559927e+05 1.848153e+05 1.627121e+05 1.223933e+05 1.346026e+05 1.127228e+05 1.189189e+05 1.744824e+05 1.105475e+05 1.545584e+05 2.319073e+05 6.931922e+05 1.441432e+05 1.340122e+05 1.279200e+05 3.271394e+05 1.735820e+05 1.154304e+05 1.566732e+05 1.701227e+05 1.585235e+05 3.061891e+05 1.358092e+05 9.997054e+04 2.108397e+05 2.564401e+05 6.236965e+05 1.312559e+05 3.614290e+05 1.294606e+05 1.303431e+05 1.251174e+05 1.311196e+05 2.306933e+05 1.262555e+05 1.264137e+05 1.035981e+05 9.335182e+04 5.660523e+05 1.800054e+05 7.932018e+04 2.436299e+05 1.158606e+06 3.266346e+06 1.343568e+05 2.331264e+05 149.52274_1.819 3.195992e+05 4.051239e+07 4.039485e+07 3.978821e+07 3.990525e+05 2.277940e+07 5.345382e+07 4.692926e+07 251900.15 4.051175e+07 2.920393e+07 3.870040e+07 231196.92 4.419710e+07 4.720473e+07 3.243023e+07 2.588766e+05 3.296418e+07 4.105308e+07 4.234669e+07 4.052750e+05 4.604135e+07 4.293533e+07 3.919520e+07 285672.317 3.465486e+07 4.489163e+07 3.898854e+07 2.619200e+05 2.688532e+07 3.971072e+07 3.894488e+07 281551.75 5.236534e+07 3.370385e+07 3.325316e+07 2.777904e+05 5.275328e+07 4.279372e+07 2.991863e+07 2.427219e+05 3.467702e+07 4.589440e+07 3.661843e+07 1.599954e+05 4.683257e+07 5.399125e+07 2.171961e+07 2.215228e+07 3.726551e+07 2.668611e+07 4.224024e+07 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3.738475e+07 3.582913e+07 8.653129e+05 2.365404e+07 4.633519e+07 3.094100e+07 3.780417e+07 5.340735e+07 4.249374e+07 4.422594e+07 3.631935e+07 2.463917e+07 4.396686e+07 3.511738e+07 3.615038e+07 5.032634e+07 3.593087e+07 3.718978e+07 2.600455e+07 4.406628e+07 2.412327e+07 2.550219e+07 4.790277e+07 4.027746e+07 3.359417e+07 4.392429e+07 5.090062e+07 3.168961e+07 4.497163e+07 4.105998e+07 2.842930e+07 3.374637e+07 2.718441e+07 2.870784e+07 4.332737e+07 1.715429e+07 3.333962e+07 2.263847e+07 3.952628e+07 3.566062e+07 3.486343e+07 3.662440e+07 3.864026e+07 3.486211e+07 3.773981e+07 4.964628e+07 3.756458e+07 3.737343e+07 3.403588e+07 2.790459e+07 4.247475e+07 4.176128e+07 6.113196e+07 1.827857e+07 4.050459e+07 4.792368e+07 2.947483e+07 4.154076e+07 5.082749e+07 3.850042e+07 2.801938e+07 4.659966e+07 4.584453e+07 4.028193e+07 3.334960e+07 3.520685e+07 4.629861e+07 4.535829e+07 4.318067e+07 3.954089e+07 3.616116e+07 3.407708e+07 3.840257e+07 2.806389e+07 3.069100e+07 4.835147e+07 5.014475e+07 4.195460e+07 3.840376e+07 2.724643e+07 3.532332e+07 3.199037e+07 5.736994e+07 5.054387e+07 3.426550e+07 7.986451e+07 3.578198e+07 2.418351e+07 3.725471e+07 4.992983e+07 4.536575e+07 4.747348e+07 2.891619e+07 5.199808e+07 3.774985e+07 4.178115e+07 3.603235e+07 3.687828e+07 4.031361e+07 4.057826e+07 5.648081e+07 5.674699e+07 3.520689e+07 3.357504e+07 4.277500e+07 6.575064e+07 2.509214e+07 3.527563e+07 2.030113e+07 4.843181e+07 4.735482e+07 3.903947e+07 4.087228e+07 4.494451e+07 4.565041e+07 4.761797e+07 3.977419e+07 4.541786e+07 2.769775e+07 4.300010e+07 3.446941e+07 3.263239e+07 2.460377e+07 2.813004e+07 3.411944e+07 4.743627e+07 2.827573e+07 2.903085e+07 2.645236e+07 2.736430e+07 3.980067e+07 3.710976e+07 4.810483e+07 C7 H16 N2 O7 P2_1.819 4.922974e+04 1.423754e+06 2.109346e+06 1.713496e+06 7.461966e+04 1.073999e+06 2.651750e+06 2.025699e+06 50387.43 1.732090e+06 1.855188e+06 1.351937e+06 63232.79 1.898143e+06 1.726292e+06 1.990056e+06 6.904955e+04 1.532005e+06 1.781448e+06 1.854967e+06 1.242791e+05 1.892299e+06 1.661758e+06 2.048759e+06 85761.064 1.984799e+06 1.578391e+06 1.542883e+06 8.839485e+04 1.847085e+06 1.490798e+06 2.290434e+06 117915.87 1.772772e+06 1.780467e+06 1.800314e+06 1.251990e+05 1.933328e+06 1.542601e+06 1.463658e+06 9.324306e+04 1.835374e+06 1.463616e+06 3.063877e+06 4.518733e+04 1.431486e+06 1.775671e+06 1.500198e+06 1.360549e+06 1.520687e+06 1.273761e+06 1.760631e+06 1.429068e+06 1.863260e+06 1.565576e+06 9.845348e+05 1.770744e+06 1.667825e+06 1.579745e+06 1.727882e+06 1.832912e+06 1.393334e+06 1.683823e+06 1.562401e+06 1.614373e+06 1.086074e+06 1.430822e+06 1.928076e+06 1.380556e+06 1.842833e+06 2.080237e+06 2.451101e+06 1.874283e+06 1.755791e+06 1.717089e+06 1.485983e+06 1.432280e+06 1.563142e+06 1.210188e+05 1.759225e+06 1.619986e+06 1.615641e+06 1.592356e+06 1.851830e+06 1.326322e+06 1.586327e+06 1.299867e+06 2.003595e+06 1.574872e+06 1.644912e+06 1.870450e+06 1.783076e+06 1.626845e+06 1.581117e+06 1.664415e+06 1.258417e+06 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1.610186e+06 1.711517e+06 1.936716e+06 1.498314e+06 2.198475e+06 1.592208e+06 1.884512e+06 1.511909e+06 1.935338e+06 1.989110e+06 1.015858e+06 1.452500e+06 1.750732e+06 1.575567e+06 1.973477e+06 1.257017e+06 1.477576e+06 1.956665e+06 2.026728e+06 1.951657e+06 1.923819e+06 1.403195e+06 1.621197e+06 1.616540e+06 1.872927e+06 1.737913e+06 1.384983e+06 1.445108e+06 1.749863e+06 1.581249e+06 1.886409e+06 2.382916e+06 1.995244e+06 1.922715e+06 1.783038e+06 1.632508e+06 2.021490e+06 1.930252e+06 1.957301e+06 1.561775e+06 2.281213e+06 2.451062e+06 1.648383e+06 1.053614e+06 1.498800e+06 2.135014e+06 1.470516e+06 2.202738e+06 1.995242e+06 2.084694e+06 1.484953e+06 1.829462e+06 1.782347e+06 1.931595e+06 1.801810e+06 1.754970e+06 1.733008e+06 2.308338e+06 1.760415e+06 2.101476e+06 2.671989e+06 2.264659e+06 1.476932e+06 1.527922e+06 2.461249e+06 2.173711e+06 2.159267e+06 1.394525e+06 2.071017e+06 1.525189e+06 2.013574e+06 1.682037e+06 1.705783e+06 3.066352e+06 1.716507e+06 2.024885e+06 1.644214e+06 1.891323e+06 1.835355e+06 2.525206e+06 1.704942e+06 1.646301e+06 1.218782e+06 1.495625e+06 1.934486e+06 1.693894e+06 2.055358e+06 2.054763e+06 1.936370e+06 9-Aminononanoic acid_1.82 3.021193e+06 4.141517e+06 3.961646e+06 3.259201e+06 8.222070e+04 2.163688e+06 3.272508e+06 4.288477e+06 80977.04 3.387424e+06 3.517684e+06 3.789404e+06 89848.91 3.330712e+06 3.423035e+06 3.530938e+06 3.367298e+05 3.260515e+06 3.487359e+06 3.455429e+06 1.924284e+05 3.137458e+06 4.162796e+06 3.995455e+06 134199.615 2.604944e+06 3.552473e+06 3.752725e+06 1.353784e+05 3.403384e+06 3.134896e+06 4.132743e+06 180788.21 2.876753e+06 4.273485e+06 3.208215e+06 2.108994e+05 2.924749e+06 4.273899e+06 2.688958e+06 1.638941e+05 2.872550e+06 3.792246e+06 4.764146e+06 8.189379e+04 3.115058e+06 3.784951e+06 2.850432e+06 1.531631e+06 4.680438e+05 2.630608e+05 5.409289e+05 2.807969e+05 5.160645e+05 1.149632e+06 1.004580e+06 3.169560e+05 3.946722e+05 3.403524e+05 1.582887e+06 4.828795e+06 2.182948e+06 3.973474e+05 3.926651e+06 1.419017e+06 4.548876e+05 2.050545e+05 3.541470e+06 2.739725e+05 2.808315e+05 3.751850e+05 4.101332e+05 5.924980e+05 3.058566e+05 3.641822e+05 2.443247e+05 6.890498e+05 8.303186e+05 4.472706e+05 5.766000e+05 6.861818e+05 3.439067e+05 1.800216e+06 4.208399e+05 2.440695e+05 1.660672e+06 1.369032e+06 1.767534e+05 4.126941e+05 3.841834e+05 2.660666e+05 3.962199e+05 3.570101e+05 2.442297e+07 3.872913e+06 3.520513e+05 5.301312e+05 3.941845e+06 1.235012e+07 1.077507e+07 1.052252e+06 1.627262e+06 7.763529e+06 1.428709e+06 4.723821e+05 4.856245e+05 4.968484e+05 8.424108e+06 1.653358e+06 2.311855e+05 2.518398e+05 6.092470e+05 3.652676e+05 7.604316e+07 5.372482e+06 2.825801e+05 2.338114e+05 6.227626e+05 2.385197e+05 6.569457e+05 2.503333e+05 2.555719e+05 3.800787e+05 3.792976e+05 3.205661e+05 4.289475e+05 5.168242e+05 3.984931e+05 1.593083e+07 1.566411e+05 1.367939e+06 7.084535e+05 6.442371e+06 4.376241e+05 4.484313e+05 3.710533e+05 3.672206e+05 1.338505e+06 1.608219e+07 5.498271e+05 4.364912e+07 1.379369e+07 6.121713e+05 1.925672e+05 1.829916e+05 4.988713e+05 4.534347e+05 4.990630e+05 4.995919e+05 5.039848e+05 4.166872e+05 1.049853e+06 8.040178e+05 1.849976e+07 1.908926e+05 2.101744e+07 5.684174e+05 2.168776e+05 6.198677e+05 2.061027e+05 4.942908e+05 3.721906e+05 9.524629e+05 4.404178e+06 5.944711e+05 1.477236e+07 6.760812e+06 1.187600e+06 4.865269e+06 6.322239e+06 4.155373e+05 5.654737e+05 3.896247e+06 7.229374e+06 1.536956e+06 1.954380e+05 3.975186e+05 5.409233e+05 7.636592e+06 3.244363e+05 7.096288e+05 2.000992e+06 2.623708e+05 4.751711e+06 3.835891e+05 4.196717e+06 4.749725e+05 9.452407e+05 1.779486e+06 1.465489e+07 7.233306e+05 5.729683e+05 1.263498e+07 1.723929e+07 2.381087e+06 3.271546e+06 6.675910e+05 4.119063e+05 6.313459e+05 8.076854e+05 1.218866e+06 1.098330e+07 1.506398e+06 3.657906e+05 3.236624e+05 3.606768e+06 4.237963e+05 2.509920e+05 1.185574e+06 4.587317e+05 2.343012e+06 2.075306e+07 3.864810e+06 4.484520e+05 6.273646e+06 3.277023e+06 1.035935e+06 2.098270e+07 4.714114e+05 3.273665e+05 5.139062e+05 3.332267e+05 3.097823e+05 3.443900e+05 6.009638e+06 7.862308e+05 5.064831e+05 7.092342e+05 2.570498e+06 2.815634e+05 9.093085e+06 4.873807e+05 6.686894e+07 2.945019e+05 3.757020e+05 7.171488e+06 3.330835e+06 1.892090e+07 3.202208e+05 3.593102e+06 1.050227e+07 7.929257e+05 2.561030e+07 2.299737e+07 2.558187e+05 4.878709e+06 6.300402e+05 4.953904e+05 2.155167e+07 3.263405e+06 5.899664e+05 7.413225e+05 4.639376e+06 4.183785e+05 8.300210e+05 1.036981e+08 2.738000e+05 3.507919e+05 2.034032e+06 1.067180e+07 2.864428e+07 5.129221e+05 C12 H18 O6_1.821 3.615531e+04 2.338575e+06 2.393968e+06 2.419820e+06 5.747390e+04 1.175593e+06 1.943148e+06 2.813193e+06 42503.50 1.979329e+06 2.280958e+06 2.252937e+06 50995.93 2.205822e+06 1.466340e+06 2.272275e+06 5.706636e+04 2.567516e+06 1.926158e+06 2.159760e+06 1.061511e+05 1.709884e+06 2.341198e+06 2.826772e+06 68526.102 1.948691e+06 2.054300e+06 1.793072e+06 6.863804e+04 2.172816e+06 2.149615e+06 2.514092e+06 89962.80 1.820344e+06 2.527421e+06 1.722717e+06 1.006950e+05 2.049499e+06 2.605572e+06 2.101019e+06 8.007783e+04 1.865218e+06 1.707827e+06 2.727121e+06 4.136813e+04 2.093369e+06 2.734487e+06 1.545642e+06 1.380336e+06 2.157389e+06 1.079259e+06 2.373921e+06 1.087861e+06 1.377213e+06 1.709447e+06 1.474620e+06 2.062033e+06 1.811573e+06 1.556776e+06 2.621507e+06 1.826758e+06 1.396575e+06 2.221941e+06 2.421952e+06 2.279535e+06 1.206557e+06 4.292032e+06 1.252041e+06 1.694648e+06 2.211795e+06 2.356523e+06 2.157033e+06 1.682561e+06 2.919848e+06 1.728276e+06 1.743796e+06 2.272207e+06 2.402141e+06 8.400353e+04 2.464657e+06 2.240897e+06 2.398430e+06 1.396334e+06 2.776655e+06 1.358995e+06 1.458369e+06 9.250122e+05 9.410807e+05 1.742552e+06 1.903508e+06 4.594726e+06 1.948545e+06 5.759190e+06 2.387352e+06 4.723092e+06 3.693222e+06 4.493801e+06 1.046483e+06 3.127640e+06 2.388779e+06 1.942882e+06 3.910547e+06 6.953229e+05 3.136832e+06 3.650025e+06 3.075841e+06 2.464814e+06 2.406492e+06 9.765538e+05 1.155914e+06 1.459717e+06 5.362942e+06 3.025979e+06 1.646173e+06 2.064504e+06 1.095664e+06 2.081806e+06 1.452080e+06 1.181784e+06 1.919478e+06 6.788462e+05 1.038724e+06 6.868768e+05 1.251394e+06 1.217679e+06 1.188220e+06 2.391181e+06 1.007503e+06 1.004170e+06 1.662651e+06 2.061095e+06 1.004987e+05 1.431822e+06 1.489027e+06 1.880049e+06 1.706285e+06 2.462006e+06 2.470641e+06 1.600884e+06 2.124567e+06 1.037212e+06 2.127699e+06 2.164446e+06 1.124069e+06 1.766286e+06 1.406854e+06 1.520250e+06 2.028523e+06 1.192429e+06 2.814703e+06 2.095821e+06 1.964556e+06 1.984849e+06 2.927121e+06 2.216853e+06 2.306262e+06 3.585363e+06 4.498906e+06 3.805500e+06 2.241026e+06 1.582552e+06 3.325754e+06 1.590387e+06 1.271833e+06 2.187184e+06 1.180017e+06 1.299332e+06 1.609871e+06 1.336173e+06 1.238796e+06 1.596721e+06 1.751837e+06 1.517783e+06 1.376507e+06 2.606114e+06 1.754400e+06 1.874746e+06 1.326513e+06 2.294074e+06 2.221898e+06 9.362669e+06 8.752679e+05 1.630391e+06 7.093413e+06 1.056102e+06 1.375353e+06 1.427707e+06 1.381727e+06 7.982339e+06 1.127963e+06 8.256166e+06 1.876239e+06 1.641893e+06 1.772114e+06 7.343393e+06 1.416278e+06 6.065201e+06 8.437438e+06 1.149456e+06 7.413358e+06 8.482860e+06 9.304747e+06 1.295915e+06 1.148595e+06 1.509496e+06 1.904442e+06 1.894486e+06 1.229335e+06 2.643332e+06 1.520367e+06 1.154911e+06 1.591417e+06 1.453547e+06 1.769619e+06 1.471348e+06 2.603175e+06 7.238386e+06 1.955726e+06 3.764145e+06 1.270084e+06 2.837250e+06 1.183511e+06 1.514735e+06 2.182737e+06 2.487593e+06 3.296126e+06 3.637714e+06 1.534289e+06 3.100307e+06 1.693026e+06 2.744196e+06 1.871803e+06 1.842057e+06 2.156111e+06 2.473198e+06 1.656919e+06 2.736989e+06 1.338332e+06 2.720716e+06 1.301308e+06 2.192543e+06 1.415250e+06 1.510996e+06 1.409650e+06 1.124539e+06 1.633768e+06 2.352270e+06 1.259861e+06 1.533887e+06 2.345028e+06 2.048360e+06 3.173649e+06 1.396658e+06 1.710267e+06 3.659353e+06 1.158098e+06 1.188431e+06 2.511877e+06 6.055988e+05 8.354448e+05 1.974428e+06 1.974858e+06 2-(1-Pyrrolidinyl)-3-pentanone_1.821 1.869753e+06 2.843663e+06 2.739729e+06 1.940930e+06 6.136696e+04 1.230745e+06 1.988478e+06 2.883477e+06 45212.79 2.219236e+06 2.259353e+06 2.473367e+06 48603.93 2.003376e+06 2.132995e+06 2.391820e+06 5.862212e+04 2.127147e+06 2.270551e+06 2.297664e+06 9.989134e+04 2.085823e+06 2.701937e+06 2.392357e+06 72909.226 1.575053e+06 2.316418e+06 2.558028e+06 7.433145e+04 2.254802e+06 1.865850e+06 2.682167e+06 96762.03 1.842057e+06 2.992617e+06 1.959827e+06 1.127821e+05 1.709390e+06 2.853412e+06 1.674133e+06 8.461604e+04 1.829272e+06 2.387338e+06 3.143751e+06 4.203775e+04 2.227733e+06 2.407506e+06 1.671781e+06 9.413150e+05 3.946591e+05 1.480644e+05 2.976762e+05 1.497909e+05 3.981400e+05 7.134969e+05 8.871378e+05 2.139273e+05 2.698677e+05 1.954144e+05 8.841063e+05 3.197946e+06 1.273111e+06 2.913672e+05 2.467233e+06 9.517712e+05 3.311135e+05 1.057272e+05 2.222006e+06 1.656414e+05 1.627995e+05 2.404551e+05 2.543020e+05 3.614068e+05 1.618214e+05 2.703136e+05 1.358205e+05 4.040813e+05 5.171396e+05 3.786931e+05 4.379292e+05 4.345382e+05 1.513190e+05 1.092275e+06 3.359115e+05 1.379545e+05 1.046458e+06 8.517613e+05 1.102463e+05 3.221684e+05 2.382058e+05 1.430483e+05 3.052311e+05 2.385325e+05 1.585300e+07 2.399640e+06 2.511673e+05 3.921489e+05 2.488343e+06 7.991026e+06 6.647848e+06 6.623305e+05 1.101524e+06 5.026018e+06 8.676435e+05 3.311020e+05 3.616359e+05 3.777402e+05 6.008140e+06 1.041566e+06 1.183053e+05 1.515049e+05 4.892495e+05 2.373874e+05 4.648052e+07 3.717223e+06 1.933192e+05 1.246824e+05 4.864801e+05 1.280917e+05 4.223915e+05 1.283305e+05 1.306469e+05 2.818051e+05 2.489646e+05 2.051607e+05 2.978006e+05 4.232736e+05 2.706196e+05 1.052431e+07 8.502096e+04 8.516897e+05 2.181915e+05 4.215276e+06 3.431643e+05 3.892002e+05 1.776654e+05 1.413033e+05 7.982989e+05 1.057272e+07 4.689593e+05 2.775294e+07 8.173096e+06 5.093557e+05 1.034949e+05 9.993299e+04 3.988976e+05 3.207480e+05 3.954429e+05 4.025466e+05 2.506637e+05 3.257814e+05 9.438696e+05 7.058944e+05 1.212682e+07 9.986241e+04 1.384640e+07 4.362453e+05 1.184650e+05 4.928860e+05 1.083589e+05 3.802994e+05 2.497529e+05 5.241505e+05 2.963992e+06 4.376708e+05 9.610693e+06 4.444622e+06 7.391833e+05 3.123065e+06 4.352363e+06 3.257120e+05 4.790484e+05 2.307248e+06 4.979905e+06 9.798958e+05 1.064199e+05 2.900549e+05 3.999531e+05 4.506915e+06 2.049636e+05 4.944885e+05 1.297603e+06 1.492987e+05 3.218291e+06 2.604245e+05 2.549814e+06 3.756795e+05 6.419496e+05 1.688525e+06 9.648642e+06 5.605987e+05 3.876906e+05 8.179370e+06 1.198639e+07 1.486862e+06 2.180949e+06 4.637485e+05 2.312965e+05 3.653481e+05 6.473586e+05 1.094523e+06 6.674075e+06 1.037779e+06 2.679815e+05 1.947174e+05 2.324967e+06 2.785213e+05 1.367008e+05 7.550081e+05 3.235058e+05 1.499121e+06 1.345238e+07 2.637598e+06 3.182364e+05 4.350703e+06 2.044216e+06 7.933057e+05 1.422903e+07 3.047213e+05 1.867940e+05 4.018887e+05 2.372929e+05 1.895738e+05 1.876070e+05 3.839668e+06 6.665655e+05 2.604478e+05 4.537243e+05 1.493540e+06 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6.363623e+05 6.626696e+05 3.578622e+05 5.514987e+05 9.014285e+05 6.260347e+05 1.994015e+06 7.667441e+05 8.583440e+05 8.689147e+05 9.191101e+05 5.846236e+05 4.879619e+05 9.022270e+05 1.017974e+06 9.496869e+05 8.169694e+05 1.043453e+06 7.093535e+05 6.586863e+05 7.219330e+05 9.401854e+05 5.124533e+05 8.974403e+05 8.217594e+05 3.764689e+05 4.484024e+05 2.426138e+05 6.274386e+05 6.905915e+05 9.127324e+05 1.397542e+06 1.351226e+06 1.354808e+06 8.601410e+05 1.387175e+06 1.322657e+06 9.130231e+05 1.108510e+06 1.662026e+06 1.264537e+06 2.947867e+05 1.170745e+06 6.977260e+05 2.921540e+06 3.093684e+05 3.187770e+05 3.532444e+05 5.075908e+05 1.692498e+06 1.063473e+06 1.627642e+06 C8 H13 N O_1.825 3.530101e+05 3.084772e+05 3.104259e+05 3.077970e+05 5.237924e+04 1.177850e+05 3.016725e+05 3.181573e+05 41259.59 2.797980e+05 3.424631e+05 4.395549e+05 51999.47 2.292269e+05 2.800160e+05 2.670051e+05 5.521412e+04 3.215172e+05 3.462394e+05 3.002050e+05 1.081723e+05 2.932346e+05 2.626424e+05 4.199195e+05 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1.129827e+05 1.329114e+05 2.385666e+06 6.361610e+06 1.190840e+05 1.551226e+05 1.404346e+05 1.616654e+05 1.194845e+05 4.258758e+05 1.691217e+05 1.768262e+05 2.001420e+05 1.274409e+05 1.635957e+05 1.851183e+05 2.527361e+05 4.993734e+05 1.834670e+05 1.985715e+05 2.429889e+05 2.288653e+05 1.794632e+05 1.945162e+05 1.519925e+05 1.168803e+05 1.345838e+05 1.101392e+05 2.162495e+05 1.046123e+05 1.663159e+05 1.430340e+05 1.497019e+05 1.535631e+05 1.151757e+05 1.760673e+06 1.512884e+05 1.879449e+05 2.478276e+05 1.719089e+05 4.103367e+05 2.121416e+05 1.396954e+05 1.155465e+05 6.023283e+05 1.666775e+05 1.362670e+05 1.587002e+05 2.085109e+05 3.045175e+05 1.503623e+05 2.471731e+05 1.489044e+05 1.980404e+05 1.778476e+05 1.949182e+05 1.795479e+05 1.573670e+05 1.331580e+05 2.085481e+05 1.372754e+05 9.571700e+04 2.210325e+05 1.160177e+05 1.512061e+05 5.682654e+06 1.059726e+05 1.137911e+05 1.483420e+05 1.590868e+05 3.430485e+05 2.931145e+05 1.347434e+05 1.459408e+05 1.045820e+05 9.611775e+04 2.029089e+05 8.324615e+04 1.105079e+05 1.429702e+05 1.098360e+05 1.919232e+05 1.662240e+05 1.443785e+05 Asparenomycin A_1.825 1.421046e+05 9.460148e+06 1.374686e+07 9.479417e+06 1.731124e+05 9.454485e+06 2.090084e+07 1.650405e+07 98515.03 9.716721e+06 1.105411e+07 1.615812e+07 99292.00 1.219245e+07 1.315272e+07 1.197184e+07 1.119427e+05 9.485763e+06 1.206612e+07 1.270802e+07 2.126898e+05 1.586480e+07 1.853754e+07 1.119029e+07 163491.581 8.466792e+06 1.328336e+07 1.446074e+07 1.586744e+05 1.010113e+07 1.063711e+07 1.185105e+07 147265.96 2.005452e+07 9.269015e+06 1.320047e+07 1.343091e+05 1.414971e+07 1.027912e+07 1.728285e+07 1.067542e+05 1.391273e+07 8.865701e+06 1.198532e+07 7.041052e+04 1.498603e+07 1.480312e+07 1.099540e+07 8.745431e+06 1.084293e+07 9.970535e+06 1.160276e+07 1.133246e+07 1.062297e+07 1.235307e+07 7.038570e+06 1.116789e+07 1.125777e+07 9.178222e+06 1.130493e+07 1.054759e+07 1.114391e+07 1.378886e+07 1.230338e+07 8.764455e+06 8.131007e+06 1.308352e+07 1.083126e+07 1.455896e+07 1.439614e+07 1.446767e+07 1.062137e+07 1.403134e+07 1.201581e+07 1.331655e+07 1.278047e+07 1.416552e+07 1.328083e+07 5.464953e+05 7.048792e+06 8.927923e+06 1.163057e+07 9.803057e+06 9.771946e+06 1.072070e+07 1.076104e+07 1.017735e+07 1.211538e+07 1.223199e+07 1.548139e+07 1.033001e+07 9.475798e+06 1.172527e+07 1.088622e+07 9.643621e+06 1.002868e+07 1.486578e+07 8.889925e+06 1.298739e+07 9.673998e+06 1.879272e+07 1.114541e+07 1.485416e+07 1.037115e+07 1.193419e+07 1.215126e+07 9.873691e+06 1.127667e+07 1.038372e+07 1.008218e+07 9.482379e+06 1.406632e+07 1.737541e+07 8.416591e+06 9.779778e+06 1.340695e+07 1.187931e+07 1.018270e+07 8.513089e+06 1.097778e+07 8.277591e+06 8.231783e+06 9.284594e+06 9.615688e+06 1.142264e+07 1.178095e+07 8.473847e+06 1.087884e+07 1.087106e+07 8.475349e+06 1.433959e+07 1.536519e+05 9.265936e+06 1.170808e+07 1.084068e+07 1.956991e+07 1.012249e+07 1.445938e+07 1.481644e+07 1.316257e+07 7.410567e+06 2.214126e+07 1.174457e+07 1.340399e+07 1.048161e+07 1.090666e+07 8.954065e+06 1.047248e+07 9.106864e+06 9.582284e+06 7.880690e+06 1.192000e+07 1.312706e+07 9.925510e+06 1.185419e+07 9.817020e+06 1.082301e+07 9.383560e+06 1.682879e+07 1.106457e+07 9.728744e+06 8.094156e+06 1.014342e+07 1.270377e+07 7.519397e+06 1.075749e+07 7.945422e+06 9.389369e+06 8.350238e+06 9.247237e+06 9.984094e+06 1.202516e+07 9.822954e+06 1.425859e+07 1.132913e+07 8.411084e+06 1.247930e+07 8.669637e+06 9.405775e+06 1.175360e+07 9.918883e+06 1.277065e+07 1.142346e+07 1.177691e+07 1.202919e+07 1.236714e+07 1.002215e+07 1.343950e+07 8.678387e+06 9.804484e+06 1.784855e+07 9.469908e+06 1.344272e+07 1.226584e+07 7.804880e+06 1.093666e+07 9.894028e+06 1.975162e+07 1.195516e+07 1.224823e+07 8.521723e+06 1.217271e+07 1.088566e+07 1.031100e+07 1.627322e+07 1.657804e+07 2.340385e+07 1.303349e+07 1.286990e+07 1.389023e+07 1.224296e+07 1.689648e+07 1.300176e+07 1.204717e+07 2.192285e+07 1.181608e+07 1.288472e+07 1.011233e+07 1.293075e+07 2.012660e+07 1.002982e+07 9.681462e+06 1.506259e+07 9.322066e+06 1.511655e+07 1.154466e+07 9.548531e+06 1.100189e+07 1.692516e+07 1.010078e+07 1.390658e+07 8.427038e+06 1.085177e+07 1.392966e+07 1.677391e+07 8.748963e+06 1.319280e+07 1.148330e+07 1.091161e+07 1.001220e+07 1.811396e+07 1.215291e+07 1.610609e+07 1.264213e+07 1.666363e+07 9.095257e+06 1.459047e+07 1.005870e+07 1.127432e+07 1.232028e+07 6.537085e+06 1.004764e+07 9.818417e+06 8.984661e+06 1.120203e+07 8.988258e+06 8.179405e+06 8.307783e+06 1.033913e+07 9.828782e+06 1.163299e+07 1.333234e+07 C8 H11 N7 O2 P2_1.826 4.106006e+05 4.738478e+07 5.463955e+07 4.796212e+07 5.319632e+05 3.621007e+07 7.386743e+07 6.065836e+07 315158.66 4.826042e+07 4.625856e+07 5.740837e+07 303884.28 5.449061e+07 5.751371e+07 4.488522e+07 3.094412e+05 4.100897e+07 5.384117e+07 5.408904e+07 5.477297e+05 6.170674e+07 6.383888e+07 4.940413e+07 406031.622 4.314686e+07 5.684510e+07 5.611122e+07 3.961854e+05 3.563906e+07 4.977079e+07 4.887700e+07 398803.90 7.377003e+07 4.444550e+07 4.633981e+07 3.841626e+05 6.568742e+07 5.227296e+07 4.775203e+07 3.280483e+05 4.882238e+07 5.380121e+07 5.004650e+07 2.140202e+05 6.230601e+07 7.170835e+07 2.766788e+07 3.274176e+07 4.802514e+07 3.779132e+07 5.333941e+07 4.289726e+07 3.901757e+07 5.640843e+07 3.410261e+07 5.484954e+07 3.757708e+07 3.342064e+07 6.120811e+07 4.717476e+07 5.071895e+07 5.436607e+07 5.118872e+07 3.289351e+07 2.536538e+07 5.360770e+07 4.541190e+07 5.895578e+07 5.217716e+07 3.829622e+07 4.132524e+07 6.841955e+07 5.709598e+07 4.990144e+07 4.795761e+07 5.281568e+07 5.678415e+07 2.015418e+06 3.337132e+07 4.815535e+07 5.148929e+07 4.456508e+07 5.169412e+07 4.133578e+07 4.806963e+07 3.424596e+07 5.859193e+07 5.502655e+07 5.197950e+07 3.881380e+07 5.253922e+07 5.332546e+07 5.086713e+07 4.697416e+07 4.471658e+07 4.466139e+07 4.028566e+07 5.007292e+07 4.266465e+07 5.413084e+07 4.337767e+07 4.993292e+07 4.465293e+07 4.766963e+07 6.644855e+07 3.702710e+07 5.326623e+07 2.867947e+07 4.005753e+07 4.141912e+07 5.799835e+07 6.717780e+07 4.100574e+07 5.191225e+07 5.671227e+07 4.878356e+07 4.954621e+07 4.057301e+07 4.652184e+07 3.069515e+07 3.750072e+07 3.335826e+07 5.197071e+07 4.561569e+07 5.887540e+07 4.408391e+07 3.948651e+07 5.103870e+07 4.411507e+07 4.799111e+07 1.030968e+06 3.410185e+07 5.822897e+07 4.194302e+07 5.551008e+07 6.757823e+07 5.759571e+07 6.226670e+07 5.011477e+07 3.212032e+07 6.426777e+07 4.979060e+07 5.104612e+07 5.989404e+07 4.602057e+07 4.428505e+07 3.627961e+07 4.688929e+07 3.258388e+07 3.242873e+07 5.840485e+07 5.250553e+07 4.163461e+07 5.857220e+07 5.681600e+07 4.183600e+07 5.264847e+07 5.797764e+07 3.897126e+07 4.190403e+07 3.731693e+07 3.903596e+07 5.729313e+07 2.479751e+07 4.319026e+07 3.270464e+07 4.815672e+07 4.392250e+07 4.382875e+07 4.415568e+07 5.075827e+07 4.538833e+07 5.254885e+07 6.508046e+07 4.612553e+07 4.950804e+07 4.474947e+07 3.809499e+07 5.362165e+07 5.132828e+07 7.432231e+07 3.315948e+07 5.172666e+07 5.750523e+07 4.141582e+07 4.891223e+07 6.795141e+07 4.679595e+07 3.686216e+07 6.373524e+07 5.267182e+07 5.395932e+07 4.555893e+07 4.210766e+07 5.891849e+07 5.472334e+07 6.222753e+07 4.803551e+07 5.056567e+07 3.983773e+07 5.136301e+07 3.737205e+07 4.544227e+07 7.307877e+07 6.533749e+07 6.507478e+07 5.022875e+07 3.722753e+07 5.596803e+07 4.388064e+07 7.084504e+07 6.414345e+07 4.977007e+07 1.086008e+08 5.010354e+07 3.775906e+07 4.724475e+07 6.343558e+07 6.631066e+07 5.379096e+07 4.039433e+07 6.576809e+07 5.013171e+07 5.528031e+07 4.772831e+07 4.583658e+07 5.064603e+07 5.988334e+07 6.219245e+07 6.999679e+07 4.495611e+07 4.448813e+07 5.804109e+07 8.096098e+07 3.349840e+07 5.769394e+07 3.089396e+07 5.667693e+07 5.862317e+07 5.915758e+07 5.310656e+07 5.962750e+07 5.533282e+07 6.338886e+07 5.089017e+07 5.805691e+07 3.491390e+07 5.496900e+07 4.661370e+07 3.712051e+07 3.430920e+07 3.643812e+07 4.118803e+07 5.860434e+07 3.785560e+07 3.614996e+07 3.332119e+07 3.978806e+07 4.865607e+07 4.845201e+07 6.146677e+07 123.07448_1.826 3.354924e+04 4.488440e+06 3.946074e+06 4.290584e+06 5.381382e+04 1.910385e+06 4.217984e+06 3.786719e+06 41813.31 4.378799e+06 3.768145e+06 4.236278e+06 49908.92 3.274762e+06 3.713665e+06 3.879007e+06 9.071573e+04 4.057086e+06 3.552092e+06 4.377943e+06 1.015149e+05 3.180168e+06 3.382100e+06 4.568046e+06 64704.023 3.738241e+06 4.046303e+06 3.643361e+06 6.252509e+04 3.651237e+06 3.904096e+06 5.012742e+06 86921.40 2.562693e+06 4.339098e+06 3.660090e+06 1.015307e+05 3.117793e+06 3.960299e+06 3.392956e+06 6.753207e+04 3.857740e+06 4.349193e+06 4.459886e+06 3.598354e+04 3.394726e+06 4.366904e+06 3.137428e+06 1.767251e+06 2.868432e+06 1.281639e+06 3.645906e+06 2.805237e+06 3.042714e+06 3.322621e+06 1.362814e+06 3.527935e+06 2.766034e+06 4.192379e+06 3.178518e+06 6.153711e+06 2.750830e+06 4.261449e+06 5.254417e+06 4.737056e+06 2.984567e+06 4.547479e+06 4.407909e+06 4.703840e+06 4.147716e+06 5.214491e+06 5.938551e+06 5.487401e+06 6.620096e+06 3.192157e+06 4.311962e+06 4.465839e+06 4.118197e+06 3.955372e+05 3.510097e+06 3.770924e+06 3.457593e+06 2.780230e+06 3.736790e+06 2.435666e+06 3.805277e+06 1.442081e+06 2.073005e+06 2.578226e+06 4.236098e+06 4.671798e+06 2.833748e+06 4.384726e+06 2.980877e+06 4.807069e+06 4.341740e+06 5.299451e+06 2.632670e+06 4.873266e+06 3.769110e+06 3.507887e+06 4.958519e+06 2.377978e+06 4.527867e+06 4.482438e+06 4.177034e+06 3.439732e+06 5.027519e+06 7.682373e+05 2.241170e+06 2.959475e+06 5.717493e+06 4.446284e+06 3.150668e+06 3.992303e+06 3.300248e+06 4.242650e+06 3.566658e+06 3.063316e+06 3.906255e+06 1.910967e+06 2.230128e+06 1.653854e+06 4.583799e+06 2.798608e+06 3.054974e+06 4.654614e+06 1.959101e+06 3.233733e+06 3.264093e+06 4.195487e+06 1.018138e+05 3.324413e+06 3.414572e+06 2.613081e+06 3.479006e+06 5.662687e+06 4.750845e+06 3.953756e+06 3.665177e+06 1.556390e+06 7.450033e+06 5.019765e+06 2.254073e+06 2.764526e+06 3.661018e+06 4.175799e+06 4.292303e+06 6.929938e+06 6.101064e+06 4.126526e+06 4.849970e+06 4.178122e+06 3.883656e+06 3.214313e+06 4.005901e+06 4.871747e+06 5.574464e+06 5.825607e+06 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6.891565e+06 4.550831e+06 5.519841e+06 3.029379e+06 3.724455e+06 4.303147e+06 4.271606e+06 5.243405e+06 2.653454e+06 2.941875e+06 3.463966e+06 3.246889e+06 3.621853e+06 6.140985e+06 4.323919e+06 3.971955e+06 3.389370e+06 3.063313e+06 8.403960e+06 1.611975e+06 2.158223e+06 1.580667e+06 4.070278e+06 5.613850e+06 4.133668e+06 4.715758e+06 C5 H7 N4 O P_1.826 1.430779e+05 1.027312e+07 1.038237e+07 1.008162e+07 1.806364e+05 1.106994e+07 1.368042e+07 1.358535e+07 91267.84 1.093195e+07 1.045978e+07 1.069272e+07 87233.82 1.174556e+07 1.507813e+07 1.086221e+07 9.371125e+04 1.019080e+07 9.581148e+06 9.562399e+06 1.917896e+05 1.599473e+07 1.206891e+07 1.137777e+07 145993.545 8.850310e+06 1.243459e+07 1.310937e+07 1.277263e+05 9.130878e+06 9.549929e+06 1.334695e+07 119008.40 1.374957e+07 1.018515e+07 9.398959e+06 1.081746e+05 1.275557e+07 1.216965e+07 1.000399e+07 8.550136e+04 1.459067e+07 7.470288e+06 1.134956e+07 5.850709e+04 1.760092e+07 1.380105e+07 3.152901e+06 4.304053e+06 7.955260e+06 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9.023718e+05 1.126768e+06 1.253176e+05 2.963813e+06 1.091987e+06 1.150226e+06 8.622329e+05 1.565454e+06 1.306934e+06 7.312214e+05 2.134977e+05 2.292808e+05 4.115282e+06 4.175011e+05 7.010845e+05 1.346107e+05 1.225528e+05 1.865248e+05 2.315712e+06 1.647610e+05 C9 H17 N8 P_1.83 3.668623e+04 4.488440e+06 3.946074e+06 4.290584e+06 5.884562e+04 1.910385e+06 4.217984e+06 3.786719e+06 47944.26 4.378799e+06 3.768145e+06 4.236278e+06 54575.60 3.274762e+06 3.713665e+06 3.879007e+06 9.071573e+04 4.057086e+06 3.552092e+06 4.377943e+06 1.141609e+05 3.180168e+06 3.382100e+06 4.568046e+06 78163.107 3.738241e+06 4.046303e+06 3.643361e+06 6.837506e+04 3.651237e+06 3.904096e+06 5.012742e+06 95048.90 2.562693e+06 4.339098e+06 3.660090e+06 1.110242e+05 3.117793e+06 3.960299e+06 3.392956e+06 7.384659e+04 3.857740e+06 4.349193e+06 4.459886e+06 3.693119e+04 3.394726e+06 4.366904e+06 3.137428e+06 1.767251e+06 2.868432e+06 1.281639e+06 3.645906e+06 2.805237e+06 3.042714e+06 3.322621e+06 1.362814e+06 3.527935e+06 2.766034e+06 4.192379e+06 3.178518e+06 6.153711e+06 2.750830e+06 4.261449e+06 5.254417e+06 4.737056e+06 2.984567e+06 4.547479e+06 4.407909e+06 4.703840e+06 4.147716e+06 5.214491e+06 5.938551e+06 5.487401e+06 6.620096e+06 3.192157e+06 4.311962e+06 4.465839e+06 4.118197e+06 4.501259e+05 3.510097e+06 3.770924e+06 3.457593e+06 2.780230e+06 3.736790e+06 2.435666e+06 3.805277e+06 1.442081e+06 2.073005e+06 2.578226e+06 4.236098e+06 4.671798e+06 2.833748e+06 4.384726e+06 2.980877e+06 4.807069e+06 4.341740e+06 5.299451e+06 2.632670e+06 4.873266e+06 3.769110e+06 3.507887e+06 4.958519e+06 2.377978e+06 4.527867e+06 4.482438e+06 4.177034e+06 3.439732e+06 5.027519e+06 7.682373e+05 2.241170e+06 2.959475e+06 5.717493e+06 4.446284e+06 3.150668e+06 3.992303e+06 3.300248e+06 4.242650e+06 3.566658e+06 3.063316e+06 3.906255e+06 1.910967e+06 2.230128e+06 1.653854e+06 4.583799e+06 2.798608e+06 3.054974e+06 4.654614e+06 1.959101e+06 3.233733e+06 3.264093e+06 4.195487e+06 1.179233e+05 3.324413e+06 3.414572e+06 2.613081e+06 3.479006e+06 5.662687e+06 4.750845e+06 3.953756e+06 3.665177e+06 1.556390e+06 7.450033e+06 5.019765e+06 2.254073e+06 2.764526e+06 3.661018e+06 4.175799e+06 4.292303e+06 6.929938e+06 6.101064e+06 4.126526e+06 4.849970e+06 4.178122e+06 3.883656e+06 3.214313e+06 4.005901e+06 4.871747e+06 5.574464e+06 5.825607e+06 3.546866e+06 3.539881e+06 4.126172e+06 2.281428e+06 2.442625e+06 3.359818e+06 2.674279e+06 2.101549e+06 2.209063e+06 2.354463e+06 2.762981e+06 3.605805e+06 2.653355e+06 2.386343e+06 2.672905e+06 4.207571e+06 3.923345e+06 4.857295e+06 5.068655e+06 4.032929e+06 5.470566e+06 6.372791e+06 4.296790e+06 5.606141e+06 3.778881e+06 6.233760e+06 4.736666e+06 5.088837e+06 3.561012e+06 5.722969e+06 3.469330e+06 4.870257e+06 6.885395e+06 4.558126e+06 2.108641e+06 5.568895e+06 3.984968e+06 2.867909e+06 3.818499e+06 4.805762e+06 4.342903e+06 5.173189e+06 5.546371e+06 2.464521e+06 4.922994e+06 4.879464e+06 4.500995e+06 4.412480e+06 3.122024e+06 6.545405e+06 5.234833e+06 4.056279e+06 5.299724e+06 3.679866e+06 5.803436e+06 6.464146e+06 6.089062e+06 5.247754e+06 5.261092e+06 7.591797e+06 5.612196e+06 5.811895e+06 4.627025e+06 3.325345e+06 5.558033e+06 6.311716e+06 6.839569e+06 4.966430e+06 4.317946e+06 6.585923e+06 5.495697e+06 6.148266e+06 5.666212e+06 5.365603e+06 4.567656e+06 6.044978e+06 4.881893e+06 6.891565e+06 4.550831e+06 5.519841e+06 3.029379e+06 3.724455e+06 4.303147e+06 4.271606e+06 5.243405e+06 2.653454e+06 2.941875e+06 3.463966e+06 3.246889e+06 3.621853e+06 6.140985e+06 4.323919e+06 3.971955e+06 3.389370e+06 3.063313e+06 8.403960e+06 1.611975e+06 2.158223e+06 1.580667e+06 4.070278e+06 5.613850e+06 4.133668e+06 4.715758e+06 C18 H6 N6 O_1.831 1.112561e+05 1.993266e+06 1.987904e+06 2.040409e+06 1.499548e+05 1.575668e+06 2.634679e+06 2.190030e+06 90365.21 2.212235e+06 1.672989e+06 1.640579e+06 88020.04 2.437380e+06 2.602942e+06 2.054170e+06 8.771363e+04 1.648486e+06 1.871576e+06 1.747001e+06 1.590936e+05 2.537339e+06 2.595227e+06 1.904794e+06 115723.694 1.539629e+06 2.254677e+06 2.431238e+06 1.099842e+05 1.746373e+06 1.884737e+06 1.866704e+06 121696.43 2.211230e+06 2.216088e+06 2.211870e+06 1.162166e+05 2.156490e+06 1.798204e+06 2.014273e+06 9.845309e+04 2.346925e+06 1.578116e+06 2.357791e+06 5.740726e+04 2.158006e+06 2.221253e+06 1.831019e+06 1.740270e+06 1.819009e+06 1.816605e+06 1.838501e+06 1.556913e+06 1.829593e+06 2.061124e+06 1.346196e+06 1.777651e+06 1.955470e+06 1.558554e+06 2.641600e+06 1.730519e+06 1.845916e+06 2.230932e+06 1.975873e+06 2.070630e+06 1.256435e+06 1.747076e+06 2.172388e+06 1.981227e+06 1.922037e+06 2.075873e+06 1.792741e+06 2.243347e+06 2.376065e+06 2.159950e+06 1.762363e+06 1.671155e+06 2.619281e+06 2.274903e+06 2.004405e+06 2.128537e+06 1.656513e+06 1.951507e+06 1.823706e+06 1.711550e+06 1.939247e+06 1.682313e+06 1.694957e+06 2.667949e+06 2.471295e+06 1.742638e+06 1.540134e+06 2.631797e+06 1.844372e+06 1.760048e+06 1.982841e+06 1.721556e+06 2.190020e+06 1.979694e+06 1.394209e+06 2.003139e+06 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1.754455e+06 1.770505e+06 1.959444e+06 2.412835e+06 2.014972e+06 1.923521e+06 1.944279e+06 2.357131e+06 2.381927e+06 2.066008e+06 2.374308e+06 1.727476e+06 1.907964e+06 2.600992e+06 2.042351e+06 2.245205e+06 1.657200e+06 2.401828e+06 1.268454e+06 2.149360e+06 1.666871e+06 1.879796e+06 1.219582e+06 1.723536e+06 1.940508e+06 2.528980e+06 2.559276e+06 2.449081e+06 2.836076e+06 2.739551e+06 2.198109e+06 1.977204e+06 2.589518e+06 2.676012e+06 2.117941e+06 2.306245e+06 2.569334e+06 1.905157e+06 1.550085e+06 1.693354e+06 2.208845e+06 2.194871e+06 2.215119e+06 1.907782e+06 2.238354e+06 2.214140e+06 2.313936e+06 2.044942e+06 1.916393e+06 1.896410e+06 2.388438e+06 3.287138e+06 2.700633e+06 1.814318e+06 1.767488e+06 1.995340e+06 2.808047e+06 1.960760e+06 3.350000e+06 1.784842e+06 2.148073e+06 2.547383e+06 3.360701e+06 1.818545e+06 2.320893e+06 2.477971e+06 2.671192e+06 1.850269e+06 1.930433e+06 1.573978e+06 1.818095e+06 2.175609e+06 1.711501e+06 1.894133e+06 2.088810e+06 1.993059e+06 2.728385e+06 1.547853e+06 1.927955e+06 1.460993e+06 1.830518e+06 1.861887e+06 1.826496e+06 1.830397e+06 C9 H24 N9 O2 P_1.832 4.246215e+04 1.452658e+06 1.375692e+06 1.341332e+06 4.780783e+04 6.836450e+05 1.229429e+06 1.251968e+06 42967.27 1.367516e+06 1.360001e+06 1.362029e+06 51146.35 1.096021e+06 1.099103e+06 1.183578e+06 5.670993e+04 1.377413e+06 1.152501e+06 1.482363e+06 1.049841e+05 9.816839e+05 1.270005e+06 1.355219e+06 71027.085 1.193237e+06 1.209457e+06 9.785025e+05 6.066962e+04 1.742434e+06 1.100805e+06 1.445372e+06 87025.41 8.668717e+05 1.344998e+06 1.261570e+06 1.036077e+05 1.187580e+06 1.364948e+06 1.177893e+06 7.786473e+04 1.172838e+06 1.168332e+06 1.403292e+06 3.917847e+04 1.187637e+06 1.338541e+06 1.167997e+06 5.933734e+05 9.102360e+05 7.178751e+05 1.266018e+06 8.258289e+05 1.046256e+06 1.101616e+06 3.630966e+05 1.236716e+06 1.092859e+06 1.420476e+06 1.054425e+06 1.638373e+06 1.227285e+06 1.277740e+06 1.644538e+06 1.236789e+06 6.980397e+05 1.467080e+06 1.319596e+06 1.493447e+06 1.340308e+06 1.910697e+06 2.008806e+06 1.727170e+06 1.898019e+06 9.804242e+05 1.380630e+06 1.503780e+06 1.573167e+06 1.023827e+05 1.380025e+06 1.308770e+06 1.082860e+06 8.659923e+05 1.143839e+06 9.077874e+05 1.129148e+06 7.689162e+05 6.689525e+05 9.313663e+05 1.243823e+06 1.390313e+06 1.377985e+06 1.341484e+06 1.128890e+06 1.619920e+06 1.243087e+06 1.653669e+06 1.088235e+06 1.499386e+06 1.167230e+06 1.135221e+06 1.462616e+06 9.908044e+05 1.536734e+06 1.408415e+06 1.297583e+06 1.011244e+06 1.403545e+06 2.677824e+05 8.135347e+05 9.788078e+05 1.691996e+06 1.129679e+06 1.041603e+06 1.213655e+06 1.148890e+06 1.225078e+06 1.421472e+06 9.620077e+05 9.962160e+05 7.143708e+05 7.252437e+05 6.577359e+05 1.501856e+06 1.028953e+06 1.173753e+06 1.395963e+06 6.019038e+05 1.140386e+06 9.508776e+05 1.608627e+06 1.089661e+05 1.595259e+06 8.443019e+05 9.275107e+05 1.461552e+06 1.865813e+06 1.425790e+06 1.381147e+06 1.313018e+06 6.385465e+05 2.295702e+06 1.802156e+06 5.566573e+05 1.000983e+06 1.217159e+06 1.500143e+06 1.301443e+06 2.331184e+06 1.785310e+06 1.453514e+06 1.358412e+06 1.345296e+06 1.283267e+06 1.074497e+06 1.239737e+06 1.543723e+06 1.577633e+06 1.706750e+06 1.380784e+06 1.083121e+06 1.324850e+06 6.876588e+05 7.641397e+05 9.146991e+05 9.222648e+05 7.404628e+05 7.598267e+05 1.178799e+06 8.583070e+05 1.307985e+06 9.484147e+05 6.693810e+05 7.437572e+05 1.325381e+06 1.206936e+06 1.420668e+06 1.724305e+06 1.425271e+06 1.525605e+06 1.318096e+06 1.562614e+06 2.116985e+06 8.698703e+05 1.946592e+06 1.659100e+06 1.799139e+06 1.221095e+06 1.304145e+06 1.533470e+06 7.031765e+05 2.417008e+06 1.174295e+06 1.599047e+06 1.786915e+06 1.227900e+06 1.191079e+06 1.195267e+06 1.353474e+06 9.080016e+05 9.572233e+05 1.304633e+06 8.907867e+05 1.620911e+06 2.009865e+06 1.417488e+06 1.871884e+06 1.072236e+06 2.350166e+06 1.451497e+06 1.426956e+06 1.867999e+06 1.361892e+06 2.121692e+06 1.690452e+06 2.020287e+06 1.269167e+06 1.795234e+06 2.428396e+06 1.932902e+06 1.908837e+06 1.625823e+06 9.613514e+05 1.929131e+06 2.170314e+06 2.309431e+06 2.303728e+06 2.087759e+06 2.082937e+06 1.765555e+06 1.731149e+06 1.960032e+06 1.722200e+06 1.508323e+06 1.860058e+06 1.863942e+06 2.026768e+06 1.756112e+06 2.013506e+06 9.617909e+05 1.372265e+06 1.435021e+06 1.267550e+06 1.655396e+06 1.041780e+06 1.048860e+06 9.072090e+05 9.050473e+05 1.172487e+06 1.712051e+06 1.268573e+06 1.087663e+06 1.294386e+06 1.099226e+06 2.560431e+06 6.229909e+05 6.145794e+05 6.034050e+05 1.414965e+06 1.555040e+06 1.281632e+06 1.462222e+06 C17 H30 N3 P S_1.834 1.942267e+04 3.014181e+05 4.136926e+05 4.235884e+05 3.360600e+04 1.169823e+05 2.926291e+05 2.903690e+05 39969.04 3.070107e+05 2.217565e+05 4.778492e+05 47125.67 2.745055e+05 2.400565e+05 4.195787e+05 5.348885e+04 3.314311e+05 2.887842e+05 3.692118e+05 1.255150e+05 1.618342e+05 2.853767e+05 2.360856e+05 86675.370 4.570528e+05 3.047210e+05 1.583171e+05 6.023370e+04 3.095401e+05 4.869923e+05 3.521997e+05 70259.08 1.120043e+05 2.052516e+05 3.857122e+05 8.739815e+04 1.762206e+05 3.240814e+05 3.251866e+05 5.680137e+04 2.797589e+05 3.711478e+05 4.320762e+05 3.230222e+04 1.159371e+05 3.910306e+05 2.718553e+05 1.230379e+05 2.662770e+05 1.421472e+05 2.250923e+05 1.570693e+05 1.974505e+05 1.331496e+05 1.296962e+05 3.903836e+05 1.354828e+05 1.286762e+05 1.322657e+05 1.299726e+05 1.241203e+05 1.766540e+05 1.998550e+05 1.130437e+05 1.093609e+06 1.142255e+05 1.049737e+05 1.935611e+05 1.264483e+05 1.079174e+05 1.672902e+05 1.585638e+05 1.728029e+05 7.234040e+05 2.897083e+05 1.403659e+06 8.512349e+05 1.105989e+05 1.374872e+06 5.021775e+05 5.494317e+05 6.152458e+05 5.211695e+05 5.446159e+05 1.211759e+06 1.093568e+06 9.225900e+04 6.422072e+05 7.572527e+05 5.378319e+05 9.833719e+05 1.216268e+05 8.832584e+04 1.144305e+05 1.596148e+05 1.359025e+05 9.149919e+04 1.097139e+05 8.903663e+04 9.414034e+04 1.136040e+05 9.663796e+04 2.447172e+05 1.106056e+05 1.701862e+05 9.952064e+04 1.134431e+05 9.297248e+04 1.038098e+05 1.466275e+05 1.404752e+05 1.290843e+05 9.430286e+04 8.930091e+04 7.187568e+04 1.200701e+05 9.220736e+04 1.287082e+05 2.996382e+05 9.903377e+04 9.436495e+04 7.684008e+04 1.055361e+05 1.002752e+05 1.032748e+05 1.238618e+05 1.020666e+05 7.624939e+04 7.928048e+04 1.184507e+05 9.221351e+04 2.009298e+05 2.112359e+05 8.832936e+04 1.362038e+05 1.794219e+05 1.272951e+05 1.287577e+05 3.237735e+05 1.081528e+05 1.993005e+05 1.535743e+05 1.374629e+05 8.730877e+04 9.063042e+04 3.678302e+05 1.480032e+05 2.518370e+05 3.886440e+05 1.920739e+05 5.234915e+05 3.785533e+05 1.630156e+05 1.013007e+05 1.350189e+05 1.954191e+05 2.200691e+05 1.356441e+05 1.015044e+05 1.525042e+05 8.772461e+04 1.139306e+05 3.077903e+05 8.512256e+05 3.283972e+05 1.044797e+05 3.685277e+05 2.420800e+05 2.049544e+05 6.254532e+05 2.761585e+05 1.628901e+05 1.877105e+05 4.268042e+05 3.984680e+05 8.631893e+04 1.953051e+05 9.629754e+04 1.065662e+05 6.045320e+05 5.641801e+05 1.846231e+05 8.507563e+05 1.685821e+05 2.289546e+05 3.027045e+05 2.024077e+05 4.305204e+05 8.496246e+05 1.584879e+06 3.975747e+05 2.057389e+05 1.248723e+05 1.449789e+06 1.781719e+05 7.055251e+05 1.786815e+06 6.691847e+05 1.758493e+06 8.537356e+05 2.039468e+06 1.696537e+05 5.546650e+05 8.125748e+05 1.043845e+06 4.320840e+05 9.209954e+04 1.670389e+06 8.236485e+05 1.343222e+05 2.463394e+05 6.157338e+05 1.271615e+06 1.622785e+05 8.693499e+05 3.138586e+06 5.450006e+05 5.745826e+05 6.964602e+05 7.997528e+05 5.798753e+05 1.588998e+05 3.184658e+05 5.168984e+05 3.356597e+05 3.700818e+05 2.566768e+05 2.656792e+05 1.237952e+05 1.661429e+05 8.890261e+05 2.810447e+05 1.320510e+05 1.900412e+05 4.275810e+05 9.250248e+05 1.281014e+05 1.479022e+05 2.168744e+05 1.602461e+06 2.459706e+05 1.392896e+05 3.347491e+05 3.206098e+05 1.525719e+05 1.090301e+05 1.305212e+05 3.199191e+05 4.795288e+05 5.494212e+05 2.744782e+05 1.058052e+05 2.074379e+05 7.140658e+05 2.232610e+05 3.080364e+05 2.469586e+05 3.386517e+05 2.067999e+06 2.775952e+05 2.854976e+05 C10 H14_1.835 3.000222e+05 5.644925e+05 5.715990e+05 7.843510e+05 5.670748e+04 3.392524e+05 5.868139e+05 6.448134e+05 84535.43 5.458559e+05 5.881788e+05 6.708019e+05 53655.69 5.273023e+05 4.850488e+05 6.506775e+05 5.993455e+04 5.840576e+05 5.951276e+05 6.495437e+05 1.235991e+05 3.726253e+05 6.008767e+05 8.365344e+05 91872.106 4.858984e+05 3.792980e+05 6.605175e+05 8.916731e+04 4.941963e+05 5.881179e+05 8.061675e+05 103788.87 5.331026e+05 4.873790e+05 6.456267e+05 1.325730e+05 4.437458e+05 6.477537e+05 5.986831e+05 1.143959e+05 4.476785e+05 7.235048e+05 6.953844e+05 4.112973e+04 3.353182e+05 6.026491e+05 6.137952e+05 5.352747e+05 2.215576e+05 2.428139e+05 6.609766e+05 8.111982e+05 3.643738e+05 4.393655e+05 6.805389e+05 4.097218e+05 7.162923e+05 9.857059e+05 5.163620e+05 3.735342e+05 2.000990e+05 6.742323e+05 3.383639e+05 2.713489e+05 8.573169e+05 4.575038e+05 6.846471e+05 1.702245e+05 3.405000e+05 4.568812e+05 4.714924e+05 6.321921e+05 5.467777e+05 8.299219e+05 4.870777e+05 3.484412e+05 2.603249e+06 6.608213e+05 1.035634e+06 4.427238e+05 1.107025e+06 8.970237e+05 1.124196e+06 7.094661e+05 1.471104e+06 1.327479e+05 2.376271e+05 4.331092e+05 6.569829e+05 1.424406e+05 3.350974e+05 5.196584e+05 2.735567e+05 1.142151e+06 3.861597e+05 4.903209e+05 1.044057e+06 1.187298e+05 3.977753e+05 7.480247e+05 3.219582e+05 1.399094e+06 5.985837e+05 2.011387e+05 2.201622e+05 2.035054e+05 4.705022e+05 1.564282e+05 1.734280e+05 1.174104e+05 5.939747e+05 5.171510e+05 5.591192e+06 1.180741e+06 5.284218e+05 3.106470e+05 5.139060e+05 1.196149e+06 4.171538e+05 4.436117e+05 1.308990e+05 2.354946e+05 5.615513e+05 4.796316e+05 9.648702e+05 4.802248e+05 3.380403e+05 3.023640e+05 4.042250e+05 5.955790e+05 2.689072e+05 1.537250e+05 2.888363e+05 2.920136e+05 4.258255e+05 5.174238e+05 3.376409e+05 7.587195e+05 2.679433e+05 1.229368e+06 7.761278e+05 2.271484e+05 3.447187e+05 1.618226e+05 1.443417e+05 5.319664e+05 4.315427e+05 3.123661e+05 1.663476e+05 3.589909e+05 1.522046e+05 2.269904e+05 6.829474e+05 8.580219e+05 4.304918e+05 5.147986e+05 1.103744e+06 8.293250e+05 2.303817e+05 2.815660e+05 3.796081e+05 3.590393e+05 4.842092e+05 3.132947e+05 1.072233e+06 5.354600e+05 4.367229e+05 8.074225e+05 7.671619e+05 1.748513e+06 8.054498e+05 1.664794e+05 9.312462e+05 2.794482e+05 4.510539e+05 3.213826e+05 1.280510e+06 7.193771e+05 7.762265e+05 5.664475e+05 3.251962e+05 3.690482e+05 8.721461e+05 6.837998e+05 6.543037e+05 7.357370e+05 7.087573e+05 6.693794e+05 1.005745e+06 3.296748e+05 4.221366e+05 6.157118e+05 7.394675e+05 2.169310e+05 4.757517e+05 1.930839e+05 9.644493e+05 2.858734e+05 6.538975e+05 6.060962e+05 4.302826e+05 1.431104e+05 3.768521e+05 6.682667e+05 4.907429e+05 1.090272e+06 3.827000e+05 7.481304e+05 1.551480e+05 6.022975e+05 8.263635e+05 9.353241e+05 4.962930e+05 7.581599e+05 1.537109e+05 2.493652e+05 8.212008e+05 2.079445e+05 4.237710e+05 4.965728e+05 2.863118e+05 4.767978e+05 3.493566e+05 1.285740e+06 1.765600e+05 2.062025e+05 1.001143e+06 4.901960e+05 3.377803e+05 6.003775e+05 2.057549e+05 1.139951e+06 2.716178e+05 1.916682e+05 7.516023e+05 2.623340e+05 1.611958e+06 1.503731e+06 7.417880e+05 4.154370e+05 6.046675e+05 5.001058e+05 9.904655e+05 1.089722e+05 5.755570e+05 7.624961e+05 3.210928e+05 9.491320e+05 5.581444e+05 3.499636e+05 8.119377e+05 1.733755e+06 1.156057e+05 3.305225e+05 1.711328e+06 7.228606e+04 1.039664e+06 8.065374e+05 7.366096e+05 8.156971e+05 3.560805e+05 C10 H3 N8 O P3 S_1.835 3.569652e+04 3.225333e+05 3.158068e+05 3.508854e+05 5.613202e+04 1.255542e+05 3.231783e+05 3.111017e+05 42324.30 3.873206e+05 3.481083e+05 3.654833e+05 46317.29 3.451944e+05 2.902313e+05 3.499888e+05 5.110595e+04 3.207705e+05 3.270692e+05 3.549080e+05 9.544005e+04 2.865811e+05 3.687594e+05 3.523453e+05 65381.051 3.435567e+05 2.980819e+05 3.307063e+05 5.742498e+04 3.693112e+05 3.809132e+05 4.228463e+05 85586.41 1.708600e+05 3.704323e+05 2.976412e+05 1.099061e+05 3.646114e+05 3.898374e+05 2.290615e+05 7.422873e+04 2.430458e+05 4.248712e+05 5.140008e+05 3.655757e+04 2.060564e+05 4.075557e+05 2.587547e+05 1.368132e+05 2.324935e+05 2.637630e+05 3.971433e+05 1.971315e+05 1.163711e+06 2.183488e+05 2.016693e+05 1.110837e+05 2.918524e+05 3.328989e+05 9.860751e+04 6.636960e+05 4.494555e+05 1.451582e+06 3.238233e+05 6.661918e+05 1.176116e+05 7.200880e+05 6.949051e+05 4.109032e+05 1.140734e+06 1.742749e+06 1.173315e+06 1.052296e+06 1.184071e+06 1.456531e+05 1.372337e+05 2.416973e+05 1.464565e+05 7.522816e+04 1.244057e+05 7.890712e+04 2.718838e+05 1.948036e+05 1.512125e+05 8.329889e+04 2.494887e+05 1.555827e+05 7.367716e+04 5.104159e+05 3.025469e+05 1.759530e+06 4.614278e+05 1.338110e+05 8.118812e+05 6.329561e+05 1.190413e+05 2.152620e+06 1.161944e+05 7.452700e+05 2.717593e+05 1.064505e+06 7.839972e+05 7.486948e+04 1.388678e+06 1.613822e+05 2.487985e+06 1.651845e+06 2.456895e+06 7.152200e+04 9.980999e+04 9.798482e+04 5.562565e+05 1.375527e+06 1.193632e+05 8.740154e+04 1.002961e+05 9.087453e+04 1.215647e+05 1.116913e+05 1.203150e+05 1.250041e+05 1.160715e+05 9.090686e+04 1.392974e+05 9.614983e+04 1.266358e+05 9.077892e+04 1.132837e+05 9.066563e+04 7.764975e+04 9.802873e+04 1.150603e+05 1.029098e+05 9.100147e+04 6.067934e+05 1.269995e+05 1.222023e+05 8.999331e+04 1.019098e+05 1.156218e+05 1.019459e+05 1.384061e+05 9.884441e+04 8.227935e+04 8.568586e+04 1.043928e+05 1.210604e+05 9.861035e+04 1.138071e+05 1.572862e+05 8.572248e+04 1.485293e+05 2.550411e+05 1.361815e+05 1.512280e+05 8.473990e+04 2.641473e+05 7.436655e+05 9.044578e+05 1.399291e+05 1.198672e+05 5.528933e+05 1.173302e+05 1.494529e+05 5.662189e+05 1.270031e+05 2.088278e+05 9.949986e+04 1.599594e+05 1.146248e+05 2.806613e+05 7.260957e+04 2.515027e+05 8.323658e+05 1.634537e+06 4.538130e+05 6.555799e+05 9.452336e+05 1.070576e+06 7.117442e+05 1.902152e+06 5.402190e+05 6.424425e+05 6.328524e+06 2.721983e+05 1.613612e+05 1.862553e+05 2.942014e+05 1.384371e+07 2.342572e+05 7.512027e+06 1.532252e+05 2.122139e+05 3.799488e+05 1.433873e+06 9.945060e+04 1.014646e+07 5.093416e+06 9.659961e+04 6.654712e+06 7.731808e+06 5.691712e+06 1.367589e+05 1.668617e+05 2.596276e+05 2.088041e+05 2.759899e+05 1.020283e+05 4.868580e+05 1.579636e+05 1.342833e+05 3.075927e+05 1.310849e+05 4.956048e+05 6.181881e+05 6.383998e+05 1.314202e+07 1.647506e+05 8.097132e+05 1.639667e+05 8.795590e+05 3.398158e+05 1.128327e+05 1.370011e+05 9.911966e+04 9.729856e+05 4.174754e+05 1.563135e+05 1.188015e+05 3.770546e+05 1.193099e+05 5.644587e+05 1.320711e+05 1.574293e+05 4.075910e+05 3.927007e+05 7.435906e+05 1.582896e+05 5.463194e+05 9.691268e+04 3.108745e+05 6.735461e+05 9.507513e+05 1.074411e+06 7.450495e+05 4.751943e+05 1.256483e+06 8.212416e+05 1.997502e+05 2.202884e+06 2.528250e+05 9.477819e+04 5.540142e+05 1.183681e+05 9.666931e+05 6.966001e+04 8.745468e+04 1.339213e+05 1.300762e+05 2.620244e+05 1.105170e+06 1.349878e+06 Isobutylparaben_1.835 7.986685e+05 2.774516e+07 2.632603e+07 2.213684e+07 7.994104e+05 8.958690e+06 2.315584e+07 2.402624e+07 141612.40 2.341947e+07 2.113529e+07 2.569056e+07 640634.67 1.818678e+07 2.170773e+07 2.396404e+07 7.941328e+05 2.337664e+07 1.888144e+07 2.341393e+07 3.011377e+05 1.924748e+07 2.418752e+07 2.593235e+07 219172.502 2.048062e+07 2.014364e+07 2.190752e+07 5.686445e+05 2.146350e+07 2.181325e+07 2.736996e+07 305480.48 1.949102e+07 2.518661e+07 1.445888e+07 3.723641e+05 2.302371e+07 2.723076e+07 1.461537e+07 2.429342e+05 2.000164e+07 2.399860e+07 2.928212e+07 1.118494e+05 2.048903e+07 2.573072e+07 1.676270e+07 2.786513e+07 3.647064e+07 2.019134e+07 4.257878e+07 1.748317e+07 3.467920e+07 2.065305e+07 3.224760e+07 2.937793e+07 2.642001e+07 2.033151e+07 3.717139e+07 3.318393e+07 2.353732e+07 2.646307e+07 3.608078e+07 3.260478e+07 1.167130e+07 2.736599e+07 2.342879e+07 2.510289e+07 2.217586e+07 3.520911e+07 3.006215e+07 3.491293e+07 3.934895e+07 1.009617e+07 2.200195e+07 1.073944e+07 2.020310e+07 3.831708e+06 2.674522e+07 1.926847e+07 2.188440e+07 1.716968e+07 1.267493e+07 1.269735e+07 1.846477e+07 5.895991e+06 9.674521e+06 7.571288e+06 1.406760e+07 4.121993e+07 1.681672e+07 3.930758e+07 2.362950e+07 3.608665e+07 3.544304e+07 3.626082e+07 1.695314e+07 2.232039e+07 2.474087e+07 2.298966e+07 2.804500e+07 7.660777e+06 2.964127e+07 3.519712e+07 2.538881e+07 2.902125e+07 2.546847e+07 8.555969e+06 1.492500e+07 1.743241e+07 3.358443e+07 2.454084e+07 1.919670e+07 1.861616e+07 7.056401e+06 2.650238e+07 1.944703e+07 8.549647e+06 2.204117e+07 1.273111e+07 1.045822e+07 4.661185e+06 1.742677e+07 1.055752e+07 1.652436e+07 2.629467e+07 6.055690e+06 1.382962e+07 1.585863e+07 2.319112e+07 1.462906e+06 9.395171e+06 1.749996e+07 1.808707e+07 1.613572e+07 1.872399e+07 2.146535e+07 1.782577e+07 2.140165e+07 1.229565e+07 2.969331e+07 2.309161e+07 1.461420e+07 1.906744e+07 1.492104e+07 1.381380e+07 1.849011e+07 2.172046e+07 3.132719e+07 1.875739e+07 1.904663e+07 1.682809e+07 3.166900e+07 1.966280e+07 2.337952e+07 3.877485e+07 3.470873e+07 3.494715e+07 1.676231e+07 1.151947e+07 2.313965e+07 3.275794e+07 3.064638e+07 5.625517e+07 2.824124e+07 3.364309e+07 3.520771e+07 3.456012e+07 3.642096e+07 3.399944e+07 2.395075e+07 3.602546e+07 3.692138e+07 3.651978e+07 3.244131e+07 3.059319e+07 2.570201e+07 2.427063e+07 2.529247e+07 6.199298e+07 9.774077e+06 1.659824e+07 4.467549e+07 1.793247e+07 2.815762e+07 9.493025e+06 7.619023e+06 4.842913e+07 1.330664e+07 4.687211e+07 9.038397e+06 7.622077e+06 2.487564e+07 1.129916e+08 2.011343e+07 5.241753e+07 5.982103e+07 9.358456e+06 3.873794e+07 4.710564e+07 4.776445e+07 1.350704e+07 2.020566e+07 1.011931e+07 1.600762e+07 2.064372e+07 6.589140e+06 1.525002e+07 9.517249e+06 1.006820e+07 1.882369e+07 7.796340e+06 1.262951e+07 1.781700e+07 1.358424e+07 2.592225e+07 3.019840e+07 2.760280e+07 1.089971e+07 1.395130e+07 8.621112e+06 7.673403e+06 1.015497e+07 2.435056e+07 2.140319e+07 1.500784e+07 1.031223e+07 2.640611e+07 1.705304e+07 1.122463e+07 2.521089e+07 9.260133e+06 1.537305e+07 2.284297e+07 8.231448e+06 9.303463e+06 7.239673e+06 2.063863e+07 2.284042e+07 3.030299e+07 6.431159e+06 7.891752e+06 6.633756e+06 4.482320e+06 1.394139e+07 7.326406e+06 7.765151e+06 5.336371e+06 1.589987e+07 5.596417e+06 3.441745e+07 8.291463e+06 2.167178e+07 1.303723e+07 1.716297e+07 1.935562e+07 3.153296e+07 1.626735e+07 6.058291e+06 5.643359e+06 9.029111e+06 C15 H39 N7 O S2_1.835 3.680039e+04 1.688572e+06 1.875004e+06 1.662181e+06 5.774631e+04 9.745243e+05 1.721789e+06 1.899405e+06 43911.25 1.249898e+06 1.913193e+06 1.843263e+06 48702.53 1.508999e+06 1.299163e+06 1.691257e+06 5.513108e+04 1.605587e+06 1.408722e+06 1.932479e+06 1.062652e+05 1.457611e+06 1.581650e+06 1.429818e+06 76572.391 1.903307e+06 1.789042e+06 1.321162e+06 6.807766e+04 1.599156e+06 1.547054e+06 1.855658e+06 83632.46 1.408690e+06 1.652772e+06 1.538083e+06 8.621094e+04 1.596929e+06 1.806390e+06 1.252252e+06 5.676780e+04 1.829230e+06 1.521718e+06 1.523604e+06 3.161120e+04 2.086049e+06 1.348088e+06 1.602673e+06 1.208001e+06 1.692439e+06 3.689061e+05 4.895241e+05 2.862679e+05 1.327230e+06 4.963913e+05 1.268465e+05 4.894331e+05 3.825534e+05 5.421125e+05 1.568197e+06 7.028040e+05 3.886682e+05 5.195417e+05 5.393545e+05 5.317472e+05 1.148817e+06 1.535414e+06 5.010157e+05 5.878867e+05 5.535823e+05 9.247254e+05 6.792237e+05 6.929800e+05 9.339230e+05 1.534504e+06 1.270734e+06 1.578659e+06 2.009876e+06 8.177755e+05 1.419420e+06 1.373891e+06 1.468051e+06 1.156127e+06 1.654164e+06 1.024339e+06 1.193826e+06 7.790416e+05 6.922903e+05 1.569552e+06 1.300852e+06 1.863694e+06 1.447604e+06 1.125951e+06 1.053790e+06 8.881465e+05 9.444230e+05 1.472234e+06 1.337094e+06 9.695638e+05 9.063917e+05 9.478084e+05 1.652359e+06 8.775632e+05 1.298367e+06 1.224118e+06 1.594125e+06 8.682628e+05 1.426389e+06 8.926655e+05 1.483249e+06 1.657659e+06 2.020866e+06 1.428385e+06 1.836442e+06 2.001067e+06 1.147801e+06 2.980840e+06 1.734895e+06 1.523708e+06 2.037238e+06 7.624790e+05 9.782813e+05 6.743129e+05 2.678655e+06 1.313171e+06 1.672619e+06 2.908346e+06 1.166768e+06 1.539423e+06 1.992319e+06 2.043666e+06 4.149079e+05 1.494344e+06 1.670341e+06 1.508123e+06 1.940186e+06 1.521271e+06 2.240309e+06 2.090983e+06 1.907400e+06 2.167855e+05 2.994152e+06 2.500120e+06 1.671557e+05 2.518857e+05 4.879196e+05 4.656681e+05 4.984769e+05 7.158981e+05 7.327135e+05 7.238188e+05 9.534011e+05 7.205747e+05 1.178725e+06 9.899178e+05 9.375840e+05 2.064713e+06 2.561948e+06 2.757673e+06 1.186268e+06 1.516856e+06 1.239693e+06 9.541819e+05 5.802361e+05 1.536975e+06 9.751287e+05 9.834822e+05 8.980374e+05 8.023506e+05 9.118520e+05 1.324712e+06 1.093895e+06 1.500557e+06 1.290043e+06 1.901249e+06 1.923106e+06 5.595218e+05 6.306118e+05 7.570334e+05 5.953594e+05 2.302757e+06 1.173143e+06 1.761265e+06 2.357455e+06 1.639431e+06 1.185384e+06 1.623709e+06 1.378642e+06 3.974728e+06 1.303694e+06 2.677566e+06 1.263672e+06 3.473579e+05 1.883487e+06 3.134113e+06 9.694434e+05 2.543022e+06 2.590587e+06 1.103352e+06 2.369185e+06 2.727519e+06 3.321390e+06 1.128924e+06 9.201085e+05 1.657349e+06 1.273294e+06 2.174979e+06 5.938609e+05 2.286875e+06 1.800348e+06 1.271738e+06 1.852232e+06 1.124324e+06 1.750619e+06 1.457573e+06 1.655714e+06 2.576314e+06 1.595262e+06 2.668155e+06 1.628667e+06 2.367259e+06 1.281678e+06 8.435006e+05 1.598845e+06 2.541043e+06 2.644913e+06 2.298491e+06 1.793204e+06 1.985256e+06 1.376111e+06 2.330010e+06 2.294189e+06 8.575217e+05 1.576846e+06 3.208019e+06 8.968624e+05 1.321054e+06 1.020203e+06 1.426356e+06 9.948359e+05 2.061907e+06 5.109880e+06 5.658666e+06 6.190340e+06 3.434271e+06 3.519651e+06 5.697089e+06 4.439123e+06 4.783681e+06 7.616859e+06 4.739307e+06 5.083881e+05 4.660295e+06 1.170225e+06 1.094331e+07 4.454585e+05 6.070414e+05 5.520239e+05 8.476968e+05 3.951905e+06 4.805957e+06 5.751916e+06 C10 H16 O_1.836 9.309251e+05 1.193995e+06 1.309592e+06 1.373920e+06 2.897580e+05 6.607659e+05 1.356322e+06 1.222057e+06 474796.01 1.115858e+06 1.171813e+06 1.412174e+06 144370.82 1.118534e+06 1.061323e+06 1.262030e+06 2.513188e+05 1.147898e+06 1.205703e+06 1.251253e+06 2.288312e+05 9.811017e+05 1.105234e+06 1.604931e+06 283539.278 9.868712e+05 9.798987e+05 1.352795e+06 4.131540e+05 9.906032e+05 1.293376e+06 1.580884e+06 331843.49 9.572344e+05 1.057715e+06 1.277223e+06 2.304111e+05 9.790348e+05 1.197226e+06 1.184238e+06 1.489864e+05 1.259698e+06 1.199260e+06 1.464943e+06 1.103424e+05 7.765980e+05 1.268106e+06 1.197784e+06 8.694444e+05 4.057800e+05 4.586277e+05 1.569412e+06 1.740239e+06 6.688884e+05 8.815080e+05 1.016264e+06 6.115524e+05 1.478794e+06 2.386457e+06 9.897549e+05 5.359973e+05 3.512611e+05 1.459182e+06 7.015558e+05 4.826745e+05 1.844321e+06 9.327617e+05 1.289654e+06 3.997412e+05 6.475991e+05 8.283401e+05 7.945484e+05 1.415221e+06 1.023445e+06 1.793311e+06 8.791208e+05 6.885226e+05 6.021314e+06 1.560666e+06 2.105292e+06 8.638395e+05 3.692796e+06 2.540191e+06 2.377443e+06 1.300514e+06 4.593482e+06 3.275604e+05 3.398052e+05 8.440322e+05 1.960250e+06 2.500326e+05 4.734718e+05 9.490019e+05 8.663687e+05 3.950485e+06 6.096081e+05 8.683845e+05 2.733611e+06 5.819431e+05 6.286877e+05 1.988065e+06 5.032294e+05 4.311665e+06 9.395539e+05 6.311753e+05 3.415218e+05 4.307391e+05 1.125106e+06 6.884815e+05 6.826557e+05 2.144246e+05 1.426478e+06 1.072935e+06 1.629269e+07 3.515618e+06 1.318449e+06 6.284865e+05 8.043718e+05 3.080427e+06 9.462798e+05 1.041868e+06 2.570150e+05 7.337705e+05 1.355062e+06 1.160270e+06 2.011809e+06 1.110281e+06 7.607007e+05 5.951797e+05 7.633246e+05 1.275483e+06 5.963008e+05 3.922773e+05 4.700941e+05 7.911137e+05 8.241844e+05 1.284969e+06 5.049175e+05 1.585317e+06 4.154627e+05 3.695957e+06 1.495017e+06 3.990627e+05 5.827953e+05 3.948866e+05 6.417066e+05 1.187334e+06 7.826684e+05 6.650887e+05 5.360671e+05 6.236612e+05 6.474795e+05 3.495517e+05 1.186812e+06 3.038452e+06 8.772530e+05 7.582082e+05 2.449095e+06 1.951436e+06 3.923072e+05 6.811499e+05 8.066847e+05 6.559231e+05 9.349549e+05 4.635562e+05 2.861268e+06 1.419160e+06 8.949885e+05 2.170087e+06 1.707462e+06 5.699265e+06 1.464033e+06 2.913669e+05 3.354078e+06 5.457485e+05 8.683505e+05 6.856375e+05 2.733131e+06 1.616041e+06 1.751646e+06 1.349259e+06 6.336687e+05 6.336210e+05 1.706029e+06 1.255276e+06 1.433913e+06 1.587868e+06 1.568668e+06 1.435045e+06 2.446123e+06 4.797919e+05 7.024515e+05 1.417900e+06 1.518762e+06 4.669619e+05 1.223350e+06 9.737222e+05 1.994079e+06 5.170445e+05 1.707344e+06 1.200091e+06 9.488313e+05 5.876171e+05 7.519226e+05 1.779840e+06 1.036044e+06 2.211316e+06 7.861635e+05 1.733813e+06 3.673378e+05 1.143457e+06 1.260248e+06 1.847615e+06 9.058453e+05 1.939368e+06 5.372792e+05 5.220924e+05 1.826458e+06 5.547390e+05 8.528308e+05 9.441810e+05 5.919253e+05 8.533641e+05 1.035468e+06 3.887864e+06 6.616114e+05 4.818263e+05 2.001471e+06 9.584655e+05 6.053271e+05 1.287787e+06 4.454052e+05 3.385985e+06 6.982061e+05 3.413542e+05 1.704807e+06 4.829105e+05 5.483693e+06 4.016671e+06 1.734178e+06 7.821310e+05 1.320994e+06 8.587626e+05 2.193849e+06 4.735803e+05 1.361957e+06 1.483678e+06 7.760047e+05 3.073255e+06 9.790545e+05 5.599011e+05 1.988847e+06 5.186832e+06 2.031068e+05 5.866780e+05 5.064551e+06 2.349030e+05 3.495062e+06 1.557292e+06 1.509714e+06 1.674375e+06 7.169525e+05 C13 H36 N9 O4 P_1.836 2.900388e+04 4.724138e+05 4.398240e+05 3.006408e+05 4.707739e+04 1.780281e+05 2.922184e+05 3.828329e+05 38068.12 3.822886e+05 3.291045e+05 4.133120e+05 40463.42 3.355593e+05 3.372345e+05 4.675155e+05 4.547801e+04 2.888386e+05 2.880617e+05 2.711709e+05 9.142084e+04 3.451147e+05 3.693594e+05 4.590516e+05 61985.520 3.578859e+05 3.247695e+05 3.031830e+05 5.843556e+04 3.622975e+05 3.905185e+05 2.700152e+05 79533.24 3.291030e+05 4.545771e+05 3.447031e+05 9.414368e+04 3.535373e+05 2.916070e+05 3.747235e+05 6.422305e+04 2.652306e+05 4.216472e+05 3.593620e+05 3.338347e+04 9.430564e+04 4.313301e+05 2.686014e+05 3.670161e+05 2.356760e+05 1.365779e+05 1.736220e+05 1.169906e+05 3.018593e+05 2.004825e+05 1.724865e+05 2.119716e+05 1.033796e+05 1.219283e+05 8.550029e+04 1.504960e+05 1.930329e+05 1.031702e+05 1.359720e+05 2.057508e+05 1.099763e+06 8.858240e+04 1.160161e+05 1.039881e+05 1.074282e+05 1.291663e+05 1.255447e+05 1.246071e+05 1.656506e+05 9.871206e+05 3.552550e+05 9.026368e+05 8.372530e+05 9.824479e+05 1.785099e+06 5.480316e+05 2.999527e+05 4.408730e+05 5.804346e+05 2.623840e+05 1.232609e+06 1.006833e+06 1.302135e+05 8.548401e+05 6.743656e+05 5.031867e+05 1.016402e+06 1.829122e+05 9.020524e+04 1.215392e+05 1.775426e+05 1.172722e+05 1.021639e+05 1.104302e+05 1.027979e+05 7.738502e+04 1.065335e+05 1.164987e+05 1.196040e+05 1.604508e+05 2.524585e+05 1.050150e+05 1.893883e+05 2.058092e+05 9.979322e+04 3.369531e+05 9.701082e+04 1.050718e+05 1.684221e+05 7.694113e+04 8.969149e+04 8.690176e+04 1.019583e+05 1.433188e+05 2.143967e+05 1.387951e+05 9.802710e+04 8.832283e+04 1.092039e+05 1.265749e+05 2.180349e+05 1.775241e+05 1.563508e+05 6.558619e+04 6.824503e+04 2.162422e+05 8.678476e+05 2.396111e+05 2.108755e+05 2.473933e+05 1.079207e+05 1.847737e+05 1.555850e+05 1.335062e+05 2.633915e+05 1.698834e+05 1.478350e+05 1.345723e+05 1.869308e+05 7.602228e+04 1.470512e+05 1.700610e+05 1.614357e+05 1.057952e+05 3.518049e+05 1.294697e+05 5.831920e+05 3.754344e+05 1.236591e+05 7.115116e+04 1.221920e+05 1.230688e+05 9.817649e+04 1.191977e+05 8.699506e+04 1.114518e+05 1.409253e+05 1.524497e+05 2.817004e+05 7.853384e+05 3.793747e+05 1.368789e+05 3.794060e+05 3.064601e+05 1.886610e+05 7.002983e+05 1.165047e+05 1.163474e+05 2.213791e+05 4.963254e+05 3.998510e+05 1.483614e+05 1.693112e+05 7.561835e+04 1.600106e+05 3.035129e+05 1.049540e+06 9.989734e+04 1.285477e+06 1.155493e+05 2.537811e+05 4.016227e+05 2.143067e+05 6.025581e+05 4.687770e+05 1.372649e+06 3.392409e+05 1.532025e+05 2.359064e+05 1.100382e+06 1.992606e+05 5.544781e+05 1.916610e+06 7.746854e+05 1.461895e+06 7.369759e+05 1.503863e+06 1.170549e+05 6.862570e+05 7.614002e+05 2.235513e+05 4.013991e+05 1.692023e+05 1.041041e+06 2.639606e+05 1.544586e+05 1.869328e+05 6.913498e+05 8.889449e+05 1.164947e+05 7.800744e+05 3.543194e+06 2.766580e+05 4.826700e+05 4.631235e+05 5.046524e+05 3.955127e+05 1.157571e+05 1.247966e+05 2.262539e+05 4.865948e+05 1.506748e+05 1.416898e+05 2.267288e+05 1.838875e+05 1.128980e+05 6.934714e+05 4.229179e+05 1.371763e+05 1.377518e+05 5.685429e+05 8.115726e+05 1.429445e+05 1.579160e+05 2.185682e+05 6.301120e+06 1.486937e+05 1.671303e+05 3.482645e+05 2.887310e+05 6.933906e+05 3.092346e+05 1.427805e+05 4.475628e+05 2.723403e+05 6.689985e+05 3.434455e+05 1.553112e+05 2.403528e+05 6.788371e+05 4.756603e+05 6.456327e+05 3.388912e+05 3.400672e+05 2.236821e+05 2.657256e+05 2.377182e+05 Voglibose_1.837 4.222724e+04 4.409496e+06 3.995898e+06 3.837047e+06 6.286152e+04 2.588345e+06 4.125357e+06 3.794545e+06 53563.27 3.773948e+06 4.010291e+06 4.238203e+06 60091.61 3.640600e+06 3.434838e+06 3.754431e+06 1.356636e+05 3.909578e+06 3.698544e+06 4.213164e+06 1.202490e+05 3.178822e+06 3.993449e+06 4.197487e+06 84445.373 3.804182e+06 3.749482e+06 3.872103e+06 8.713594e+04 3.475926e+06 3.633605e+06 4.446892e+06 99746.34 3.530949e+06 4.164030e+06 3.716512e+06 1.153126e+05 3.010472e+06 4.084996e+06 3.651066e+06 7.411143e+04 3.968269e+06 3.547383e+06 4.369793e+06 3.781173e+04 3.471016e+06 4.612271e+06 3.145717e+06 1.824656e+06 2.655407e+06 2.129827e+06 3.731922e+06 2.477850e+06 3.096319e+06 2.830643e+06 2.107963e+06 3.188343e+06 3.257772e+06 4.463844e+06 3.214963e+06 5.862503e+06 2.915917e+06 3.710157e+06 4.493101e+06 4.148264e+06 4.061009e+06 3.768209e+06 4.080717e+06 4.338008e+06 3.947304e+06 5.026227e+06 5.452284e+06 4.232282e+06 5.686403e+06 4.131764e+06 4.330488e+06 5.021672e+06 4.253712e+06 3.258732e+05 2.824001e+06 4.122759e+06 3.297886e+06 2.863228e+06 3.910486e+06 3.166444e+06 2.640910e+06 3.404627e+06 2.008052e+06 4.201221e+06 4.442246e+06 4.863101e+06 4.825049e+06 3.833368e+06 3.398076e+06 5.288533e+06 3.679466e+06 4.571177e+06 2.825249e+06 3.919283e+06 3.670970e+06 3.070675e+06 4.471110e+06 2.181666e+06 4.167017e+06 4.045088e+06 3.710172e+06 3.007982e+06 4.277725e+06 1.079607e+06 1.972386e+06 3.250644e+06 5.217392e+06 4.452324e+06 2.792123e+06 3.698668e+06 2.979562e+06 3.684776e+06 3.567687e+06 2.766320e+06 3.354845e+06 2.009189e+06 1.913119e+06 1.705071e+06 4.606113e+06 2.618934e+06 2.686866e+06 4.537709e+06 1.534378e+06 2.980296e+06 2.834933e+06 4.310287e+06 1.224765e+05 3.251420e+06 3.562224e+06 2.431214e+06 3.516807e+06 4.679838e+06 4.301457e+06 3.612764e+06 3.395279e+06 1.634294e+06 6.749195e+06 4.423705e+06 1.948973e+06 2.664223e+06 3.331570e+06 4.522717e+06 3.624319e+06 6.440489e+06 5.041470e+06 3.887177e+06 5.390447e+06 4.113925e+06 4.130419e+06 2.806974e+06 3.330477e+06 4.345403e+06 4.464249e+06 4.981834e+06 3.721925e+06 2.777761e+06 3.455246e+06 2.086679e+06 2.326437e+06 4.382376e+06 3.076778e+06 2.273165e+06 2.796050e+06 2.722528e+06 2.180784e+06 4.674226e+06 2.571741e+06 2.384700e+06 2.693934e+06 3.966130e+06 3.941499e+06 4.282262e+06 4.063498e+06 3.682767e+06 5.246992e+06 5.167922e+06 5.597800e+06 5.471164e+06 4.464494e+06 5.887805e+06 5.285831e+06 5.671172e+06 3.111682e+06 4.493629e+06 5.329086e+06 4.736015e+06 6.910436e+06 4.141011e+06 5.208468e+06 6.485526e+06 3.977093e+06 4.138562e+06 7.422599e+06 5.554875e+06 2.866731e+06 4.581819e+06 3.169083e+06 2.557999e+06 5.408492e+06 6.349700e+06 4.507282e+06 6.904855e+06 3.556576e+06 1.058343e+07 5.090834e+06 3.866936e+06 5.446804e+06 4.017622e+06 8.538205e+06 5.661568e+06 8.300233e+06 4.950467e+06 5.764430e+06 8.140068e+06 6.123037e+06 6.915742e+06 5.198516e+06 3.061452e+06 5.211955e+06 6.432247e+06 7.154320e+06 6.638866e+06 5.181927e+06 6.735721e+06 4.955828e+06 5.873383e+06 7.530953e+06 5.220164e+06 4.573470e+06 6.380589e+06 4.737532e+06 7.347014e+06 4.826938e+06 5.494995e+06 2.754891e+06 7.138432e+06 3.744507e+06 4.013559e+06 5.018284e+06 3.202047e+06 2.600925e+06 2.729898e+06 2.761741e+06 3.577434e+06 5.919186e+06 4.176472e+06 3.836767e+06 3.876474e+06 2.841951e+06 8.458953e+06 2.183666e+06 2.439297e+06 1.933843e+06 3.953641e+06 4.854123e+06 3.785727e+06 4.302750e+06 C39 H66 N4 O9_1.838 7.457174e+04 6.389798e+05 5.845452e+05 6.318848e+05 1.142679e+05 3.958189e+05 5.947913e+05 5.867049e+05 92027.35 5.763519e+05 6.341003e+05 6.493807e+05 100278.46 4.835392e+05 4.903665e+05 7.727702e+05 7.167210e+04 5.165698e+05 4.955037e+05 6.835059e+05 1.980579e+05 4.050284e+05 5.850814e+05 6.418204e+05 132944.410 6.493032e+05 5.133485e+05 5.967203e+05 1.224573e+05 4.890238e+05 5.909545e+05 7.597162e+05 140523.51 3.853202e+05 6.618349e+05 6.083198e+05 1.708473e+05 4.436934e+05 7.507874e+05 6.358155e+05 1.303218e+05 3.056542e+05 6.165476e+05 6.447691e+05 6.991551e+04 5.060123e+05 6.563656e+05 5.395913e+05 6.008103e+05 1.880548e+05 2.069642e+05 2.292630e+05 1.756131e+05 1.841401e+05 1.770834e+05 2.448453e+05 1.859284e+05 2.247117e+05 2.198590e+05 2.099470e+05 2.687013e+05 1.991039e+05 2.117627e+05 2.508862e+05 2.441124e+05 2.193103e+05 1.931246e+05 1.886334e+05 1.902271e+05 2.042635e+05 2.304822e+05 2.527669e+05 2.166687e+05 2.498677e+05 1.581277e+05 1.667746e+05 2.146735e+05 2.188590e+05 1.566563e+05 2.021733e+05 1.718274e+05 8.847133e+05 1.899224e+05 1.871379e+05 1.726434e+05 2.296721e+05 2.275628e+05 1.239919e+05 1.850494e+05 1.816780e+05 2.035927e+05 2.386170e+05 1.886886e+05 1.914528e+05 2.584361e+05 1.701989e+05 2.317277e+05 2.134383e+05 2.000191e+05 1.862288e+05 1.841879e+05 2.031546e+05 1.503053e+05 2.125294e+05 2.134322e+05 1.753302e+05 1.855584e+05 1.818298e+06 1.394267e+05 1.805422e+05 1.785268e+05 2.111390e+05 2.157370e+05 2.080303e+05 1.903565e+05 2.104064e+05 1.773795e+05 1.989756e+05 1.946374e+05 1.867250e+05 2.311626e+05 2.078279e+05 1.752883e+05 2.072822e+05 1.841006e+05 2.013842e+05 1.955890e+05 1.917511e+05 1.624658e+05 2.379713e+05 1.955987e+05 1.782825e+05 1.908862e+05 1.714541e+05 1.534057e+05 1.799051e+05 2.236477e+05 1.824466e+05 1.866733e+05 2.480852e+05 1.919014e+05 2.349191e+05 1.910545e+05 1.302109e+05 1.663226e+05 1.874503e+05 2.000614e+05 1.757568e+05 2.486798e+05 2.346800e+05 1.989749e+05 2.286770e+05 1.933049e+05 2.188947e+05 1.543414e+05 1.875530e+05 2.189266e+05 1.979082e+05 1.958470e+05 2.150143e+05 1.968727e+05 1.656761e+05 1.403129e+05 1.573244e+05 1.954838e+05 1.739332e+05 1.843822e+05 1.683027e+05 1.672363e+05 1.801344e+05 2.132604e+05 1.794330e+05 2.068686e+05 1.655889e+05 1.992311e+05 1.584745e+05 1.779965e+05 2.475849e+05 1.713053e+05 1.859208e+05 3.433544e+05 2.158633e+05 1.757910e+05 2.970781e+05 2.679615e+05 1.932567e+05 2.550251e+05 3.142522e+06 3.141330e+05 2.582530e+05 2.420121e+05 1.182962e+06 1.899987e+05 2.866424e+05 3.754927e+05 2.031456e+05 2.752849e+05 2.704836e+05 1.812897e+05 2.524172e+05 3.000996e+05 2.898300e+05 2.116092e+05 2.459720e+05 2.085353e+05 1.792614e+05 2.076963e+05 9.375245e+07 1.966422e+05 3.111490e+05 2.046469e+06 2.205217e+05 1.378780e+05 2.197578e+05 2.013848e+05 2.556105e+05 3.432090e+05 2.853395e+05 2.370748e+05 2.124460e+05 3.127005e+05 2.041019e+05 3.597725e+05 1.123939e+06 3.689206e+05 4.269617e+05 1.042322e+06 1.584831e+06 9.865986e+05 2.709335e+05 5.523922e+06 2.857518e+05 2.144685e+05 1.947486e+05 2.758149e+05 2.232177e+05 1.188627e+06 8.052030e+05 2.006125e+05 1.786377e+05 1.870247e+05 2.940484e+05 7.126550e+05 2.184296e+05 1.991117e+05 1.740854e+05 1.945755e+05 1.754677e+05 1.968437e+05 2.099883e+05 1.942697e+05 1.763003e+05 2.441113e+05 1.531099e+05 3.233621e+05 1.431631e+05 1.421590e+05 2.137552e+05 1.728267e+05 2.383029e+05 3.091730e+05 2.485457e+05 C10 H18 N10 O_1.84 8.699502e+04 2.161331e+06 1.771967e+06 1.969511e+06 1.285315e+05 1.002889e+06 1.863701e+06 2.065255e+06 110050.72 1.794683e+06 1.719331e+06 1.930568e+06 117389.78 1.607352e+06 1.692507e+06 1.851591e+06 3.196516e+05 1.874158e+06 1.870411e+06 1.829131e+06 2.322993e+05 1.301678e+06 1.923046e+06 2.268595e+06 160257.554 1.600065e+06 1.797756e+06 1.382945e+06 1.610606e+05 1.897353e+06 1.865475e+06 2.183555e+06 199285.28 1.391307e+06 2.017803e+06 1.670486e+06 2.181177e+05 1.787142e+06 1.929193e+06 1.836794e+06 1.600187e+05 1.153666e+06 1.788356e+06 2.295820e+06 8.291743e+04 1.750617e+06 1.892188e+06 1.572769e+06 3.066119e+05 1.060939e+06 2.576246e+05 1.415938e+06 2.820109e+05 1.271120e+06 4.654208e+05 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1.393300e+06 1.455333e+06 1.716297e+06 1.489239e+06 2.020305e+06 1.606493e+06 2.034816e+06 1.715398e+06 1.731482e+06 1.908394e+06 1.959740e+06 1.861655e+06 1.629142e+06 2.124594e+06 2.264019e+06 1.855494e+06 1.715550e+06 1.687839e+06 1.959976e+06 1.360193e+06 1.868755e+06 1.566652e+06 1.638037e+06 1.641390e+06 1.645664e+06 1.720949e+06 1.884370e+06 2.730666e+06 2.561846e+06 2.103234e+06 2.820478e+06 2.192436e+06 2.222814e+06 2.164155e+06 2.283904e+06 1.921798e+06 2.167459e+06 2.266693e+06 1.385269e+06 1.349639e+06 1.523316e+06 2.173512e+06 1.925677e+06 2.083609e+06 1.765454e+06 2.413654e+06 1.897394e+06 1.717620e+06 2.093552e+06 1.543691e+06 1.404906e+06 2.008997e+06 2.369486e+06 2.456723e+06 1.579895e+06 1.802735e+06 1.934614e+06 1.825222e+06 1.512840e+06 2.684594e+06 1.543291e+06 2.174108e+06 2.287149e+06 2.102297e+06 1.719541e+06 2.127536e+06 2.511978e+06 2.267165e+06 1.452494e+06 1.980366e+06 1.392147e+06 1.870109e+06 1.883105e+06 1.344808e+06 1.753966e+06 1.940124e+06 1.991644e+06 2.353690e+06 1.617056e+06 1.806767e+06 1.367504e+06 1.657817e+06 1.415120e+06 1.666604e+06 1.422758e+06 C35 H65 N O8 S_1.841 3.719628e+04 1.678282e+06 1.773887e+06 1.640855e+06 5.526788e+04 1.296631e+06 1.663207e+06 1.894881e+06 47180.92 1.537178e+06 1.568907e+06 1.879844e+06 52952.48 1.354606e+06 1.628577e+06 1.762530e+06 4.045091e+04 1.594420e+06 1.511822e+06 1.785149e+06 1.024734e+05 1.322078e+06 1.726567e+06 1.808996e+06 70441.004 1.756597e+06 1.457282e+06 1.462813e+06 7.133459e+04 1.697503e+06 1.606026e+06 2.048098e+06 89005.32 1.431892e+06 1.351321e+06 1.788930e+06 9.148426e+04 1.666258e+06 1.656587e+06 1.463223e+06 6.145911e+04 1.408729e+06 1.599222e+06 1.770194e+06 3.218250e+04 2.092279e+06 1.591170e+06 1.355703e+06 1.202067e+06 1.705644e+06 5.772730e+05 1.328445e+06 6.238785e+05 1.712355e+06 1.088686e+06 6.729090e+05 1.187384e+06 1.154460e+06 1.251197e+06 1.693510e+06 1.544122e+06 1.067903e+06 1.340369e+06 1.433217e+06 1.282267e+06 1.220287e+06 1.926463e+06 8.826581e+05 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8.945427e+05 8.902598e+05 9.460316e+05 1.525040e+06 1.433744e+06 1.282562e+06 1.514217e+06 1.196975e+06 1.563938e+06 1.167995e+06 1.265857e+06 2.341105e+06 2.570321e+06 2.802821e+06 1.719136e+06 1.737549e+06 1.640442e+06 1.114935e+06 9.648335e+05 1.767467e+06 1.058276e+06 9.845361e+05 1.013550e+06 1.200254e+06 1.176001e+06 1.540770e+06 1.080249e+06 1.534443e+06 1.163923e+06 1.952879e+06 2.160810e+06 1.106640e+06 1.218189e+06 1.261507e+06 1.379562e+06 3.114146e+06 1.128168e+06 1.623921e+06 2.317490e+06 1.789979e+06 1.609049e+06 1.577218e+06 1.532926e+06 2.923071e+06 1.052778e+06 2.401593e+06 2.172910e+06 8.257139e+05 2.295117e+06 3.406531e+06 1.364373e+06 2.635580e+06 2.926982e+06 1.121299e+06 2.384334e+06 2.384507e+06 3.137435e+06 1.555725e+06 1.203406e+06 1.710388e+06 1.319532e+06 1.933610e+06 9.205179e+05 2.223839e+06 1.968877e+06 1.693229e+06 1.761025e+06 1.026852e+06 1.778077e+06 1.799094e+06 1.753893e+06 3.528313e+06 1.703319e+06 2.179756e+06 1.935819e+06 1.904249e+06 1.541041e+06 1.312988e+06 2.091104e+06 2.624911e+06 2.605295e+06 2.137309e+06 2.165551e+06 2.201569e+06 1.497218e+06 1.831364e+06 2.189725e+06 1.573477e+06 1.659766e+06 2.361185e+06 1.235200e+06 1.935544e+06 1.392472e+06 1.679716e+06 1.604080e+06 2.198822e+06 3.336836e+06 2.659788e+06 3.742127e+06 2.377203e+06 2.355170e+06 3.120100e+06 2.385271e+06 2.696018e+06 4.351479e+06 2.715816e+06 1.011155e+06 2.852985e+06 1.585703e+06 5.615632e+06 8.294551e+05 9.050572e+05 8.669949e+05 1.149843e+06 2.975982e+06 2.648354e+06 3.603422e+06 C13 H22 O5_1.842 8.517424e+04 1.293510e+06 1.477207e+06 1.351177e+06 1.232146e+05 7.397754e+05 1.408472e+06 1.425785e+06 93337.43 1.174190e+06 1.288591e+06 1.599456e+06 103110.38 1.129411e+06 1.123664e+06 1.206310e+06 1.279029e+05 1.263413e+06 1.238830e+06 1.440067e+06 2.101854e+05 1.020680e+06 1.375025e+06 1.419724e+06 144714.513 1.225535e+06 1.295966e+06 1.112294e+06 1.491623e+05 1.385300e+06 1.250869e+06 1.483649e+06 192961.51 9.425266e+05 1.367082e+06 1.443196e+06 1.952872e+05 1.038156e+06 1.296738e+06 1.178036e+06 1.460530e+05 1.266453e+06 1.450331e+06 1.521960e+06 7.284024e+04 9.170336e+05 1.496819e+06 1.104905e+06 5.361750e+05 8.276522e+05 6.437626e+05 1.012337e+06 6.007787e+05 1.546432e+06 9.567522e+05 5.695410e+05 1.064038e+06 7.660028e+05 1.128232e+06 8.644104e+05 1.703759e+06 9.997602e+05 1.364334e+06 1.082407e+06 9.694208e+05 3.152845e+05 6.026653e+05 1.113864e+06 1.140358e+06 1.048206e+06 1.430974e+06 1.182961e+06 1.442740e+06 1.431679e+06 5.197704e+05 4.683842e+05 4.201536e+05 6.305025e+05 2.382999e+07 4.887499e+05 5.740452e+05 6.714615e+05 3.122866e+05 5.668246e+05 3.327928e+05 2.760112e+05 3.063600e+05 1.809582e+05 5.172352e+05 3.868688e+05 7.362502e+05 4.123754e+05 1.228564e+06 8.604326e+05 1.153287e+06 9.987141e+05 9.095603e+05 2.824938e+05 1.124063e+06 1.169284e+06 5.576702e+05 8.356231e+05 1.644580e+05 5.823808e+05 7.314017e+05 1.189440e+06 4.594684e+05 1.125084e+06 5.482989e+05 2.718136e+05 3.173274e+05 1.352187e+06 1.273240e+06 2.244476e+05 5.354790e+05 3.247456e+05 5.806026e+05 3.215726e+05 2.351388e+05 9.257203e+05 2.841152e+05 2.835941e+05 2.231458e+05 7.392423e+05 3.184543e+05 3.211033e+05 5.928678e+05 3.353708e+05 3.650045e+05 3.136071e+05 1.168614e+06 2.324611e+06 7.921285e+05 1.011307e+06 8.611726e+05 6.440486e+05 1.434220e+06 1.277937e+06 1.022803e+06 9.545416e+05 2.064535e+06 1.865793e+06 1.375544e+06 2.298620e+06 3.286435e+06 3.515162e+06 3.713076e+06 4.022078e+06 8.313608e+06 4.670917e+06 3.679671e+06 1.843011e+06 1.030524e+06 7.812563e+05 7.741931e+05 9.901095e+05 1.430721e+06 1.163637e+06 1.334361e+06 7.694194e+05 7.762684e+05 8.439887e+05 6.784487e+05 1.503679e+06 2.350811e+06 1.631109e+06 5.309781e+05 1.898673e+06 1.065458e+06 1.141540e+06 1.782760e+06 6.381804e+05 1.467826e+06 1.658455e+06 2.141497e+06 2.121107e+06 1.359970e+06 1.011153e+06 1.061284e+06 1.297812e+06 2.593437e+06 7.118710e+05 8.343518e+05 1.761801e+06 3.599198e+06 1.073529e+06 8.637260e+05 8.100273e+05 1.970967e+06 4.177200e+05 1.627970e+06 1.412569e+06 5.085543e+05 1.200896e+06 4.450839e+06 7.117551e+05 2.076903e+06 2.526422e+06 5.540678e+05 1.598545e+06 1.247343e+06 1.989055e+06 7.024263e+05 7.349770e+05 8.055984e+05 5.625319e+05 6.190793e+05 3.631485e+05 8.191701e+05 4.955569e+05 3.944194e+05 6.923779e+05 5.484705e+05 7.949455e+05 5.250122e+06 8.990008e+05 1.744847e+06 5.769960e+05 1.039140e+06 3.530870e+06 9.188451e+05 6.236942e+05 2.788377e+05 1.165778e+06 1.261332e+06 9.746882e+05 8.004997e+05 1.202893e+06 1.137855e+06 2.637707e+06 7.970323e+05 9.462784e+05 9.022288e+05 5.533366e+05 5.761770e+05 6.028160e+05 7.933981e+05 7.620858e+05 3.861295e+05 1.371935e+06 3.148964e+06 1.148672e+06 9.509281e+05 1.210830e+06 5.868048e+05 5.871960e+05 9.968586e+05 5.802165e+05 9.667196e+05 1.229167e+06 1.076716e+06 1.369767e+06 7.938423e+05 1.115057e+06 2.254752e+06 1.605706e+06 1.592205e+06 9.543142e+05 2.144250e+06 1.873785e+06 1.239100e+06 8.910576e+05 C9 H7 N_1.842 2.717846e+06 9.241251e+05 1.027877e+06 5.891694e+05 1.139639e+05 6.378056e+05 5.775737e+05 9.318647e+05 54725.51 8.595134e+05 1.123596e+06 7.030384e+05 61557.06 4.413106e+05 8.198712e+05 1.008339e+06 4.745780e+04 7.832403e+05 6.545183e+05 8.732082e+05 1.348904e+05 6.694344e+05 9.699214e+05 9.255214e+05 110308.822 5.418954e+05 9.473304e+05 7.826786e+05 1.183711e+05 5.133526e+05 9.629012e+05 9.582998e+05 83415.14 7.093106e+05 7.877151e+05 8.248881e+05 8.508193e+04 6.370026e+05 8.065412e+05 9.936935e+05 5.891040e+04 7.661055e+05 7.423120e+05 7.801268e+05 3.852778e+04 6.907541e+05 8.775776e+05 3.908438e+05 1.301309e+05 1.031847e+06 9.061998e+05 4.420462e+06 1.338662e+06 9.782428e+05 1.070019e+06 8.011278e+05 4.099862e+05 7.193300e+05 3.578588e+06 3.955175e+05 1.269689e+06 1.019674e+06 1.021565e+06 4.573302e+05 7.242103e+05 7.844463e+05 6.023390e+05 2.052024e+06 1.830176e+06 9.137552e+05 5.557922e+05 5.694830e+05 8.478497e+05 4.536437e+05 1.003474e+06 4.006225e+05 6.931499e+05 6.617922e+05 1.416185e+06 1.085137e+06 6.514532e+05 7.917303e+05 2.071060e+05 7.701039e+05 2.955419e+05 8.787744e+05 5.702637e+05 1.980342e+06 1.856884e+06 1.283800e+06 7.870216e+05 6.686723e+05 9.007361e+05 4.725902e+05 9.511662e+05 7.656729e+05 5.766116e+05 4.291316e+05 7.740563e+05 3.631324e+05 1.104982e+06 2.140111e+06 8.367780e+05 6.459076e+05 6.796130e+05 3.153790e+05 3.324494e+05 5.703280e+05 4.794372e+05 7.344185e+05 2.069113e+05 1.247001e+06 5.346273e+05 6.207547e+05 5.754325e+05 5.541574e+05 4.918426e+05 1.074139e+06 6.976820e+05 4.980352e+05 5.427008e+05 5.493374e+05 4.224490e+05 4.182134e+05 5.430521e+05 8.146618e+05 3.686815e+05 3.574215e+05 8.112378e+05 1.213656e+06 1.024089e+06 3.003686e+05 3.621089e+05 1.266187e+06 1.053591e+06 6.944539e+05 6.607989e+05 5.298579e+05 4.694446e+05 4.476660e+05 5.389188e+05 9.674642e+05 1.443155e+05 5.074410e+05 3.767928e+06 1.104062e+06 4.331948e+05 3.861621e+05 4.677027e+05 2.807016e+05 5.006619e+05 3.421223e+06 4.977141e+05 8.783410e+05 6.329177e+05 7.070641e+05 1.140511e+06 2.874086e+05 2.607911e+06 5.395151e+05 9.373131e+05 1.330014e+06 4.630264e+06 1.233596e+06 1.094221e+06 2.953956e+06 8.574149e+05 1.000082e+06 8.670411e+05 3.367236e+05 9.865055e+05 9.704121e+05 1.609889e+06 6.686611e+05 4.172364e+05 1.445840e+06 6.298732e+05 4.364124e+05 7.157417e+05 7.671684e+05 2.560018e+05 8.380635e+05 3.942907e+05 6.952735e+05 5.450252e+05 5.294294e+05 1.109262e+06 6.830724e+05 1.056276e+06 2.743310e+05 8.852972e+05 3.545856e+05 4.028510e+05 3.512189e+05 2.787235e+05 7.269953e+05 1.315445e+06 9.402996e+05 1.028694e+06 7.898708e+05 6.956219e+05 1.748826e+06 5.828632e+05 1.142953e+06 5.631882e+05 8.008370e+05 8.183883e+05 5.755737e+05 1.481251e+06 2.503791e+06 6.282517e+05 7.940687e+05 7.494589e+05 8.628423e+05 7.525968e+05 6.448638e+05 2.595463e+05 3.177736e+05 6.480852e+05 1.458724e+06 1.226857e+06 2.897715e+06 8.544205e+05 1.209608e+06 8.332046e+05 9.139493e+05 2.027087e+06 4.701627e+05 9.972342e+05 6.865269e+05 1.183743e+06 8.925357e+05 1.924562e+06 7.225594e+05 6.478676e+05 4.151881e+05 5.963602e+05 1.135899e+06 3.403264e+05 7.379315e+05 1.004982e+06 9.344063e+05 4.752878e+05 1.175491e+06 4.428119e+06 7.399900e+05 1.115307e+06 5.842238e+06 7.997566e+05 7.373990e+05 4.856740e+05 1.019682e+06 3.976216e+05 2.126671e+06 1.615194e+06 3.791547e+05 7.033541e+05 4.402014e+05 2.100604e+06 5.615116e+05 1.043137e+06 1.227356e+06 C13 H24 O6_1.844 7.295211e+04 1.502582e+06 1.557305e+06 1.282932e+06 1.065568e+05 7.295994e+05 1.465695e+06 1.478515e+06 83205.46 1.213651e+06 1.344878e+06 1.550874e+06 91463.90 1.216891e+06 1.279191e+06 1.322478e+06 7.373135e+04 1.270347e+06 1.187056e+06 1.504655e+06 1.914625e+05 1.146881e+06 1.388250e+06 1.572708e+06 136556.852 1.186280e+06 1.318026e+06 1.262481e+06 1.431553e+05 1.365064e+06 1.246322e+06 1.531065e+06 182401.89 9.872871e+05 1.573411e+06 1.444482e+06 1.852538e+05 1.050857e+06 1.412807e+06 1.345144e+06 1.267759e+05 1.066740e+06 1.456678e+06 1.599963e+06 6.718558e+04 1.151442e+06 1.456111e+06 1.156914e+06 6.148501e+05 7.606360e+05 6.428611e+05 1.127582e+06 7.255169e+05 1.800825e+06 8.398018e+05 4.300530e+05 1.039619e+06 8.593946e+05 1.298675e+06 7.751748e+05 1.675866e+06 1.174595e+06 1.370309e+06 1.174886e+06 1.034746e+06 2.944824e+05 6.033600e+05 1.028457e+06 1.156474e+06 1.021627e+06 1.271782e+06 1.161789e+06 1.293727e+06 1.600051e+06 4.223351e+05 4.655048e+05 4.201571e+05 5.374424e+05 2.905730e+07 3.493758e+05 4.536900e+05 4.259180e+05 2.894269e+05 5.274615e+05 2.444323e+05 3.857600e+05 2.852558e+05 2.673045e+05 3.204557e+05 3.440707e+05 6.940721e+05 3.275235e+05 1.343433e+06 7.685468e+05 1.066944e+06 8.409077e+05 6.796159e+05 3.376122e+05 9.961901e+05 1.007533e+06 3.879930e+05 8.322898e+05 1.558922e+05 6.083452e+05 5.930496e+05 9.602437e+05 4.949777e+05 1.235997e+06 5.853742e+05 2.581354e+05 3.044395e+05 1.542005e+06 1.190794e+06 1.915971e+05 3.183594e+05 2.709628e+05 4.900649e+05 2.920562e+05 2.430077e+05 1.088299e+06 3.454856e+05 2.301458e+05 2.153829e+05 5.242532e+05 1.770039e+05 3.102820e+05 4.075681e+05 4.276986e+05 2.849296e+05 1.912770e+05 1.382004e+06 2.921098e+06 9.356168e+05 1.112826e+06 8.043017e+05 6.446022e+05 1.562523e+06 1.338729e+06 1.081303e+06 1.096906e+06 2.405235e+06 1.746201e+06 1.423947e+06 2.745970e+06 3.929954e+06 4.293453e+06 4.126645e+06 4.966851e+06 8.499200e+06 5.526068e+06 4.493132e+06 1.989407e+06 1.192892e+06 7.064686e+05 6.987705e+05 8.269494e+05 1.233140e+06 1.361194e+06 1.478323e+06 7.094490e+05 6.738205e+05 7.108820e+05 6.058481e+05 1.679993e+06 2.875377e+06 1.716495e+06 6.946661e+05 1.893765e+06 1.440820e+06 1.498172e+06 2.208347e+06 7.073602e+05 1.544897e+06 1.984779e+06 2.288215e+06 2.401350e+06 1.356595e+06 1.167863e+06 1.117277e+06 1.344786e+06 2.665811e+06 6.709997e+05 7.102035e+05 1.935595e+06 3.762256e+06 8.812046e+05 6.010590e+05 6.407061e+05 2.088151e+06 4.168636e+05 1.973873e+06 1.366173e+06 4.881381e+05 9.345691e+05 4.848042e+06 6.909831e+05 2.339174e+06 2.726504e+06 5.683653e+05 1.613301e+06 1.538089e+06 2.058527e+06 7.130865e+05 3.727822e+05 5.880404e+05 5.256825e+05 5.529045e+05 3.511031e+05 7.589093e+05 4.228286e+05 5.713673e+05 6.598777e+05 4.414782e+05 7.494037e+05 5.855549e+06 7.469692e+05 1.991732e+06 4.398854e+05 9.486377e+05 4.388240e+06 8.357831e+05 5.428669e+05 2.638342e+05 7.894664e+05 1.257181e+06 8.310949e+05 8.248203e+05 1.006099e+06 8.902227e+05 3.072404e+06 6.496744e+05 5.645374e+05 9.498436e+05 3.276491e+05 6.392339e+05 5.870066e+05 7.428081e+05 8.681231e+05 2.489882e+05 1.579655e+06 3.861278e+06 1.292743e+06 1.106448e+06 1.144389e+06 6.321480e+05 7.528392e+05 9.166113e+05 6.217015e+05 1.062673e+06 1.513636e+06 1.148405e+06 1.634052e+06 8.437042e+05 1.200776e+06 2.244203e+06 1.658768e+06 1.713620e+06 9.390856e+05 2.127611e+06 1.690068e+06 1.311812e+06 1.019693e+06 N-ACETYLLEUCINE 1.585363e+06 7.711398e+05 1.362154e+06 4.795082e+05 1.171052e+05 5.442553e+05 8.486246e+05 1.467563e+06 51094.84 4.163091e+05 8.708749e+05 1.632632e+06 83027.61 4.680328e+05 6.879383e+05 1.321034e+06 5.171238e+04 4.569988e+05 6.927505e+05 1.233546e+06 8.514708e+04 3.081148e+05 1.059059e+06 1.671967e+06 59958.140 4.132304e+05 6.235079e+05 1.158821e+06 6.853189e+04 5.901628e+05 8.591574e+05 1.517587e+06 92641.72 3.742736e+05 8.952609e+05 1.181074e+06 9.998518e+04 3.340202e+05 9.673074e+05 1.498172e+06 6.460493e+04 2.396184e+05 1.048736e+06 1.436749e+06 3.428281e+04 3.687461e+05 6.649045e+05 1.051194e+06 1.338705e+05 1.671397e+05 3.967909e+05 1.299517e+06 5.858623e+05 7.460688e+05 1.104574e+06 7.767773e+05 3.937224e+05 8.771659e+05 2.382066e+06 3.385634e+05 1.197615e+06 7.675102e+05 1.053782e+06 4.785248e+05 5.643339e+05 1.145067e+05 8.430627e+05 6.819108e+05 6.871290e+05 5.070387e+05 6.555569e+05 1.237641e+06 7.704863e+05 4.727826e+05 1.295376e+06 8.277293e+05 7.662282e+05 3.074008e+05 1.380636e+06 9.139287e+05 3.251756e+05 3.774634e+05 2.513083e+05 8.595034e+05 5.464902e+05 7.712379e+05 2.063168e+05 5.326116e+05 4.203105e+05 8.049231e+05 9.372569e+05 8.228878e+05 5.333993e+05 7.739888e+05 7.629326e+05 8.204042e+05 9.480517e+05 4.958578e+05 3.948691e+05 4.577380e+05 9.916261e+05 9.247642e+05 5.594828e+05 8.675909e+05 9.626984e+05 6.013708e+05 5.065984e+05 8.883691e+05 5.618130e+05 8.799969e+05 5.404811e+05 5.314025e+05 1.072925e+06 2.157351e+05 4.368235e+05 1.057012e+06 3.476768e+05 1.221821e+06 8.829073e+05 1.330729e+06 3.088362e+05 4.635173e+05 3.123429e+05 3.389783e+05 2.809377e+05 4.025197e+05 6.718700e+05 5.043535e+05 5.655308e+05 8.941658e+05 6.094556e+05 7.572371e+05 1.723331e+05 7.115500e+05 2.742543e+05 4.077149e+05 5.460941e+05 6.376522e+05 5.657900e+05 6.475513e+05 7.314467e+05 4.841948e+05 9.498409e+05 6.301852e+05 7.534561e+05 3.795062e+05 2.896553e+05 6.178398e+05 6.524119e+05 4.444876e+05 2.119259e+05 4.357568e+05 6.852425e+05 7.364951e+05 4.058507e+05 9.227784e+05 7.103747e+05 5.668873e+05 5.519878e+05 2.249551e+05 5.222022e+05 8.094441e+05 5.858350e+05 4.674279e+05 3.752786e+05 3.521735e+05 8.428171e+05 6.256264e+05 2.502229e+05 1.560742e+05 6.074501e+05 2.985655e+05 5.204556e+05 3.351123e+05 3.109811e+05 5.079144e+05 1.663798e+06 4.320946e+05 5.432127e+05 4.949308e+05 1.353423e+05 3.234411e+05 5.655782e+05 5.351636e+05 3.604681e+05 2.553410e+05 9.948757e+05 1.292646e+06 1.498172e+06 4.840783e+05 5.252846e+05 8.310396e+05 4.558487e+05 5.161180e+05 3.813582e+05 6.290843e+05 2.459780e+06 1.389609e+06 6.948261e+05 8.032540e+05 7.604858e+05 6.796315e+05 2.666807e+05 1.131967e+06 4.519190e+05 5.588662e+05 6.849540e+05 3.824288e+05 3.803764e+05 4.304329e+05 6.645443e+05 6.535817e+05 2.362659e+05 5.722111e+05 6.363760e+05 9.286156e+05 1.850642e+05 8.907191e+05 8.610858e+05 7.182672e+05 1.447744e+06 1.047402e+06 8.852612e+05 1.000671e+06 6.722977e+05 3.036176e+05 7.316191e+05 9.593673e+05 7.932183e+05 1.176972e+06 1.443996e+06 1.172258e+06 9.721130e+05 8.358769e+05 1.438973e+06 2.788736e+05 1.377222e+06 1.299858e+06 8.490192e+05 9.203405e+05 1.440440e+06 5.725163e+05 4.956241e+05 7.561737e+05 2.435168e+05 2.872336e+05 8.042974e+05 6.599453e+05 8.696767e+05 4.018947e+05 4.063162e+05 5.734990e+05 3.738736e+05 7.971300e+05 6.872218e+05 8.746026e+04 6.608182e+05 5.800326e+05 9.016640e+05 5.509625e+05 7.873797e+05 9.793980e+05 gamma-Heptalactone_1.845 2.341786e+05 2.913913e+05 2.917435e+05 3.095497e+05 5.698318e+04 1.287810e+05 3.411559e+05 3.108550e+05 111998.83 2.809193e+05 2.870423e+05 3.988733e+05 63075.53 2.350030e+05 2.958346e+05 3.217664e+05 4.785433e+04 2.602327e+05 2.682547e+05 2.689041e+05 1.113386e+05 3.850445e+05 2.951195e+05 4.206232e+05 79202.144 2.162876e+05 2.925666e+05 3.477160e+05 1.018458e+05 2.735517e+05 2.831401e+05 3.312904e+05 120196.88 1.746814e+05 4.038231e+05 2.168103e+05 1.555410e+05 3.166522e+05 3.347974e+05 3.614193e+05 5.746069e+04 3.479086e+05 2.484340e+05 2.163126e+05 6.560662e+04 3.600094e+05 2.699882e+05 3.355169e+05 2.326167e+05 5.366729e+05 4.021192e+05 1.960982e+05 3.653255e+05 3.138094e+05 3.612719e+05 2.552739e+05 2.789860e+05 3.934737e+05 2.735531e+05 3.649453e+05 5.862595e+05 4.019732e+05 5.601227e+05 2.247494e+05 3.167940e+05 1.264066e+05 2.632756e+05 3.845686e+05 6.668219e+05 3.293895e+05 4.899065e+05 4.289976e+05 4.407730e+05 5.613921e+05 2.115620e+05 2.234185e+05 3.542562e+05 1.840231e+05 3.378837e+06 1.013318e+05 1.016539e+05 2.001238e+05 1.651656e+05 3.033516e+05 2.048864e+05 1.724552e+05 1.975514e+05 1.564675e+05 2.324123e+05 1.663593e+05 2.854350e+05 2.333173e+05 2.599144e+05 2.718288e+05 2.572725e+05 2.343405e+05 1.550252e+05 9.675254e+04 1.927589e+05 3.166820e+05 1.738533e+05 3.081598e+05 9.110123e+04 2.233054e+05 2.910088e+05 4.788180e+05 1.207361e+05 3.275338e+05 1.911976e+05 1.610046e+05 1.229146e+05 4.621230e+05 1.633531e+05 1.153852e+05 1.538198e+05 1.101887e+05 1.776731e+05 9.709302e+04 1.436038e+05 3.760400e+05 1.055419e+05 9.813673e+04 1.515211e+05 1.276077e+05 1.084220e+05 9.401198e+04 2.760912e+05 1.190452e+05 2.274572e+05 1.511254e+05 2.317537e+05 2.594537e+05 1.413844e+05 2.116146e+05 3.034151e+05 2.648341e+05 2.786411e+05 3.059232e+05 2.091755e+05 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4.242262e+05 1.359999e+05 4.234109e+05 6.689067e+05 5.393511e+05 4.662108e+05 5.014569e+05 3.116532e+05 1.986531e+05 6.313608e+05 3.676633e+05 2.691477e+05 3.326202e+05 4.380058e+05 4.770957e+05 4.012824e+05 2.580116e+05 3.248294e+05 3.751125e+05 2.443094e+05 2.472360e+05 2.250968e+05 3.343983e+05 2.788823e+05 6.411193e+05 3.245122e+05 2.778759e+05 4.937847e+05 5.442730e+05 2.472906e+05 4.307020e+05 3.240736e+05 5.347984e+05 5.485046e+05 4.793854e+05 2.674734e+05 4.204266e+05 4.872836e+05 6.346881e+05 2.245135e+05 3.389108e+05 1.036794e+05 2.538634e+05 2.539566e+05 4.516219e+05 4.336968e+05 C43 H71 N5 O2 P2_1.845 4.459923e+04 5.522125e+05 4.844299e+05 5.467165e+05 6.547692e+04 2.756836e+05 5.027797e+05 4.828170e+05 51883.91 4.909157e+05 5.248931e+05 5.582891e+05 56271.29 3.827089e+05 3.916384e+05 6.762567e+05 4.279891e+04 4.200978e+05 4.026880e+05 5.712013e+05 1.104918e+05 3.269673e+05 4.852685e+05 5.240090e+05 73707.394 5.627035e+05 4.171103e+05 4.992505e+05 7.331219e+04 3.985580e+05 5.003019e+05 6.850343e+05 92112.78 3.003776e+05 4.803664e+05 5.298684e+05 1.008758e+05 3.623254e+05 6.465210e+05 5.543035e+05 7.526390e+04 2.095002e+05 5.186136e+05 5.525562e+05 3.803463e+04 4.095086e+05 5.494092e+05 4.442803e+05 5.180949e+05 9.640640e+04 1.039617e+05 1.330181e+05 9.719620e+04 1.089237e+05 9.894169e+04 1.310821e+05 1.035510e+05 1.254567e+05 1.300912e+05 1.145480e+05 1.540332e+05 1.119195e+05 1.015739e+05 1.335132e+05 1.421096e+05 1.231386e+05 9.874564e+04 1.111711e+05 1.062321e+05 1.106859e+05 1.307261e+05 1.239822e+05 1.031644e+05 1.349038e+05 8.835509e+04 9.296969e+04 1.198814e+05 9.468721e+04 7.705190e+04 1.178944e+05 9.560515e+04 7.885752e+05 1.006259e+05 1.045832e+05 8.280613e+04 1.211419e+05 1.278432e+05 6.948685e+04 9.099003e+04 8.832031e+04 9.577289e+04 1.135924e+05 1.031641e+05 8.652545e+04 1.106568e+05 9.503566e+04 1.343350e+05 1.225290e+05 9.274851e+04 1.043436e+05 8.980194e+04 1.142659e+05 8.335653e+04 1.253975e+05 1.264126e+05 9.695578e+04 1.047116e+05 1.627410e+06 7.760766e+04 1.028890e+05 1.016037e+05 1.098064e+05 1.200285e+05 1.146356e+05 9.866601e+04 1.198623e+05 9.856152e+04 1.155422e+05 1.117541e+05 1.031547e+05 1.325615e+05 1.186659e+05 9.784948e+04 1.061133e+05 1.047888e+05 1.179517e+05 1.012237e+05 1.048526e+05 8.761530e+04 8.613105e+04 1.086882e+05 1.055296e+05 1.034146e+05 9.007688e+04 8.603114e+04 1.004686e+05 1.122386e+05 1.012212e+05 1.035922e+05 7.859730e+04 1.096901e+05 1.228074e+05 1.070237e+05 7.232733e+04 8.534692e+04 1.069749e+05 1.146023e+05 9.772070e+04 1.397298e+05 1.311550e+05 9.676838e+04 9.579213e+04 9.525330e+04 1.284722e+05 8.582608e+04 8.241337e+04 1.293018e+05 9.131066e+04 1.087372e+05 9.903527e+04 1.147756e+05 9.562495e+04 7.809522e+04 8.347059e+04 1.157456e+05 9.740991e+04 1.080902e+05 9.531078e+04 9.630626e+04 1.058776e+05 9.755829e+04 1.148885e+05 1.031747e+05 9.184881e+04 1.083051e+05 8.903107e+04 1.023673e+05 1.444996e+05 9.564046e+04 9.574551e+04 1.995482e+05 1.050697e+05 8.599064e+04 1.593508e+05 1.752895e+05 1.137511e+05 1.774536e+05 2.951327e+06 1.497950e+05 1.397555e+05 1.080087e+05 1.049677e+06 1.124490e+05 2.080956e+05 2.438344e+05 1.060358e+05 1.555545e+05 1.431235e+05 9.918083e+04 1.270707e+05 1.418678e+05 1.448533e+05 1.245831e+05 1.381310e+05 1.123534e+05 1.003152e+05 9.441610e+04 8.728943e+07 1.018247e+05 1.758914e+05 2.003323e+06 1.197909e+05 7.617787e+04 1.060217e+05 1.020523e+05 1.427367e+05 1.591257e+05 1.627504e+05 1.302125e+05 1.083356e+05 2.110927e+05 9.559286e+04 2.667179e+05 9.964067e+05 2.746550e+05 2.745095e+05 9.197328e+05 1.447957e+06 8.589010e+05 1.594399e+05 5.096593e+06 1.564195e+05 1.254691e+05 1.087374e+05 1.539269e+05 1.309050e+05 1.080352e+06 7.101097e+05 1.135656e+05 8.366686e+04 1.037910e+05 1.774643e+05 5.925470e+05 1.158290e+05 1.069104e+05 8.908730e+04 9.904716e+04 9.024533e+04 1.055367e+05 1.138059e+05 1.090358e+05 1.065651e+05 9.076576e+04 8.234513e+04 1.839316e+05 7.636401e+04 8.052527e+04 1.250854e+05 9.308127e+04 1.386463e+05 9.473896e+04 1.236185e+05 C11 H18 N2 O2_1.845 8.498879e+06 1.821563e+06 1.766934e+06 1.611857e+06 7.078686e+04 1.211449e+06 1.891171e+06 2.485442e+06 55171.96 1.312322e+06 1.402359e+06 1.750686e+06 80609.72 1.964145e+06 1.321312e+06 1.820991e+06 8.757780e+04 1.685705e+06 1.835732e+06 1.456326e+06 1.375023e+05 1.500205e+06 2.110381e+06 2.116258e+06 98777.093 1.171551e+06 1.847744e+06 1.705324e+06 9.713558e+04 1.215343e+06 1.795008e+06 2.257272e+06 111898.66 1.544823e+06 1.687846e+06 1.904456e+06 1.193885e+05 1.336325e+06 1.242386e+06 2.335789e+06 8.029464e+04 1.433130e+06 1.726426e+06 2.154763e+06 4.600827e+04 1.271682e+06 1.741560e+06 1.664059e+06 1.208531e+06 1.063644e+06 2.354444e+06 9.322110e+05 1.383083e+06 1.450915e+06 1.764194e+06 1.699452e+06 3.559005e+06 2.532013e+06 3.122529e+06 2.056484e+06 2.485802e+06 3.137928e+06 2.835922e+06 1.339054e+06 6.164742e+05 1.596824e+06 2.606760e+06 1.152316e+06 2.470881e+06 1.573417e+06 1.144838e+06 2.193388e+06 2.136015e+06 1.738694e+06 2.391865e+06 9.845544e+05 1.159065e+06 2.426455e+06 3.353074e+05 1.111073e+06 1.361615e+06 4.558402e+06 9.895088e+05 2.120711e+06 5.213461e+05 8.551637e+05 1.868697e+06 6.700845e+05 3.015128e+06 1.666164e+06 1.745559e+06 9.081940e+05 1.742697e+06 1.186434e+06 1.505016e+06 1.564518e+06 1.814381e+06 2.142766e+06 1.032246e+06 1.286754e+06 1.434572e+06 1.836547e+06 1.189864e+06 1.568169e+06 1.141880e+06 1.388062e+06 1.398033e+06 2.328377e+06 1.087213e+06 3.272793e+05 1.446864e+06 1.950239e+06 1.686644e+06 1.272395e+06 1.400508e+06 9.381418e+05 1.159813e+06 1.778644e+06 1.194539e+06 1.979384e+06 2.063897e+06 1.532270e+06 1.409968e+06 1.667629e+06 1.090681e+06 1.976375e+06 1.786656e+06 1.976063e+06 2.584923e+06 2.227651e+06 2.513114e+06 1.331161e+06 1.160468e+06 2.543630e+06 2.323400e+06 1.937318e+06 1.376110e+06 1.887670e+06 2.982897e+06 1.814074e+06 2.588925e+06 2.794309e+06 2.330170e+06 1.510287e+06 1.207273e+06 1.409853e+06 9.238820e+05 1.129889e+06 1.104278e+06 1.411232e+06 1.179933e+06 2.082219e+06 1.843971e+06 2.328883e+06 1.031151e+06 1.155074e+06 1.490662e+06 1.018281e+06 1.082808e+06 1.718763e+06 1.313485e+06 1.939507e+06 1.596471e+06 1.123478e+06 1.203739e+06 5.262679e+06 8.318622e+05 1.388980e+06 8.666179e+05 1.058313e+06 1.416051e+06 1.051555e+06 1.746508e+06 1.278152e+06 1.369595e+06 9.448241e+05 1.079710e+06 1.502003e+06 2.520906e+06 1.806501e+06 1.611777e+06 6.865650e+05 3.938449e+06 2.561945e+06 2.385433e+06 5.058064e+06 3.362328e+06 7.384100e+05 1.853403e+06 8.547751e+05 2.101588e+06 1.574647e+06 8.822327e+05 2.266426e+06 7.024417e+05 1.327117e+06 3.278844e+06 1.792794e+06 1.149867e+06 1.373654e+06 4.198491e+06 1.779257e+06 1.343299e+06 1.790095e+06 2.027545e+06 8.972121e+05 1.570096e+06 7.058465e+05 2.039125e+06 6.219168e+05 2.685924e+06 1.179664e+06 1.569585e+06 8.466254e+05 1.803207e+06 1.794254e+06 1.412557e+06 9.332624e+05 1.278404e+06 1.997091e+06 8.065339e+05 7.946536e+05 1.736250e+06 8.214353e+05 1.778628e+06 8.374227e+05 3.817699e+06 1.331313e+06 1.472850e+06 1.032371e+06 4.626202e+06 1.164151e+06 1.704226e+06 1.174466e+06 1.836699e+06 4.624890e+05 1.849126e+06 8.214571e+05 2.043121e+06 1.162385e+06 4.087533e+06 2.149751e+06 1.664943e+06 2.018284e+06 1.975854e+06 1.409261e+06 2.140698e+06 9.245279e+05 2.357055e+06 1.353304e+06 2.487933e+06 1.346878e+06 1.058196e+06 3.432959e+06 1.748367e+06 2.119460e+06 9.805974e+05 1.225749e+06 2.901092e+06 7.803617e+05 1.825854e+06 9.459025e+05 C23 H49 N O10_1.846 4.367187e+04 3.855447e+06 2.852875e+06 3.540362e+06 6.339486e+04 1.862588e+06 3.373549e+06 3.507137e+06 48147.96 2.859952e+06 3.454704e+06 3.680356e+06 52462.44 2.694586e+06 2.931489e+06 3.252571e+06 4.163482e+04 3.037220e+06 3.104429e+06 3.486795e+06 1.077627e+05 2.400238e+06 3.540717e+06 3.061337e+06 74808.905 3.472365e+06 3.388789e+06 2.765995e+06 7.585692e+04 2.658704e+06 3.493386e+06 4.245170e+06 91353.19 1.785676e+06 3.280107e+06 3.314643e+06 9.144013e+04 3.111278e+06 3.757482e+06 3.403525e+06 6.908673e+04 1.941847e+06 4.086654e+06 4.002285e+06 3.801690e+04 9.251714e+05 3.663126e+06 3.382619e+06 2.230269e+06 2.680251e+06 1.264078e+06 1.438791e+06 8.944268e+05 2.632032e+06 1.092214e+06 1.128418e+06 1.078518e+06 1.664646e+06 1.625127e+06 3.504191e+06 2.062705e+06 1.329832e+06 2.002858e+06 2.162189e+06 1.698131e+06 2.414076e+06 3.509490e+06 1.427868e+06 1.465398e+06 1.694242e+06 2.507987e+06 1.977674e+06 1.654417e+06 2.503943e+06 2.745892e+06 3.201689e+06 3.196613e+06 3.252383e+06 1.050932e+06 2.440118e+06 3.265110e+06 3.102108e+06 2.706818e+06 3.483483e+06 1.697129e+06 2.889478e+06 2.083214e+06 1.374558e+06 2.716365e+06 2.575458e+06 3.357194e+06 2.639665e+06 3.497815e+06 2.149984e+06 4.171380e+06 2.661133e+06 3.137223e+06 2.993224e+06 2.323054e+06 2.255118e+06 2.002674e+06 3.596477e+06 2.171698e+06 2.454435e+06 2.509330e+06 3.080662e+06 2.034194e+06 3.013240e+06 1.821288e+06 2.571404e+06 2.560903e+06 4.187558e+06 2.966732e+06 4.195986e+06 3.873678e+06 2.680192e+06 4.153376e+06 3.542948e+06 2.935512e+06 3.637885e+06 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5.490141e+06 2.311112e+06 4.152518e+06 4.689632e+06 5.415632e+06 2.712602e+06 2.991828e+06 3.757486e+06 2.611812e+06 3.924364e+06 2.169237e+06 4.887913e+06 4.940296e+06 2.825081e+06 3.878586e+06 2.451725e+06 3.407236e+06 3.255994e+06 3.675198e+06 7.054949e+06 4.734331e+06 5.042102e+06 3.820916e+06 4.175827e+06 2.925895e+06 2.775470e+06 4.342964e+06 5.267793e+06 5.698898e+06 6.138674e+06 5.317394e+06 4.549706e+06 3.425681e+06 4.385297e+06 5.784374e+06 3.167706e+06 3.728351e+06 4.363010e+06 2.089051e+06 3.354506e+06 2.264877e+06 3.546232e+06 3.262464e+06 3.984306e+06 8.395480e+06 6.982333e+06 9.712825e+06 5.152667e+06 6.491571e+06 8.793358e+06 6.140834e+06 6.660091e+06 1.124624e+07 7.067873e+06 1.402961e+06 7.420739e+06 3.129939e+06 1.698761e+07 1.199689e+06 1.470804e+06 1.219089e+06 2.528726e+06 7.240766e+06 7.852656e+06 7.354870e+06 C11 H18 N2 O10 P2 S_1.847 1.280860e+05 5.680376e+05 9.402724e+05 9.884216e+05 1.488164e+05 5.760490e+05 1.246444e+06 9.132608e+05 63256.62 8.585255e+05 8.622373e+05 1.026201e+06 57778.36 9.351136e+05 8.666705e+05 9.496228e+05 4.217825e+04 7.155328e+05 8.324230e+05 8.723672e+05 1.010448e+05 9.662849e+05 1.100754e+06 1.051266e+06 73471.027 6.566719e+05 9.084879e+05 1.007378e+06 7.366938e+04 6.352163e+05 8.589528e+05 9.509821e+05 78313.68 9.981183e+05 8.683907e+05 7.513368e+05 6.942147e+04 1.065008e+06 9.492371e+05 7.816988e+05 5.511601e+04 1.002135e+06 7.526132e+05 1.085258e+06 3.822103e+04 8.966931e+05 1.110312e+06 5.582081e+05 1.688077e+05 6.251799e+05 3.872602e+05 1.638973e+05 9.989517e+05 9.904287e+05 6.540122e+05 4.867179e+05 3.422688e+05 6.015310e+05 1.080249e+06 6.405896e+05 3.168995e+05 3.150464e+05 7.779807e+05 9.246825e+05 9.043639e+05 1.401244e+05 4.391912e+05 8.558784e+05 9.079353e+05 7.118832e+05 3.496473e+05 1.497343e+06 1.811219e+06 1.589811e+06 1.181266e+06 1.318985e+06 6.181714e+05 1.432236e+06 7.674211e+04 6.728619e+05 1.426344e+06 6.926042e+05 4.358954e+05 7.365980e+05 2.415635e+05 4.539306e+05 8.083162e+05 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2.967288e+05 4.631968e+05 7.521388e+05 2.021644e+06 3.338154e+05 4.262007e+05 5.644635e+05 3.531643e+05 9.476322e+05 6.731020e+05 1.057530e+06 2.697906e+05 5.495190e+05 2.388960e+06 5.061515e+05 4.268296e+05 1.088062e+05 1.805173e+06 3.166591e+05 8.589265e+05 1.483771e+06 2.711505e+05 7.027867e+05 5.723212e+06 2.153804e+06 3.355983e+06 7.654040e+05 1.702980e+05 4.269990e+05 2.200890e+06 1.228012e+05 3.945128e+05 2.101020e+06 2.619936e+05 9.038490e+05 4.962669e+05 1.421699e+06 3.127025e+05 4.317592e+05 3.931193e+06 2.760559e+06 1.000559e+05 1.936192e+05 3.870960e+06 8.464419e+05 1.058162e+06 1.959985e+06 1.738772e+06 7.043092e+05 2.919963e+05 2.261341e+06 1.053461e+06 1.311647e+06 8.647010e+05 7.026804e+05 2.611973e+06 3.497253e+05 2.731331e+05 9.004674e+05 1.210724e+06 5.931374e+05 5.989956e+05 2.631772e+05 2.964731e+05 5.765126e+05 3.881193e+05 2.207110e+06 5.924927e+05 5.882802e+05 2.271323e+05 1.195238e+06 7.950946e+05 1.358763e+06 5.692572e+05 8.518730e+05 5.012579e+06 1.419823e+06 2.133594e+05 5.337266e+05 9.222725e+05 1.577288e+05 1.415291e+06 6.021346e+05 4.816577e+05 3.796189e+05 3.285611e+05 1.695537e+05 9.175245e+05 2.449161e+05 1.884915e+06 4.825402e+05 7.294928e+05 4.218886e+05 3.450939e+05 7.591284e+05 2.760186e+05 6.832735e+05 1.040742e+06 C20 H39 N5 O4_1.847 2.991042e+04 5.200274e+05 5.977867e+05 8.231478e+05 4.468298e+04 2.888325e+05 6.096876e+05 5.601393e+05 39952.58 7.852042e+05 4.430844e+05 6.735218e+05 49154.18 5.421074e+05 4.761024e+05 6.316828e+05 3.829141e+04 5.414395e+05 5.450029e+05 6.631670e+05 8.994214e+04 5.139094e+05 5.537575e+05 6.886923e+05 59948.166 6.209594e+05 4.967233e+05 5.427149e+05 6.142988e+04 5.570156e+05 6.253635e+05 6.896283e+05 79524.84 5.122807e+05 5.498520e+05 5.112487e+05 8.167768e+04 6.094591e+05 6.107052e+05 5.689833e+05 5.735354e+04 4.315161e+05 7.071033e+05 5.632587e+05 2.897298e+04 6.444817e+05 6.055542e+05 5.058290e+05 3.203414e+05 5.123437e+05 3.663795e+05 5.497566e+05 2.570815e+05 3.890716e+05 7.875161e+05 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3.208322e+05 3.882265e+05 5.770482e+05 4.334471e+05 4.536580e+05 5.751827e+05 5.486181e+05 4.952998e+05 2.525570e+05 8.495155e+05 9.407496e+05 1.289107e+05 2.353087e+05 3.658783e+05 3.126303e+05 3.406771e+05 5.964852e+05 8.338494e+05 7.018021e+05 7.213263e+05 6.362379e+05 4.752954e+05 5.127714e+05 3.369596e+05 4.805814e+05 8.982237e+05 7.394696e+05 2.034365e+05 4.459214e+05 4.632528e+05 2.552460e+05 1.869674e+05 7.819240e+05 4.209949e+05 3.387848e+05 3.926266e+05 4.766810e+05 4.503482e+05 5.995950e+05 2.375730e+05 3.913260e+05 4.469637e+05 5.558933e+05 7.397794e+05 4.746504e+05 5.085475e+05 8.590465e+05 7.296715e+05 1.990819e+06 4.679688e+05 4.230273e+05 1.993904e+06 4.705664e+05 4.475323e+05 4.557995e+05 2.171605e+05 2.118070e+06 4.629020e+05 2.181213e+06 6.487614e+05 1.475768e+05 4.850346e+05 2.221734e+06 2.612975e+05 1.907485e+06 2.281841e+06 4.083733e+05 1.770551e+06 1.831207e+06 2.102959e+06 4.511697e+05 4.062683e+05 5.496132e+05 4.186568e+05 6.284753e+05 2.620649e+05 1.035284e+06 5.493825e+05 1.411122e+05 6.110377e+05 5.145168e+05 5.071597e+05 2.640244e+05 7.131456e+05 1.981271e+06 7.475275e+05 9.865435e+05 5.052891e+05 6.072057e+05 6.284582e+05 1.303860e+05 5.236814e+05 5.033875e+05 8.988402e+05 4.363358e+05 2.459369e+05 5.737072e+05 2.134500e+05 4.070992e+05 6.176443e+05 6.031807e+05 3.366756e+05 5.185914e+05 5.440109e+05 7.575529e+05 3.436581e+05 3.220000e+05 3.600066e+05 2.050565e+06 4.930791e+05 6.830023e+05 9.217683e+05 5.744156e+05 3.507078e+05 5.546349e+05 6.273550e+05 8.430685e+05 9.808448e+05 6.209901e+05 5.378877e+05 4.447122e+05 3.764049e+05 1.150024e+06 3.462844e+05 3.740959e+05 1.780759e+05 3.832489e+05 5.019161e+05 6.114765e+05 5.374764e+05 C13 H29 N O7_1.847 5.030920e+04 1.046402e+06 9.052364e+05 1.029492e+06 7.266357e+04 7.949605e+05 9.252195e+05 1.227108e+06 54543.18 9.294873e+05 8.918421e+05 1.055741e+06 58264.51 9.043577e+05 8.432684e+05 9.800645e+05 6.855267e+04 1.032880e+06 1.086057e+06 9.987364e+05 1.119663e+05 7.369555e+05 9.923110e+05 1.267739e+06 80705.982 7.997281e+05 9.417776e+05 6.933542e+05 7.965973e+04 1.108853e+06 1.060148e+06 1.103370e+06 95793.55 8.278093e+05 9.889436e+05 9.003827e+05 1.025529e+05 1.105178e+06 9.621959e+05 9.784596e+05 7.655192e+04 7.783652e+05 8.888595e+05 1.177088e+06 3.899007e+04 9.400196e+05 1.015181e+06 9.079988e+05 1.584948e+05 6.624142e+05 1.084578e+05 7.599210e+05 2.002207e+05 6.522569e+05 3.124572e+05 2.898242e+05 1.306215e+06 4.071302e+05 3.086295e+05 6.904484e+05 5.165637e+05 2.118449e+05 2.097504e+05 6.324538e+05 1.457490e+05 2.180632e+06 4.533207e+05 1.139143e+05 5.396345e+05 2.906269e+05 2.970609e+05 1.883146e+05 1.546403e+05 2.817010e+05 1.844967e+06 1.062686e+06 2.043913e+06 2.320600e+06 1.041158e+06 3.536211e+06 1.378685e+06 8.876199e+05 1.197468e+06 2.181790e+06 7.971812e+05 3.196884e+06 1.943539e+06 5.002910e+05 1.900549e+06 1.162034e+06 1.381280e+06 3.908536e+06 5.977583e+05 2.134132e+05 2.303399e+05 5.255845e+05 6.276340e+05 1.242952e+05 9.208498e+04 9.542666e+05 2.683220e+05 4.466727e+05 1.040748e+05 4.261720e+05 2.813961e+05 3.379577e+05 2.476680e+05 2.795882e+05 4.785831e+05 2.376735e+05 8.338902e+05 4.219950e+05 4.440350e+05 1.619467e+05 3.309703e+05 1.844084e+05 3.417668e+05 4.280912e+05 3.403867e+05 6.972266e+05 1.344695e+05 1.047140e+05 1.541858e+05 2.697276e+05 1.064628e+05 2.458345e+05 6.749874e+05 1.484766e+05 3.321098e+05 4.467429e+05 7.776049e+05 6.095573e+05 5.245069e+05 7.676273e+05 4.455143e+05 4.544418e+05 7.266732e+05 6.871435e+05 8.214270e+05 8.368417e+05 1.828831e+05 1.004657e+06 8.798794e+05 5.230117e+05 5.800997e+05 4.347577e+05 1.000001e+06 2.404823e+05 4.082019e+05 1.054185e+06 7.922439e+05 1.213188e+06 8.284552e+05 5.168273e+05 1.148235e+06 2.869290e+05 3.856674e+05 6.583850e+05 4.768809e+05 3.174742e+05 2.278386e+05 4.444900e+05 5.170591e+05 6.990861e+05 1.606240e+06 1.119964e+06 4.582448e+05 1.028612e+06 6.610447e+05 1.127003e+06 1.924704e+06 6.099873e+05 7.608850e+05 8.495484e+05 1.042415e+06 1.199026e+06 2.273944e+05 1.916853e+05 2.906547e+05 3.526306e+05 1.081864e+06 2.130149e+06 6.038761e+05 3.197500e+06 4.261314e+05 7.133472e+05 1.300487e+06 3.831419e+05 1.439791e+06 1.899958e+06 3.569662e+06 1.185632e+06 7.489257e+05 3.396084e+05 2.541271e+06 6.186028e+05 2.000780e+06 4.656304e+06 1.865883e+06 3.987769e+06 1.493308e+06 3.815960e+06 7.597754e+05 2.504693e+06 2.913852e+06 8.750306e+05 1.562897e+06 4.446413e+05 2.818389e+06 1.944461e+06 4.461306e+05 6.272292e+05 1.774564e+06 2.233730e+06 2.473677e+05 2.006516e+06 7.332140e+06 9.014134e+05 1.257668e+06 1.242659e+06 1.939064e+06 1.597674e+06 3.320681e+05 8.732336e+05 6.942578e+05 1.300967e+06 7.604026e+05 6.875913e+05 8.653817e+05 5.797921e+05 3.738837e+05 1.726954e+06 1.364529e+06 2.841054e+05 8.262450e+05 8.241824e+05 2.174689e+06 7.646340e+05 7.835151e+05 8.633311e+05 1.409430e+07 8.232799e+05 7.088554e+05 1.060407e+06 1.022922e+06 9.518226e+05 3.134137e+05 4.287587e+05 8.247326e+05 9.691084e+05 1.715677e+06 7.877242e+05 5.343350e+05 8.753699e+05 1.556070e+06 9.138516e+05 1.213032e+06 8.149705e+05 7.746535e+05 3.334690e+05 6.686101e+05 9.912537e+05 C11 H22 N10_1.848 5.310674e+04 3.645130e+06 3.797903e+06 5.181464e+06 7.314521e+04 2.022218e+06 3.750437e+06 4.386645e+06 74434.82 3.479008e+06 3.516730e+06 3.979243e+06 93792.25 3.609175e+06 3.301122e+06 4.313636e+06 8.869150e+04 3.526582e+06 3.278747e+06 4.118352e+06 2.001017e+05 3.666537e+06 3.667079e+06 3.695144e+06 141331.910 3.998218e+06 3.395588e+06 3.665310e+06 1.354606e+05 3.671946e+06 4.119426e+06 4.274372e+06 164826.19 3.348429e+06 3.081142e+06 3.476303e+06 1.526914e+05 3.717682e+06 4.338391e+06 4.623134e+06 1.093414e+05 2.330775e+06 3.617495e+06 4.984384e+06 6.233508e+04 3.428514e+06 3.241366e+06 3.665572e+06 2.701020e+06 3.731125e+06 1.555984e+06 1.820154e+06 1.239131e+06 2.432460e+06 1.982734e+06 1.211605e+06 3.132355e+06 2.213711e+06 2.188391e+06 5.007418e+06 4.202669e+06 2.722823e+06 3.260702e+06 4.106728e+06 4.061853e+06 5.755569e+06 5.511153e+06 3.104885e+06 3.593363e+06 3.497974e+06 4.265517e+06 3.934727e+06 5.100432e+06 4.712660e+06 5.197460e+06 3.963443e+06 5.645054e+06 5.391325e+06 2.171251e+06 5.841372e+06 3.355115e+06 3.960218e+06 4.039917e+06 5.200838e+06 3.569801e+06 5.920986e+06 4.132165e+06 1.819594e+06 4.742281e+06 4.099750e+06 5.971301e+06 4.855860e+06 3.823309e+06 3.693897e+06 4.570296e+06 3.550439e+06 6.951038e+06 1.909100e+06 3.703087e+06 3.399420e+06 3.472475e+06 5.435986e+06 1.507018e+06 3.861107e+06 5.669965e+06 4.294267e+06 3.834496e+06 5.438539e+06 2.428127e+06 1.427831e+06 3.348168e+06 7.485527e+06 4.868253e+06 2.933826e+06 2.442223e+06 2.098569e+06 2.459751e+06 1.864318e+06 1.857875e+06 5.309960e+06 1.613140e+06 1.422285e+06 1.988168e+06 3.098540e+06 3.034249e+06 1.850757e+06 5.274553e+06 1.753637e+06 1.990880e+06 2.194745e+06 3.775847e+06 1.865704e+06 4.430158e+06 3.449505e+06 3.907251e+06 3.011410e+06 4.703755e+06 4.644225e+06 4.259861e+06 4.691022e+06 1.092332e+06 6.691546e+06 5.761569e+06 1.262733e+06 1.452244e+06 2.164439e+06 4.033226e+06 3.611494e+06 4.311083e+06 7.563325e+06 5.432754e+06 8.872604e+06 5.253439e+06 2.745701e+06 3.770919e+06 1.963091e+06 6.313303e+06 5.880926e+06 8.542650e+06 2.100719e+06 4.715841e+06 3.497355e+06 1.791249e+06 1.487818e+06 4.637461e+06 2.418510e+06 1.525207e+06 2.019086e+06 2.807122e+06 2.179550e+06 3.136475e+06 1.739013e+06 3.425875e+06 2.344976e+06 5.401728e+06 4.009720e+06 3.488061e+06 3.628845e+06 5.686303e+06 4.480979e+06 7.633576e+06 2.484596e+06 2.130763e+06 8.387349e+06 2.075275e+06 2.124529e+06 3.004220e+06 1.899468e+06 8.141805e+06 2.179506e+06 1.470674e+07 3.043798e+06 1.282058e+06 2.940817e+06 1.441145e+07 1.275906e+06 1.177515e+07 1.247045e+07 1.895424e+06 1.268652e+07 1.270786e+07 1.171021e+07 2.539859e+06 2.397028e+06 2.508201e+06 2.089755e+06 4.282005e+06 1.279332e+06 6.441039e+06 3.456838e+06 1.641750e+06 3.427745e+06 2.509359e+06 4.342682e+06 1.485677e+06 4.286120e+06 1.669892e+07 4.373830e+06 4.860141e+06 2.468598e+06 3.992373e+06 2.666277e+06 1.060313e+06 2.621728e+06 3.076785e+06 3.959476e+06 3.233303e+06 2.784484e+06 2.557190e+06 1.707733e+06 2.821552e+06 5.951095e+06 3.689896e+06 2.323835e+06 3.877279e+06 2.996008e+06 4.464298e+06 2.245420e+06 2.362875e+06 1.548807e+06 8.436495e+06 3.601407e+06 4.313379e+06 5.503902e+06 3.719463e+06 4.820008e+06 6.221670e+06 4.498030e+06 4.237595e+06 7.969044e+06 4.562615e+06 2.535058e+06 2.987331e+06 2.192115e+06 6.006848e+06 1.237970e+06 1.275448e+06 2.321321e+06 1.938702e+06 3.028102e+06 6.265628e+06 5.222014e+06 C9 H30 N9 O P_1.851 3.311014e+04 1.011682e+06 1.304741e+06 1.548827e+06 4.904118e+04 4.217342e+05 1.127570e+06 1.249727e+06 40901.27 1.062950e+06 1.224477e+06 1.128308e+06 47987.00 1.174210e+06 1.010571e+06 9.710442e+05 4.938237e+04 1.057951e+06 1.121534e+06 1.231217e+06 9.873573e+04 9.316281e+05 1.180918e+06 1.257639e+06 66581.303 1.194239e+06 9.266451e+05 1.067336e+06 6.758092e+04 1.065740e+06 1.236612e+06 1.398715e+06 85853.84 7.061691e+05 1.155370e+06 1.204887e+06 8.492385e+04 1.036123e+06 1.208962e+06 9.576747e+05 6.680681e+04 1.039397e+06 1.172286e+06 1.163701e+06 3.577446e+04 1.101575e+06 1.217300e+06 1.004919e+06 4.352681e+05 8.913147e+05 5.420785e+05 8.449892e+05 4.976656e+05 9.422381e+05 7.261496e+05 2.720906e+05 1.036227e+06 8.253487e+05 7.813719e+05 1.022951e+06 1.244740e+06 6.082498e+05 1.058413e+06 1.332095e+06 1.088099e+06 2.040090e+06 1.807500e+06 8.050382e+05 1.084044e+06 8.657373e+05 1.314650e+06 1.114962e+06 1.095922e+06 1.313429e+06 1.409810e+06 1.223021e+06 1.710645e+06 1.715418e+06 6.758633e+05 1.803592e+06 9.877097e+05 1.205995e+06 1.224058e+06 1.482265e+06 7.666317e+05 1.650283e+06 8.593755e+05 6.977206e+05 1.365920e+06 1.088083e+06 1.550771e+06 1.724974e+06 8.719825e+05 1.118210e+06 1.835478e+06 1.335406e+06 1.924187e+06 5.726399e+05 1.060370e+06 9.760549e+05 1.044545e+06 1.556423e+06 4.957670e+05 1.275645e+06 1.343180e+06 1.504029e+06 8.244388e+05 1.387785e+06 6.546458e+05 4.837798e+05 1.074382e+06 1.741322e+06 1.527349e+06 6.415204e+05 9.416951e+05 5.992589e+05 6.841815e+05 8.018730e+05 6.858946e+05 1.376377e+06 2.592222e+05 5.579351e+05 4.158486e+05 8.524152e+05 8.578068e+05 7.035678e+05 1.486802e+06 7.314186e+05 7.026053e+05 7.614054e+05 1.053242e+06 8.035198e+05 1.055621e+06 9.589567e+05 1.002543e+06 1.080851e+06 1.287157e+06 1.284129e+06 1.063259e+06 1.464972e+06 3.884237e+05 2.074829e+06 2.135957e+06 3.983739e+05 6.317345e+05 8.029955e+05 1.122635e+06 9.658606e+05 1.217443e+06 1.164024e+06 1.185035e+06 1.375996e+06 1.289746e+06 5.585029e+05 1.112973e+06 5.807820e+05 1.590578e+06 1.344442e+06 1.624675e+06 7.302881e+05 1.055928e+06 7.549786e+05 6.389340e+05 4.931261e+05 1.107761e+06 7.622635e+05 4.573136e+05 6.977597e+05 6.156107e+05 6.212972e+05 1.003903e+06 4.004279e+05 7.829294e+05 7.374174e+05 1.483970e+06 1.066715e+06 9.055165e+05 8.655729e+05 9.663420e+05 1.387262e+06 2.192443e+06 7.837834e+05 7.597311e+05 2.556855e+06 6.733250e+05 6.615269e+05 7.656315e+05 4.640074e+05 2.496864e+06 9.447168e+05 3.066062e+06 9.487244e+05 4.215842e+05 7.337096e+05 2.212970e+06 4.444319e+05 2.656504e+06 3.725061e+06 7.443011e+05 2.941882e+06 2.773737e+06 3.157979e+06 7.137347e+05 8.902347e+05 1.046318e+06 8.215431e+05 1.256616e+06 3.520368e+05 1.535286e+06 9.698444e+05 4.706320e+05 1.063767e+06 8.764544e+05 1.198657e+06 4.996472e+05 1.399791e+06 2.630663e+06 9.679381e+05 1.510740e+06 7.347989e+05 1.044039e+06 9.504508e+05 2.931869e+05 9.255082e+05 1.097724e+06 1.327185e+06 8.947236e+05 9.410532e+05 8.708688e+05 6.797415e+05 7.581306e+05 1.517015e+06 1.252180e+06 8.290887e+05 1.071667e+06 8.634740e+05 1.371875e+06 7.982496e+05 9.176336e+05 5.661771e+05 2.186962e+06 1.211844e+06 1.252921e+06 1.328330e+06 9.571349e+05 1.198897e+06 9.421359e+05 9.530013e+05 1.250721e+06 2.236316e+06 1.235101e+06 7.004011e+05 8.977962e+05 7.378254e+05 2.254914e+06 4.364806e+05 5.863202e+05 7.517601e+05 8.376237e+05 1.078709e+06 1.174597e+06 1.236297e+06 C13 H20 O4_1.851 4.807465e+04 2.633185e+05 3.787057e+05 4.288161e+05 6.982728e+04 1.564300e+05 3.936431e+05 3.607966e+05 55236.06 3.346744e+05 3.904387e+05 5.382721e+05 62785.60 3.070054e+05 2.765400e+05 3.196019e+05 9.336309e+04 3.447757e+05 4.135062e+05 4.075639e+05 1.311136e+05 2.654346e+05 4.260885e+05 4.018686e+05 89491.689 3.629585e+05 3.907066e+05 2.791972e+05 9.864598e+04 3.707761e+05 4.258807e+05 4.568588e+05 120005.74 2.345754e+05 3.141297e+05 4.561181e+05 1.103227e+05 3.382860e+05 3.505888e+05 3.272673e+05 9.352653e+04 3.953481e+05 4.318310e+05 4.524454e+05 4.447573e+04 1.850929e+05 5.062941e+05 2.822671e+05 1.782176e+05 3.175400e+05 1.351864e+05 1.813447e+05 1.330975e+05 3.916120e+05 3.693472e+05 4.566396e+05 2.398813e+05 2.091771e+05 1.895571e+05 2.381009e+05 5.454476e+05 2.093565e+05 2.139724e+05 3.401075e+05 2.619072e+05 1.521404e+05 1.184668e+05 3.531914e+05 2.509608e+05 3.584460e+05 4.214191e+05 3.680669e+05 5.827731e+05 3.194125e+05 2.472160e+05 1.451875e+05 1.901502e+05 2.886996e+05 2.434596e+06 2.328632e+05 2.293374e+05 3.605767e+05 1.119932e+05 2.125942e+05 1.763725e+05 1.215639e+05 1.564931e+05 8.087166e+04 2.839219e+05 1.409908e+05 2.895207e+05 2.152832e+05 2.791627e+05 3.244321e+05 3.945370e+05 4.468134e+05 4.553117e+05 1.262234e+05 3.803656e+05 4.373553e+05 2.757200e+05 3.200283e+05 1.019451e+05 2.106201e+05 3.541833e+05 5.581623e+05 1.469135e+05 3.096489e+05 1.544131e+05 1.345209e+05 1.327295e+05 2.754665e+05 4.707392e+05 1.300783e+05 3.318917e+05 1.874323e+05 2.044757e+05 1.270748e+05 1.463700e+05 1.764035e+05 1.368744e+05 1.941803e+05 1.020461e+05 3.809794e+05 2.308259e+05 1.715184e+05 3.252883e+05 1.897837e+05 1.539503e+05 2.031321e+05 2.886733e+05 1.697227e+05 1.462636e+05 3.130471e+05 2.609905e+05 2.228003e+05 3.142226e+05 3.747320e+05 2.740186e+05 2.578081e+05 2.898530e+05 7.156015e+05 3.552662e+05 3.657631e+05 5.161199e+05 5.454112e+05 6.946704e+05 6.420903e+05 2.339349e+06 7.987761e+05 4.899754e+05 5.250041e+05 2.401106e+05 2.725080e+05 2.754372e+05 3.746065e+05 6.095220e+05 2.053578e+05 3.256986e+05 2.230088e+05 3.010294e+05 3.992610e+05 2.375187e+05 2.133858e+05 3.684273e+05 3.530440e+05 1.192402e+05 5.163522e+05 1.687528e+05 1.441016e+05 2.793787e+05 1.337756e+05 3.869471e+05 3.595162e+05 5.928212e+05 4.254104e+05 4.122623e+05 1.983031e+05 2.086440e+05 3.726768e+05 9.567816e+05 2.742021e+05 2.792474e+05 4.245603e+05 8.307964e+05 4.794966e+05 3.525980e+05 3.397896e+05 5.038502e+05 1.437206e+05 3.505990e+05 5.155195e+05 1.384266e+05 4.928909e+05 1.282147e+06 2.442741e+05 6.044051e+05 7.525786e+05 1.465143e+05 5.172958e+05 2.236782e+05 5.966578e+05 1.770688e+05 4.746056e+05 3.196923e+05 1.774518e+05 2.127909e+05 9.554304e+04 3.082764e+05 1.921308e+05 1.261975e+05 2.578956e+05 2.255576e+05 3.416542e+05 9.639667e+05 3.959763e+05 6.234325e+05 2.713983e+05 3.553196e+05 4.923298e+05 3.407889e+05 2.886666e+05 1.266875e+05 6.040450e+05 3.703339e+05 4.006777e+05 2.940479e+05 5.158745e+05 5.312721e+05 4.720119e+05 3.219395e+05 5.142315e+05 3.048475e+05 3.430282e+05 1.943436e+05 1.483818e+05 2.796910e+05 1.673887e+05 2.068445e+05 2.170454e+05 5.604735e+05 2.261749e+05 1.971105e+05 4.105058e+05 1.237559e+05 1.324731e+05 3.455682e+05 1.487056e+05 2.195199e+05 1.904170e+05 3.109307e+05 2.686804e+05 1.734791e+05 2.902395e+05 5.623293e+05 3.875300e+05 3.225938e+05 2.705876e+05 5.519453e+05 7.130602e+05 3.436532e+05 1.774879e+05 C41 H81 N O3 S2_1.852 4.074204e+06 2.069293e+06 2.476270e+06 2.203569e+06 5.228565e+04 1.392706e+06 1.933805e+06 2.039568e+06 42558.46 2.210044e+06 2.160162e+06 2.107612e+06 43338.60 1.934741e+06 1.797626e+06 2.449954e+06 3.544708e+04 2.222722e+06 1.863993e+06 2.080448e+06 1.046042e+05 2.043763e+06 2.448557e+06 3.542956e+05 79377.473 2.973869e+06 1.899424e+06 2.216845e+06 6.499817e+04 2.223866e+06 2.093460e+06 2.241297e+06 72264.70 1.749476e+06 2.018907e+06 2.395589e+06 6.874043e+04 1.927426e+06 2.295574e+06 1.744916e+06 5.735783e+04 1.773523e+06 1.905361e+06 2.402843e+06 3.155909e+04 1.861799e+06 2.942596e+06 1.356611e+06 1.822091e+06 1.878662e+06 2.215909e+06 2.244702e+06 1.907449e+06 1.851397e+06 1.924814e+06 8.939125e+05 2.306437e+06 2.488088e+06 2.245326e+06 2.165787e+06 2.187109e+06 2.687512e+06 2.042756e+06 4.112729e+06 1.356615e+06 2.275449e+06 1.989238e+06 1.747003e+06 1.931296e+06 2.404438e+06 2.290035e+06 2.400459e+06 4.885137e+06 1.840630e+06 1.899265e+06 1.847332e+06 2.103136e+06 2.500436e+06 1.485645e+06 1.501412e+06 1.914658e+06 1.829186e+06 2.246667e+06 1.474297e+06 1.895034e+06 2.185136e+06 1.915967e+06 1.635491e+06 1.956657e+06 1.419122e+06 1.602322e+06 1.458116e+06 1.749753e+06 2.596992e+06 1.364991e+06 1.087275e+06 2.148688e+06 1.776372e+06 2.615956e+06 1.437017e+06 1.822991e+06 1.879125e+06 1.984448e+06 1.398141e+06 1.492657e+06 2.020016e+06 1.650610e+06 2.145807e+06 4.009611e+06 2.140877e+06 2.656066e+06 1.934602e+06 1.196620e+06 1.803142e+06 1.736086e+06 2.885244e+06 1.386028e+06 2.166900e+06 2.312399e+06 2.003561e+06 1.273661e+06 1.263231e+06 1.471190e+06 1.826604e+06 2.054269e+06 2.481503e+06 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1.751596e+06 3.561901e+06 1.693903e+06 2.258878e+06 2.842222e+06 1.426974e+06 1.619123e+06 1.922338e+06 1.960511e+06 2.387142e+06 1.980166e+06 3.828551e+06 1.580018e+06 2.121543e+06 1.887349e+06 1.743734e+06 1.172393e+06 1.052554e+06 1.897716e+06 2.372082e+06 1.641187e+06 1.330145e+06 1.439076e+06 2.009291e+06 1.463461e+06 1.958383e+06 2.110810e+06 1.739388e+06 2.207050e+06 2.444725e+06 1.938290e+06 1.862186e+06 1.618375e+06 2.578900e+06 1.938274e+06 5.845488e+06 3.541449e+06 1.489847e+06 2.597047e+06 3.217594e+06 2.176943e+06 1.986812e+06 3.325788e+06 2.016619e+06 1.868047e+06 2.052028e+06 1.472270e+06 3.096321e+06 1.327121e+06 2.666935e+06 3.555677e+06 2.100937e+06 9.362121e+05 2.164626e+06 3.919887e+06 1.855661e+06 4.634220e+06 1.891997e+06 2.112761e+06 C20 H43 N O10_1.854 3.172224e+04 1.908917e+05 2.358372e+05 1.543752e+05 4.855540e+04 1.670550e+05 1.722310e+05 1.917244e+05 47897.57 2.126493e+05 1.317489e+05 2.601651e+05 56426.85 1.938384e+05 2.297854e+05 1.185588e+05 4.924304e+04 1.687966e+05 2.565909e+05 1.816646e+05 1.292508e+05 1.220804e+05 1.857033e+05 1.839992e+05 79727.209 2.528600e+05 2.553864e+05 1.035964e+05 9.094197e+04 2.358333e+05 1.306579e+05 1.847377e+05 116467.78 1.306993e+05 2.226232e+05 2.421999e+05 1.055229e+05 1.367582e+05 2.459698e+05 1.531405e+05 7.389633e+04 2.765132e+05 1.546359e+05 2.087478e+05 2.896328e+04 1.656840e+05 2.166353e+05 7.032576e+04 1.067302e+05 8.739218e+04 8.992271e+04 1.069536e+05 1.197614e+05 1.857359e+05 1.902029e+05 9.872973e+04 1.965170e+05 1.453586e+05 1.631047e+05 9.664613e+04 2.758862e+05 1.223321e+05 1.881655e+05 1.250160e+05 1.488684e+05 6.790088e+05 1.975249e+05 1.453223e+05 1.523766e+05 1.527710e+05 1.539000e+05 1.442647e+05 9.602893e+04 2.225030e+05 6.812748e+05 1.937715e+05 6.349289e+05 6.925458e+05 1.222645e+06 1.065887e+06 2.802862e+05 1.326236e+05 2.490396e+05 3.233163e+05 2.681822e+05 7.490285e+05 3.252876e+05 7.216638e+04 6.342114e+05 4.924346e+05 2.840456e+05 8.152074e+05 9.217099e+04 1.066391e+05 8.456754e+04 8.323643e+04 2.235152e+05 1.077227e+05 1.086556e+05 9.136129e+04 9.641944e+04 1.288385e+05 9.435676e+04 1.586556e+05 1.440064e+05 1.839310e+05 1.352684e+05 1.347382e+05 1.013649e+05 1.230090e+05 2.334149e+05 1.238142e+05 1.820212e+05 2.058335e+05 8.097118e+04 1.074924e+05 9.363827e+04 1.653748e+05 1.283448e+05 1.160363e+05 1.186120e+05 1.213267e+05 7.908981e+04 2.185564e+05 9.107008e+04 1.159839e+05 1.841619e+05 1.469368e+05 1.128455e+05 1.101473e+05 1.347924e+05 7.263046e+05 7.254680e+04 1.130254e+05 1.339110e+05 1.178721e+05 6.355909e+04 1.804795e+05 1.114751e+05 1.021211e+05 1.330127e+05 1.328449e+05 1.676048e+05 6.999810e+04 6.898325e+04 1.570568e+05 2.190481e+05 1.275258e+05 2.323694e+05 1.519325e+05 9.231579e+04 3.411789e+05 1.719303e+05 1.486615e+05 1.897357e+05 6.597154e+04 2.618810e+05 1.839710e+05 2.360330e+05 1.488767e+05 1.433650e+05 1.424088e+05 7.352994e+04 1.338803e+05 5.285192e+05 2.224225e+05 9.713671e+04 2.365407e+05 1.550407e+05 1.091334e+05 5.145516e+05 9.931560e+04 2.041156e+05 9.880262e+04 8.649053e+04 2.502252e+05 1.827855e+05 1.765905e+05 1.653977e+05 1.225295e+05 2.738330e+05 3.873941e+05 1.225665e+05 9.401098e+05 1.286995e+05 1.253410e+05 1.105266e+05 9.423754e+04 3.938750e+05 1.962667e+05 1.632796e+06 2.751771e+05 1.327605e+05 2.213431e+05 8.848667e+05 8.916018e+04 3.515616e+05 1.990314e+06 4.788073e+05 1.467570e+06 5.129167e+05 1.552369e+06 1.349638e+05 4.079049e+05 3.573991e+05 1.551992e+05 1.964485e+05 7.136887e+04 8.800517e+05 2.090689e+05 1.487911e+05 1.128788e+05 5.290651e+05 5.092512e+05 8.424949e+04 5.097774e+05 1.695152e+06 1.189434e+05 1.186915e+05 1.638543e+05 2.969742e+05 2.272848e+05 1.019572e+05 9.197805e+04 1.596347e+05 1.864348e+05 2.898908e+05 1.005806e+05 1.160020e+05 8.693798e+04 2.048610e+05 2.436872e+05 3.437673e+05 1.213792e+05 1.328983e+05 2.280450e+05 4.213399e+05 1.663823e+05 2.172961e+05 7.107238e+04 6.927493e+06 1.056810e+05 1.356955e+05 2.252062e+05 4.055890e+05 2.246769e+05 2.096554e+05 1.153474e+05 4.234603e+05 1.989537e+05 4.068039e+05 1.349130e+05 8.047469e+04 8.724850e+04 4.534712e+05 3.180888e+05 5.662034e+05 1.350808e+05 1.677777e+05 1.346816e+05 1.169403e+05 1.172521e+05 C9 H17 N O2_1.855 1.910351e+05 7.675679e+05 1.198488e+05 1.753183e+06 8.788752e+04 9.531613e+05 1.232497e+06 1.284000e+05 70771.87 1.232132e+06 1.223643e+06 1.604653e+06 51420.39 1.057998e+06 1.229601e+06 1.360057e+06 8.002214e+05 1.161931e+06 1.405001e+06 2.210284e+05 1.526459e+05 1.259174e+06 1.062413e+05 1.747960e+06 92060.341 8.624478e+04 1.174489e+06 1.237830e+06 8.720428e+04 8.115916e+04 1.168106e+06 1.408249e+06 118434.25 8.343660e+05 1.385445e+06 1.295745e+06 1.110879e+05 1.105350e+06 1.917675e+06 1.646387e+06 1.105546e+05 1.783662e+05 2.810132e+05 1.994156e+06 3.675250e+05 1.157292e+06 1.029325e+05 1.263492e+06 1.429316e+05 7.379128e+04 2.951917e+05 4.000948e+05 1.299437e+05 1.207229e+05 9.441659e+04 1.342260e+05 1.010241e+05 1.299819e+05 1.272291e+05 2.259631e+05 1.246769e+05 1.482149e+05 1.013854e+05 1.425456e+05 1.617044e+05 1.603884e+05 1.073275e+05 1.345972e+05 1.105784e+05 9.151035e+04 1.085254e+05 1.158775e+05 1.055469e+05 1.412732e+05 8.467290e+04 9.133416e+04 1.243112e+05 1.095547e+05 1.292528e+05 1.379500e+05 1.616844e+05 8.200205e+04 1.491133e+05 7.929040e+04 1.225169e+05 1.550931e+05 1.376853e+05 5.986640e+04 1.244743e+05 9.934674e+04 1.077934e+05 7.824486e+04 1.133019e+05 7.921415e+05 1.385934e+05 8.614709e+04 1.596316e+05 1.712263e+05 9.697190e+04 7.797896e+04 7.765866e+04 9.850089e+04 7.806240e+04 1.151062e+05 1.449761e+05 2.014422e+05 1.090932e+05 1.485506e+05 4.206572e+05 9.534744e+04 1.043948e+05 1.116707e+05 9.561823e+04 2.645967e+05 1.878473e+05 1.019606e+05 1.016174e+05 1.280865e+05 1.109666e+05 1.121681e+05 2.369710e+05 4.562383e+05 1.324602e+05 1.043939e+05 1.446795e+05 1.293075e+05 1.072260e+05 1.047597e+05 7.469190e+04 9.036742e+04 1.278413e+05 3.361409e+08 1.263959e+05 9.483122e+04 8.390980e+04 1.461298e+05 9.854071e+04 1.251403e+05 1.061701e+05 9.751226e+04 1.667758e+05 1.065839e+05 1.077651e+05 1.040167e+05 1.125162e+05 9.110932e+04 1.673470e+05 1.145604e+05 8.846525e+04 1.247185e+05 8.218957e+04 1.500770e+05 1.330649e+05 1.008330e+05 1.068203e+05 9.731640e+04 1.862969e+05 9.780632e+04 1.612608e+05 6.182716e+04 1.046679e+05 1.115395e+05 8.545377e+04 1.061753e+05 1.120191e+05 6.770767e+04 1.145742e+05 1.899889e+05 1.585590e+05 1.186721e+05 1.149888e+05 1.108917e+05 1.765759e+05 1.126329e+05 1.089445e+05 7.215507e+04 9.974504e+04 1.337184e+05 1.012162e+05 9.398333e+04 1.812194e+05 1.282042e+05 1.157997e+05 1.074859e+05 1.971546e+05 1.511196e+05 1.098834e+05 1.161625e+05 1.252698e+05 1.638613e+05 1.298526e+05 9.380608e+04 1.252559e+05 1.583730e+05 1.731661e+05 6.283782e+05 4.084128e+05 1.269900e+05 8.914188e+04 1.153439e+05 9.606623e+04 1.513647e+05 1.326073e+05 8.802765e+04 1.197878e+05 7.528130e+04 1.338100e+05 1.074476e+05 1.251422e+05 1.588248e+05 1.145907e+05 1.098434e+05 7.508403e+04 1.111958e+05 1.028933e+05 3.965054e+05 1.921509e+05 1.754152e+05 9.366983e+04 6.853294e+05 2.623362e+06 1.288836e+05 9.200153e+04 1.960395e+05 1.185339e+05 9.641766e+04 2.640239e+05 2.431603e+05 1.176784e+05 1.482100e+05 1.158952e+05 1.674343e+05 1.274837e+05 1.069831e+05 1.346340e+05 1.301036e+05 1.266229e+05 1.330356e+05 3.751099e+05 9.584351e+04 1.148570e+05 1.041124e+05 1.157156e+05 1.006380e+05 9.113553e+04 1.163173e+05 1.177066e+05 1.021927e+05 1.072138e+05 9.594551e+04 4.235104e+05 1.289939e+05 2.548081e+05 8.133212e+04 1.667764e+05 1.496803e+06 1.739249e+05 1.330983e+05 8.400062e+04 1.530124e+05 1.338406e+05 1.104857e+05 C8 H12 O4_1.855 4.700803e+04 6.854129e+05 6.810294e+05 5.995558e+05 5.662551e+04 4.048661e+05 5.438516e+05 7.208710e+05 43134.86 6.539189e+05 5.871955e+05 6.711110e+05 48585.70 5.991544e+05 5.686965e+05 6.914134e+05 1.579450e+05 5.068640e+05 5.582829e+05 6.745681e+05 1.083428e+05 4.917082e+05 6.325386e+05 7.912201e+05 76289.662 5.760018e+05 5.426151e+05 6.571848e+05 8.600897e+04 4.968340e+05 6.982001e+05 6.812649e+05 104190.09 4.314586e+05 5.805842e+05 6.651435e+05 9.228892e+04 6.195039e+05 6.620516e+05 6.551392e+05 6.920464e+04 4.785881e+05 5.874978e+05 7.936671e+05 3.932436e+04 4.678065e+05 7.600728e+05 4.754901e+05 1.633043e+05 2.930095e+05 2.110681e+05 3.473585e+05 2.640612e+05 8.056336e+05 3.165188e+05 1.881676e+05 3.902068e+05 3.923674e+05 5.138919e+05 5.256736e+05 7.289514e+05 4.505977e+05 4.967591e+05 5.308301e+05 4.399309e+05 2.063138e+05 4.067674e+05 4.956435e+05 4.649646e+05 5.024747e+05 6.625153e+05 6.270451e+05 8.780211e+05 8.012981e+05 3.871126e+05 3.716567e+05 3.526679e+05 3.534610e+05 1.274331e+07 1.774141e+05 3.694762e+05 3.669126e+05 1.903602e+05 2.520095e+05 2.947451e+05 2.870508e+05 2.326613e+05 1.648525e+05 3.037998e+05 3.772049e+05 4.609282e+05 3.503305e+05 4.769475e+05 4.117609e+05 5.711992e+05 4.260476e+05 5.347477e+05 1.036489e+05 6.361107e+05 4.803579e+05 2.618054e+05 4.834875e+05 7.745328e+04 4.648901e+05 3.852887e+05 6.069932e+05 3.823589e+05 6.479858e+05 2.565803e+05 9.143043e+04 1.112742e+05 6.101682e+05 6.136622e+05 9.987362e+04 1.658651e+05 1.064853e+05 1.959370e+05 1.068619e+05 1.144509e+05 4.131506e+05 1.189748e+05 8.701930e+04 9.139077e+04 1.627122e+05 2.344056e+05 9.119903e+04 1.692488e+05 2.218054e+05 1.383298e+05 1.571308e+05 3.956231e+05 1.284832e+06 4.011949e+05 3.672563e+05 3.110471e+05 2.881694e+05 7.519863e+05 5.348587e+05 4.124830e+05 4.527619e+05 7.383665e+05 9.191646e+05 5.416292e+05 7.691663e+05 1.084746e+06 1.397987e+06 1.248793e+06 1.484010e+06 2.072295e+06 1.866873e+06 1.353048e+06 7.678867e+05 5.434443e+05 2.476517e+05 3.017669e+05 3.369784e+05 4.708825e+05 5.288678e+05 6.356092e+05 2.947724e+05 3.945084e+05 3.332051e+05 2.961157e+05 5.869274e+05 8.627847e+05 6.057095e+05 3.028484e+05 5.762711e+05 4.005229e+05 4.954389e+05 7.031380e+05 2.598793e+05 6.236810e+05 6.292192e+05 1.122447e+06 7.961833e+05 6.358150e+05 6.213495e+05 5.276483e+05 6.966939e+05 2.024540e+06 4.173580e+05 4.066400e+05 1.607317e+06 1.071126e+06 3.878242e+05 4.314278e+05 4.186061e+05 1.438351e+06 2.476484e+05 1.679573e+06 6.474202e+05 4.168880e+05 3.619007e+05 2.099475e+06 3.046666e+05 1.843761e+06 1.977744e+06 3.275060e+05 1.295713e+06 1.441910e+06 2.079147e+06 1.176591e+05 3.014672e+05 4.546476e+05 4.117993e+05 3.645416e+05 2.314452e+05 4.012622e+05 3.910020e+05 2.130521e+05 3.861467e+05 2.339592e+05 5.474920e+05 2.107452e+06 5.125630e+05 2.224378e+06 3.131780e+05 4.979600e+05 1.544321e+06 4.930484e+05 3.102566e+05 2.133157e+05 4.086432e+05 5.752365e+05 4.049979e+05 5.615673e+05 3.696506e+05 6.027919e+05 1.075719e+06 5.668777e+05 6.257458e+05 6.532352e+05 3.308939e+05 3.643444e+05 4.323236e+05 5.383068e+05 5.894286e+05 2.662958e+05 4.623823e+05 1.525086e+06 4.879849e+05 7.061376e+05 5.775089e+05 3.388824e+05 3.752741e+05 4.132190e+05 3.236863e+05 4.682017e+05 7.853636e+05 5.130792e+05 5.798138e+05 3.922203e+05 3.822569e+05 1.004266e+06 6.263131e+05 6.327058e+05 4.087117e+05 6.164262e+05 6.656112e+05 4.719872e+05 4.659864e+05 C7 H10 O2_1.856 7.022741e+05 1.461462e+06 1.536111e+06 1.529186e+06 1.030778e+05 2.030215e+05 1.017724e+06 2.182921e+06 46592.93 1.676278e+06 1.157536e+06 1.769885e+06 79959.52 8.486795e+05 1.062642e+06 1.468264e+06 1.846740e+05 1.152377e+06 1.154972e+06 1.358360e+06 1.004287e+05 9.627565e+05 1.747612e+06 1.065844e+06 90038.792 2.094746e+06 1.366138e+06 1.019115e+06 2.628154e+05 9.499373e+05 1.435146e+06 1.704840e+06 222166.31 1.103129e+06 1.356486e+06 1.370782e+06 2.113874e+05 1.088430e+06 1.523917e+06 1.430184e+06 1.090562e+05 1.400650e+06 1.180215e+06 1.430412e+06 9.029895e+04 1.027750e+06 1.745197e+06 1.180747e+06 3.552813e+05 7.302581e+05 9.409661e+05 9.995279e+05 6.605334e+05 6.979921e+05 6.875991e+05 1.318791e+06 1.146181e+06 9.830770e+05 1.381480e+06 1.123294e+06 1.952257e+06 1.603680e+06 1.547904e+06 1.846645e+06 1.832782e+06 6.773386e+05 6.677315e+05 1.669752e+06 1.280032e+06 9.514501e+05 1.599880e+06 1.636246e+06 1.852949e+06 4.111914e+06 3.164010e+05 4.873540e+05 5.641839e+05 6.062632e+05 2.016939e+06 9.769326e+05 3.626766e+05 6.651975e+05 4.503177e+05 7.714128e+05 5.690748e+05 7.802211e+05 7.772945e+05 6.123528e+05 5.684212e+05 6.152055e+05 1.118073e+06 5.420145e+05 4.842837e+05 5.084199e+05 1.492150e+06 6.385285e+05 1.311477e+06 2.277607e+05 7.371760e+05 5.953088e+05 4.295410e+05 7.846373e+05 2.172580e+05 7.038172e+05 1.414617e+06 7.099997e+05 5.562634e+05 8.604420e+05 3.917304e+05 2.385482e+05 3.625902e+05 1.268428e+06 8.200545e+05 1.066783e+06 3.884570e+05 2.375877e+05 2.156678e+05 6.134889e+05 3.387800e+05 8.332016e+05 1.210784e+06 8.375420e+05 1.808132e+05 5.685284e+05 5.325746e+05 2.814045e+05 4.030413e+05 4.106412e+05 3.827756e+05 2.782104e+05 6.323905e+05 4.269003e+05 3.649956e+05 7.096413e+05 4.711850e+05 3.802519e+05 6.949218e+05 2.211672e+05 5.775429e+05 7.350481e+05 2.663620e+05 7.285372e+05 8.318475e+05 2.147087e+05 3.083802e+05 6.252828e+05 4.859927e+05 5.311026e+05 5.139925e+05 8.566414e+05 5.909822e+05 3.764212e+05 6.150002e+05 8.151092e+05 2.934240e+05 2.998662e+05 8.751818e+05 6.537750e+05 5.581653e+05 4.616347e+05 4.284891e+05 7.103801e+05 4.223480e+05 3.613290e+05 9.169178e+05 5.658739e+05 7.139927e+05 1.125912e+06 5.171777e+05 7.033347e+05 6.298157e+05 4.415428e+05 7.692925e+05 7.251628e+05 1.514856e+06 8.906524e+05 1.519090e+06 1.552295e+06 6.445807e+06 1.422257e+06 9.590314e+06 1.949189e+06 1.674993e+06 6.534233e+06 1.750447e+06 1.956063e+06 2.497461e+06 3.725100e+06 5.024167e+06 2.791211e+06 7.292264e+06 9.796110e+05 9.570142e+05 2.080531e+06 1.006874e+07 1.006094e+06 6.181585e+06 6.409523e+06 1.359984e+06 7.696818e+06 4.345863e+06 6.601968e+06 2.172356e+06 1.666926e+06 3.413727e+06 3.018934e+06 3.330334e+06 1.487488e+06 2.269898e+06 4.573686e+06 1.237222e+06 1.863537e+06 1.154249e+06 2.372133e+06 2.194415e+06 3.629060e+06 5.783215e+06 3.209198e+06 3.031384e+06 3.196222e+06 1.721044e+06 2.381179e+06 7.825841e+05 1.742793e+06 1.543333e+06 2.759945e+06 2.972146e+06 3.148584e+06 5.302170e+06 1.690856e+06 1.209923e+06 8.193566e+06 1.428710e+06 2.897123e+06 1.931353e+06 9.420674e+05 1.241895e+06 1.164662e+06 1.131092e+06 8.945771e+05 1.159153e+06 1.258668e+06 1.660075e+06 2.663069e+06 1.156643e+06 1.952361e+06 2.030957e+06 1.815042e+06 1.281652e+06 2.092954e+06 2.217094e+06 7.842726e+05 2.011949e+06 7.875667e+05 3.304703e+06 4.779942e+05 7.010884e+05 5.552632e+05 8.844277e+05 1.301387e+06 2.621408e+06 1.609343e+06 C15 H26 N3 P S_1.856 7.450393e+04 1.354888e+06 1.138750e+06 1.119940e+06 1.049771e+05 7.383068e+05 1.339285e+06 1.312789e+06 77320.03 1.135321e+06 1.132747e+06 1.384556e+06 78509.87 1.094762e+06 1.026044e+06 1.164245e+06 6.603201e+04 1.026122e+06 1.067742e+06 1.591541e+06 1.523651e+05 8.654925e+05 1.275404e+06 1.169689e+06 108668.040 1.139610e+06 1.088133e+06 9.906076e+05 1.130978e+05 1.289318e+06 1.155978e+06 1.578228e+06 134796.57 8.473843e+05 1.185388e+06 1.153959e+06 1.493093e+05 1.002250e+06 1.252881e+06 1.307022e+06 1.150795e+05 1.011776e+06 1.113462e+06 1.256252e+06 5.721233e+04 9.795904e+05 1.466146e+06 9.960020e+05 5.254124e+05 8.711914e+05 3.320120e+05 9.511464e+05 5.895809e+05 1.157309e+06 6.332321e+05 3.958663e+05 8.476469e+05 9.249919e+05 5.470289e+05 8.528421e+05 7.570201e+05 5.251043e+05 3.793178e+05 1.164882e+06 7.645474e+05 3.705219e+06 5.997819e+05 3.308180e+05 1.079433e+06 5.028840e+05 1.007889e+06 5.127585e+05 4.179879e+05 3.480153e+05 2.758760e+06 1.294649e+06 3.377217e+06 1.706317e+06 3.001732e+06 3.602419e+06 1.551667e+06 1.378152e+06 1.812417e+06 1.709826e+06 1.286382e+06 3.682319e+06 2.477572e+06 7.000255e+05 2.783201e+06 2.325642e+06 1.730978e+06 3.055282e+06 6.355983e+05 5.091685e+05 4.912998e+05 8.265176e+05 6.847016e+05 1.762641e+05 3.111182e+05 6.993416e+05 3.553533e+05 4.584113e+05 1.592370e+05 7.398091e+05 2.279144e+05 5.223299e+05 3.524774e+05 3.285584e+05 4.572538e+05 2.228137e+05 7.805805e+05 7.813296e+05 7.581294e+05 1.665039e+05 3.818195e+05 1.796194e+05 4.762726e+05 3.892458e+05 4.785486e+05 9.811026e+05 3.446209e+05 1.723236e+05 1.441328e+05 2.709217e+05 1.532378e+05 2.111748e+05 6.500487e+05 1.648502e+05 5.251316e+05 3.942493e+05 9.217241e+05 5.130795e+05 1.194534e+06 1.064315e+06 6.788803e+05 5.350944e+05 1.205139e+06 9.136408e+05 4.623552e+05 1.012532e+06 1.117490e+06 8.837198e+05 8.236873e+05 8.697435e+05 1.582668e+06 1.241612e+06 1.729679e+06 1.055230e+06 1.424362e+06 1.774284e+06 1.253815e+06 1.985905e+06 1.449101e+06 7.463847e+05 5.305910e+05 4.421193e+05 8.266254e+05 1.147303e+06 7.080107e+05 6.852684e+05 1.998930e+05 6.844834e+05 7.182008e+05 8.927464e+05 2.122093e+06 1.290557e+06 6.929861e+05 1.113770e+06 8.657388e+05 9.077841e+05 2.423838e+06 7.003664e+05 9.945866e+05 8.137765e+05 1.685779e+06 1.390950e+06 7.416302e+05 5.637252e+05 7.378549e+05 7.866782e+05 1.365844e+06 2.391609e+06 9.299467e+05 2.352471e+06 8.788196e+05 1.133776e+06 1.971726e+06 6.162832e+05 1.737541e+06 2.160257e+06 3.189403e+06 1.862718e+06 8.856180e+05 8.077752e+05 2.745297e+06 8.032785e+05 2.549449e+06 2.759966e+06 1.901776e+06 4.203787e+06 2.420432e+06 3.657858e+06 1.350885e+06 2.899628e+06 2.633449e+06 1.450319e+06 1.954207e+06 8.194766e+05 3.837165e+06 2.266964e+06 5.059176e+05 1.172951e+06 1.979730e+06 2.451124e+06 6.938651e+05 1.979341e+06 7.035427e+06 1.164579e+06 1.939907e+06 1.658881e+06 2.331619e+06 1.763826e+06 2.829576e+05 1.638914e+06 1.357320e+06 1.435854e+06 8.074681e+05 1.247998e+06 1.575527e+06 1.064257e+06 7.498114e+05 2.308830e+06 1.254756e+06 4.797918e+05 9.815987e+05 1.595634e+06 2.721375e+06 8.973027e+05 1.137658e+06 8.744999e+05 9.998036e+06 7.327384e+05 8.154112e+05 1.393505e+06 1.296680e+06 1.319962e+06 5.564917e+05 7.248892e+05 1.295051e+06 1.238917e+06 1.666637e+06 1.064046e+06 6.668364e+05 1.715508e+06 2.432827e+06 1.029035e+06 1.562485e+06 1.095465e+06 9.496118e+05 5.299661e+05 8.294244e+05 1.057600e+06 Gentianamine_1.858 6.508091e+05 2.001717e+05 1.630913e+05 1.445891e+05 4.523338e+04 1.547591e+05 1.930274e+05 1.936907e+05 34579.94 1.783299e+05 1.959062e+05 1.795852e+05 37009.98 1.401855e+05 2.121559e+05 1.645994e+05 3.106071e+04 1.748616e+05 1.647374e+05 1.917727e+05 8.121787e+04 1.195665e+05 2.623328e+05 2.124091e+05 63049.390 1.538049e+05 1.451885e+05 1.739759e+05 7.787621e+04 1.087500e+05 2.104631e+05 2.315981e+05 89039.60 1.001752e+05 1.915535e+05 1.215335e+05 8.716907e+04 1.864204e+05 1.541766e+05 1.988067e+05 6.315797e+04 8.117080e+04 1.592795e+05 2.992864e+05 3.259605e+04 9.853480e+04 1.656078e+05 1.154231e+05 1.018276e+05 7.317018e+05 1.055448e+05 3.022002e+05 9.996444e+04 1.462110e+05 6.649818e+04 2.078325e+05 6.235406e+05 1.420287e+05 1.068957e+06 4.137900e+05 9.988541e+04 1.609048e+05 1.289934e+06 1.812596e+06 9.636523e+04 3.836646e+05 6.291144e+04 1.070912e+05 6.552260e+04 8.819830e+04 6.749660e+04 1.488092e+05 8.755806e+04 9.077181e+04 1.150596e+05 7.551354e+04 3.099891e+05 5.601494e+04 1.860148e+05 9.312922e+04 6.296022e+04 4.851469e+04 4.653754e+05 6.140289e+05 3.653460e+05 9.269999e+04 9.376238e+04 4.271270e+04 6.763417e+04 6.228597e+04 2.119030e+05 7.429483e+04 8.116295e+04 9.820501e+05 7.080051e+05 4.106196e+05 1.029700e+05 1.352720e+05 6.140827e+04 2.539669e+05 8.013634e+04 4.319623e+05 9.398630e+04 9.168870e+04 2.352857e+05 6.727049e+05 1.136063e+05 1.999297e+05 1.467815e+05 8.164373e+04 1.052082e+05 2.059233e+05 7.694492e+04 1.825537e+05 1.049372e+05 1.870643e+05 6.136943e+04 9.209196e+05 1.458301e+05 9.672410e+04 1.052978e+05 1.764695e+05 7.815781e+04 1.265457e+05 1.991761e+05 1.616928e+05 7.211765e+04 3.508709e+05 5.586793e+04 6.763821e+04 1.055230e+05 1.020137e+05 8.949930e+04 7.944530e+04 2.308167e+05 8.665286e+05 1.381240e+05 4.556855e+05 8.185720e+04 6.061947e+04 5.922995e+05 8.494791e+04 2.270486e+05 1.630950e+05 7.482739e+04 3.290726e+05 9.253785e+04 9.235846e+04 6.423173e+04 1.023139e+05 1.464245e+05 2.589284e+05 6.053668e+04 3.314237e+05 4.509074e+05 4.838851e+05 1.845876e+05 2.569860e+05 9.172055e+04 5.693961e+04 1.220972e+05 1.779955e+05 5.335726e+05 1.813214e+05 5.051597e+05 5.936834e+05 6.942524e+05 7.192480e+04 1.233841e+05 1.098513e+05 2.450776e+05 8.975083e+04 1.011989e+05 8.214465e+04 1.052922e+05 1.096514e+05 1.737839e+05 1.276420e+05 2.026445e+05 6.350153e+04 2.564601e+05 9.985228e+04 3.284746e+05 1.089451e+05 7.309117e+05 9.195502e+04 9.106119e+04 9.830900e+04 2.449040e+05 1.246766e+05 1.162699e+06 4.398763e+05 1.001080e+05 1.192703e+05 1.121516e+05 5.467720e+04 1.010311e+05 1.054867e+05 7.765692e+04 1.042129e+05 8.492757e+04 1.381092e+05 1.154382e+05 2.822523e+05 6.078794e+04 9.384245e+04 3.811224e+05 6.119568e+04 5.627994e+05 8.489101e+04 7.821305e+05 1.808778e+05 1.912327e+05 2.049209e+05 8.605480e+04 8.927932e+04 4.036842e+05 1.232480e+05 7.772007e+04 7.328794e+04 6.791896e+04 4.840780e+04 1.867842e+05 1.392200e+05 2.629667e+05 9.141109e+05 1.215003e+05 9.682167e+04 3.871538e+05 2.295199e+05 6.832229e+04 2.362734e+05 5.337542e+05 1.413493e+05 1.391581e+05 6.723307e+05 6.713829e+04 1.814558e+05 9.049110e+05 5.384961e+04 4.103098e+05 7.052608e+04 8.511871e+04 4.697169e+05 7.473113e+04 1.028572e+05 1.440652e+05 8.692884e+05 1.860401e+05 1.388837e+05 1.872876e+05 4.631919e+05 1.049348e+05 6.262238e+04 2.032712e+05 3.006409e+05 1.157701e+05 9.434099e+04 1.989298e+05 1.930627e+05 4.363771e+05 3.066625e+05 C10 H27 N8 O3 P_1.859 9.675647e+04 1.583227e+06 1.495099e+06 1.394002e+06 1.416547e+05 9.910038e+05 1.613310e+06 1.291761e+06 120647.64 1.586730e+06 1.459633e+06 1.513603e+06 118664.56 1.364615e+06 1.285458e+06 1.491586e+06 9.567101e+04 1.371235e+06 1.378617e+06 1.577343e+06 2.391091e+05 1.215620e+06 1.460838e+06 1.576094e+06 166471.292 1.445633e+06 1.356190e+06 1.274754e+06 1.771713e+05 1.525403e+06 1.359495e+06 1.526437e+06 205237.63 1.226694e+06 1.557830e+06 1.514050e+06 1.901714e+05 1.326016e+06 1.411166e+06 1.389563e+06 1.500052e+05 1.212530e+06 1.723771e+06 1.584263e+06 8.168304e+04 1.208998e+06 1.471881e+06 1.333337e+06 5.781563e+05 8.550208e+05 2.656058e+05 6.743728e+05 3.547301e+05 1.135854e+06 4.609807e+05 6.517076e+05 1.027389e+06 6.162838e+05 5.441264e+05 7.800374e+05 6.566454e+05 5.377426e+05 3.545662e+05 8.731872e+05 5.045815e+05 5.848161e+06 5.645892e+05 2.380104e+05 7.001922e+05 3.889529e+05 6.178532e+05 4.423359e+05 2.760780e+05 5.033518e+05 3.774836e+06 1.180774e+06 3.468558e+06 2.966240e+06 1.926260e+06 6.351537e+06 1.837637e+06 1.187564e+06 1.808262e+06 2.401910e+06 1.756927e+06 5.719893e+06 3.358132e+06 6.863189e+05 3.123022e+06 2.871747e+06 1.884368e+06 5.339834e+06 6.478813e+05 5.266816e+05 4.121036e+05 7.989903e+05 7.327960e+05 2.468982e+05 2.647797e+05 7.905895e+05 2.308445e+05 8.153994e+05 2.796624e+05 5.488199e+05 5.140495e+05 6.127658e+05 4.524417e+05 4.282138e+05 8.298388e+05 2.457328e+05 1.342556e+06 7.718754e+05 8.578863e+05 3.733192e+05 4.600742e+05 2.347624e+05 5.766169e+05 5.071575e+05 5.165877e+05 8.548413e+05 2.479433e+05 1.794284e+05 1.905593e+05 5.762435e+05 2.088404e+05 3.325084e+05 7.541927e+05 2.689734e+05 5.505544e+05 5.101118e+05 9.097182e+05 1.156124e+06 1.215013e+06 1.219626e+06 8.954899e+05 6.555074e+05 1.039216e+06 8.914771e+05 7.897794e+05 9.587801e+05 4.456440e+05 1.969489e+06 1.232858e+06 7.188534e+05 6.295496e+05 6.366541e+05 9.171187e+05 4.498924e+05 8.564300e+05 1.518628e+06 1.302216e+06 1.977864e+06 1.514062e+06 6.241875e+05 6.013282e+05 3.570891e+05 5.127342e+05 1.181433e+06 6.758345e+05 4.771536e+05 2.325135e+05 4.596045e+05 7.079426e+05 1.239392e+06 2.864997e+06 1.587215e+06 6.240764e+05 1.215268e+06 9.930920e+05 1.044673e+06 3.033621e+06 7.704630e+05 9.305434e+05 8.452480e+05 1.826891e+06 1.810715e+06 4.326515e+05 4.331812e+05 5.449022e+05 5.625277e+05 1.591743e+06 4.500845e+06 9.856280e+05 5.844343e+06 9.061077e+05 1.168272e+06 1.730699e+06 7.273733e+05 2.648889e+06 2.101706e+06 6.965180e+06 1.660642e+06 1.219681e+06 5.067164e+05 3.910153e+06 1.069557e+06 3.235202e+06 7.790017e+06 2.619242e+06 6.991320e+06 3.465740e+06 7.097202e+06 7.142647e+05 2.668015e+06 3.587963e+06 1.041779e+06 1.906112e+06 7.768649e+05 4.402702e+06 2.816173e+06 5.662062e+05 1.101093e+06 2.933184e+06 3.315079e+06 5.239083e+05 2.416355e+06 1.073926e+07 1.514291e+06 1.843000e+06 1.625882e+06 2.494335e+06 1.993778e+06 3.857779e+05 1.189593e+06 1.140315e+06 2.757792e+06 7.719883e+05 9.440264e+05 1.237127e+06 6.612366e+05 7.227916e+05 2.778553e+06 1.716499e+06 4.209284e+05 1.040696e+06 1.739069e+06 4.295275e+06 1.072296e+06 1.043910e+06 9.731129e+05 2.218771e+07 1.053282e+06 1.010126e+06 1.666043e+06 1.589235e+06 2.201569e+06 6.165704e+05 6.743294e+05 1.677937e+06 1.504096e+06 2.514736e+06 1.320098e+06 7.836613e+05 1.175477e+06 2.338829e+06 1.641982e+06 2.478083e+06 1.105107e+06 1.490350e+06 5.327194e+05 1.032019e+06 1.243028e+06 C32 H59 N O7 S_1.863 3.911013e+04 2.706358e+06 2.895308e+06 2.439685e+06 5.773056e+04 1.759823e+06 2.853280e+06 2.433913e+06 50779.74 2.485454e+06 2.709519e+06 2.909738e+06 50294.18 2.375988e+06 2.209429e+06 2.667346e+06 4.183153e+04 2.498273e+06 2.317695e+06 2.841455e+06 1.066244e+05 2.168891e+06 2.741681e+06 2.638432e+06 74368.270 2.553146e+06 2.474523e+06 2.262180e+06 7.811367e+04 2.700813e+06 2.627709e+06 2.819021e+06 92475.10 2.026890e+06 2.658178e+06 2.423125e+06 8.394541e+04 2.627167e+06 2.728282e+06 2.322356e+06 6.935020e+04 2.061926e+06 3.108615e+06 2.620351e+06 3.479297e+04 2.476953e+06 2.604171e+06 2.326885e+06 2.054750e+06 2.368334e+06 9.796483e+05 1.521578e+06 9.767994e+05 2.056498e+06 1.419056e+06 1.461602e+06 1.502127e+06 1.548116e+06 2.120635e+06 2.795640e+06 2.116761e+06 1.692359e+06 1.892428e+06 2.247838e+06 1.879190e+06 2.590913e+06 2.795512e+06 1.629136e+06 1.700062e+06 1.439946e+06 2.421045e+06 2.122803e+06 2.225182e+06 2.129398e+06 2.483417e+06 1.927003e+06 2.920088e+06 2.863178e+06 6.009956e+05 2.216934e+06 2.126845e+06 2.509037e+06 2.133681e+06 2.597634e+06 1.930986e+06 2.705268e+06 1.773918e+06 1.085809e+06 1.941278e+06 2.468841e+06 3.227996e+06 2.537310e+06 3.142607e+06 1.894917e+06 2.068599e+06 2.574106e+06 3.304458e+06 2.014703e+06 2.259299e+06 1.920749e+06 1.719160e+06 3.206315e+06 1.625493e+06 2.105182e+06 2.199392e+06 2.586438e+06 1.837583e+06 2.144206e+06 1.490261e+06 1.900081e+06 1.785414e+06 3.934172e+06 2.562285e+06 2.941568e+06 3.275619e+06 2.079280e+06 2.992110e+06 2.506210e+06 1.999463e+06 2.432356e+06 1.235645e+06 1.685342e+06 1.228760e+06 2.917604e+06 2.339661e+06 2.352506e+06 3.903567e+06 1.556557e+06 2.511465e+06 3.031292e+06 2.021941e+06 9.908349e+04 2.613267e+06 2.348543e+06 2.141340e+06 2.110798e+06 2.731255e+06 3.081629e+06 2.515361e+06 2.655941e+06 8.500989e+05 3.735850e+06 3.228724e+06 6.415063e+05 1.161542e+06 1.369826e+06 1.359701e+06 1.360314e+06 1.703847e+06 1.839020e+06 1.996607e+06 1.778387e+06 1.620406e+06 2.186235e+06 1.879476e+06 2.239568e+06 3.865824e+06 4.303322e+06 4.239261e+06 2.095546e+06 3.096727e+06 3.049430e+06 2.082514e+06 1.754152e+06 3.264916e+06 1.820495e+06 1.639250e+06 1.870611e+06 2.042769e+06 2.294895e+06 2.490985e+06 1.880675e+06 2.423351e+06 1.898599e+06 3.228634e+06 2.462012e+06 1.651478e+06 1.834310e+06 1.800222e+06 1.785310e+06 4.596901e+06 2.526865e+06 2.614775e+06 3.973144e+06 2.788162e+06 2.818553e+06 2.303903e+06 2.505698e+06 3.931121e+06 2.207781e+06 3.094685e+06 2.329327e+06 1.421543e+06 3.090180e+06 5.723511e+06 2.278181e+06 4.162615e+06 2.616469e+06 1.759690e+06 3.131596e+06 4.046383e+06 4.131200e+06 1.926521e+06 1.974260e+06 2.902455e+06 2.235235e+06 2.905654e+06 1.838343e+06 3.730981e+06 2.792148e+06 2.616247e+06 2.491321e+06 1.654634e+06 2.821179e+06 3.571219e+06 2.929924e+06 3.638942e+06 3.545663e+06 3.897017e+06 2.609670e+06 2.788267e+06 2.138514e+06 1.951806e+06 2.660446e+06 4.126019e+06 4.255816e+06 4.172996e+06 4.022728e+06 3.066849e+06 2.634251e+06 3.913047e+06 3.984679e+06 2.405867e+06 2.766659e+06 3.317154e+06 2.221467e+06 3.018974e+06 2.414041e+06 2.809505e+06 2.341932e+06 3.924606e+06 5.233733e+06 5.525873e+06 5.724678e+06 3.613589e+06 4.870059e+06 5.521985e+06 4.086524e+06 4.658888e+06 6.758796e+06 4.604505e+06 1.516786e+06 5.438940e+06 2.179200e+06 1.033162e+07 1.223810e+06 1.292053e+06 1.446626e+06 2.011282e+06 4.786545e+06 4.965413e+06 6.287696e+06 C10 H19 N O3_1.864 1.026540e+05 6.385565e+05 5.434332e+05 6.710991e+05 8.772285e+04 2.877230e+05 5.512774e+05 7.205173e+05 91129.08 4.389898e+05 5.088834e+05 4.251544e+05 70732.40 7.752318e+05 8.185479e+05 9.631227e+05 5.036319e+04 3.969894e+05 3.181881e+05 5.929659e+05 1.818505e+05 4.219411e+05 6.529085e+05 6.140497e+05 139130.691 7.055685e+05 6.389283e+05 5.932251e+05 1.503154e+05 6.086692e+05 4.996093e+05 6.387528e+05 181379.25 6.110269e+05 6.482674e+05 4.272404e+05 1.659055e+05 7.182017e+05 6.367645e+05 5.725234e+05 1.398350e+05 4.504560e+05 5.675701e+05 8.266967e+05 2.179149e+05 4.068381e+05 6.679769e+05 5.509682e+05 2.874833e+05 1.560382e+05 3.774880e+05 2.963791e+05 3.583727e+05 5.668335e+05 2.174743e+05 4.142298e+05 4.371809e+05 2.971634e+05 7.752791e+05 2.654418e+05 6.750791e+05 4.698986e+05 2.409303e+05 6.498163e+05 4.373531e+05 3.383676e+05 3.373928e+05 4.952428e+05 3.414626e+05 3.904152e+05 4.602083e+05 4.238200e+05 5.491966e+05 5.523004e+05 1.981169e+05 2.070873e+05 1.555540e+05 3.454887e+05 6.719548e+06 3.722017e+05 1.319435e+05 1.234464e+05 3.383860e+05 1.752524e+05 5.274015e+05 2.879387e+05 4.238801e+05 1.139127e+05 2.317905e+05 2.169579e+05 3.801728e+05 2.511654e+05 5.004786e+05 3.192997e+05 5.871601e+05 1.759663e+05 7.678143e+05 4.057209e+05 2.767552e+05 2.777280e+05 1.579125e+05 3.663392e+05 4.683997e+05 1.895686e+05 3.170470e+05 4.446628e+05 1.861670e+05 5.152808e+05 5.107473e+05 2.005724e+05 2.100333e+05 6.028248e+05 5.922932e+05 4.433071e+05 2.163221e+05 1.123683e+05 4.256835e+05 5.613108e+05 3.155890e+05 4.618794e+05 2.111642e+05 3.740040e+05 1.868783e+05 2.166046e+05 3.319971e+05 2.141964e+05 1.653698e+05 3.571371e+05 1.043162e+05 3.925555e+05 4.412303e+05 2.156035e+07 5.890825e+05 3.157837e+05 1.833822e+05 2.377610e+05 5.118183e+05 2.757942e+05 3.818732e+05 4.976918e+05 7.019797e+05 3.981531e+05 3.121670e+05 7.088173e+05 8.971675e+05 1.068940e+06 1.366512e+06 1.021931e+06 1.060367e+06 1.823491e+06 9.405906e+05 4.286986e+05 4.111428e+05 4.763754e+05 4.334208e+05 5.061489e+05 6.244489e+05 3.597889e+05 7.470372e+05 1.551270e+05 3.324579e+05 3.548549e+05 4.353789e+05 1.170739e+06 9.481269e+05 4.464647e+05 3.352737e+05 6.587325e+05 5.683469e+05 5.902473e+05 4.213620e+05 6.437019e+05 7.362904e+05 4.586587e+05 5.931848e+05 5.453742e+05 6.588373e+05 4.404763e+05 3.906172e+05 3.595849e+05 3.530261e+05 4.663064e+05 3.045024e+05 7.795917e+05 5.491676e+05 3.759592e+05 2.245536e+05 2.334542e+05 4.405478e+05 3.111229e+05 4.135214e+05 1.587752e+05 2.445822e+05 2.950376e+05 8.461866e+05 2.554700e+05 4.075012e+05 5.865807e+05 1.667148e+05 3.034278e+05 2.794182e+05 4.638838e+05 2.551307e+05 1.897137e+05 2.069786e+05 1.704672e+05 1.929882e+05 1.481059e+05 1.861258e+05 2.031797e+05 2.557155e+05 2.706914e+05 1.571356e+05 2.028972e+05 8.064584e+05 1.659852e+05 7.915581e+05 4.186297e+05 1.979066e+05 8.216784e+05 4.824562e+05 2.449261e+05 2.194875e+05 2.754153e+05 4.132095e+05 2.495423e+05 3.433239e+05 3.745427e+05 1.753669e+05 4.825887e+05 4.356568e+05 2.488904e+05 2.035863e+05 1.506391e+05 2.178941e+05 2.575947e+05 2.055793e+05 2.211396e+05 1.777167e+05 5.622473e+05 1.216772e+06 6.458788e+05 5.474649e+05 4.535546e+05 1.644438e+05 5.696820e+05 2.658795e+05 2.907314e+05 6.896023e+05 5.844536e+05 4.433228e+05 4.784071e+05 4.404418e+05 2.954006e+05 8.752282e+05 5.273912e+05 6.794826e+05 5.603132e+05 2.938074e+05 5.946067e+05 8.259147e+05 2.302781e+05 C14 H27 N3 O3_1.866 3.571555e+04 3.140092e+05 3.215740e+05 2.415471e+05 4.772052e+04 1.203869e+05 2.751719e+05 3.158980e+05 38922.10 2.635128e+05 2.750672e+05 3.040659e+05 37432.68 2.045925e+05 2.483969e+05 2.593500e+05 3.044051e+04 2.700876e+05 2.564902e+05 3.070702e+05 7.853759e+04 2.044942e+05 2.798313e+05 3.120872e+05 60160.953 2.666121e+05 2.628295e+05 2.284288e+05 7.491395e+04 1.909553e+05 3.276448e+05 3.288393e+05 91366.36 1.510052e+05 2.990706e+05 2.777396e+05 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1.311809e+06 8.418346e+04 7.582621e+05 1.417309e+06 1.250336e+06 64850.99 1.420988e+06 1.321245e+06 1.326034e+06 63434.77 1.269854e+06 1.152231e+06 1.341781e+06 5.445956e+04 1.244276e+06 1.254167e+06 1.435751e+06 1.274325e+05 1.105303e+06 1.312881e+06 1.399285e+06 89112.108 1.317457e+06 1.253748e+06 1.148137e+06 9.546230e+04 1.363178e+06 1.229403e+06 1.430028e+06 112260.31 1.131736e+06 1.333368e+06 1.440714e+06 1.015949e+05 1.076116e+06 1.310940e+06 1.287791e+06 8.345714e+04 1.121955e+06 1.573635e+06 1.388332e+06 4.360200e+04 1.098447e+06 1.338020e+06 1.203674e+06 4.460030e+05 7.568912e+05 1.556609e+05 5.324760e+05 2.571596e+05 1.136531e+06 3.631878e+05 4.933439e+05 9.274727e+05 5.163505e+05 4.332789e+05 6.268724e+05 5.309663e+05 4.163948e+05 2.251678e+05 7.408371e+05 3.168323e+05 5.031726e+06 4.633264e+05 1.311912e+05 5.740691e+05 2.834003e+05 4.324804e+05 3.464015e+05 1.387858e+05 3.459976e+05 3.188777e+06 1.075214e+06 3.019011e+06 2.498948e+06 1.558506e+06 5.184458e+06 1.667307e+06 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1.601908e+06 3.760680e+06 1.002700e+06 8.269447e+05 9.018678e+05 1.837688e+07 9.154696e+05 8.653833e+05 1.437547e+06 1.416374e+06 1.845777e+06 4.809185e+05 5.485662e+05 1.465060e+06 1.353161e+06 2.068147e+06 1.279550e+06 6.759859e+05 1.089381e+06 1.959934e+06 1.446563e+06 2.089975e+06 9.425050e+05 1.266893e+06 4.253341e+05 9.359233e+05 1.074254e+06 C6 H14 O3_1.868 4.458162e+05 5.574298e+05 9.587798e+05 2.316783e+06 1.704173e+05 3.712026e+05 9.541923e+05 1.201623e+06 309509.22 9.143034e+05 1.126848e+06 8.730929e+05 125687.03 1.117044e+06 9.759738e+05 1.236783e+06 1.297107e+05 9.054862e+05 1.060533e+06 1.038640e+06 1.408494e+05 8.111332e+05 1.113808e+06 1.694893e+06 65284.741 6.984211e+05 1.044189e+06 8.641452e+05 4.687507e+05 8.450815e+05 1.191982e+06 1.204615e+06 389377.71 7.481872e+05 1.183179e+06 1.318050e+06 8.354772e+04 8.140128e+05 9.782316e+05 1.162684e+06 3.609541e+05 7.570930e+05 1.108442e+06 1.307565e+06 5.862890e+05 9.798049e+05 1.193223e+06 7.642965e+05 4.415020e+05 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1.439732e+06 1.242216e+06 1.533990e+06 9.566153e+04 1.298775e+06 1.459086e+06 1.548982e+06 69031.301 1.431590e+06 1.333077e+06 1.193306e+06 7.395995e+04 1.400918e+06 1.390247e+06 1.742515e+06 83179.01 1.247217e+06 1.296176e+06 1.449195e+06 7.558647e+04 1.423204e+06 1.362189e+06 1.335605e+06 6.397929e+04 1.392547e+06 1.395000e+06 1.666583e+06 3.447375e+04 1.286620e+06 1.700848e+06 1.039125e+06 1.186377e+06 1.445671e+06 4.639535e+05 4.235199e+05 2.035442e+05 1.047820e+06 4.234362e+05 5.774499e+05 5.135440e+05 4.496720e+05 5.498076e+05 1.588572e+06 6.302313e+05 5.447396e+05 6.703006e+05 6.707673e+05 5.678134e+05 1.462694e+06 1.259783e+06 4.249948e+05 4.812993e+05 5.403996e+05 7.617445e+05 6.559017e+05 7.519889e+05 7.289973e+05 1.122232e+06 1.066106e+06 1.296557e+06 1.227727e+06 1.217627e+06 1.615336e+06 1.175423e+06 1.192049e+06 1.010325e+06 1.412074e+06 8.285190e+05 1.207982e+06 9.093813e+05 4.573913e+05 1.003709e+06 1.135228e+06 1.477353e+06 1.205534e+06 1.214703e+06 9.597384e+05 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9.194905e+05 1.278698e+06 1.101671e+06 1.823650e+06 1.531924e+06 5.847444e+05 4.997846e+05 5.980894e+05 6.267132e+05 2.271630e+06 1.411356e+06 1.243330e+06 2.155606e+06 1.592189e+06 1.379256e+06 1.291676e+06 1.575584e+06 2.164241e+06 1.116713e+06 1.807040e+06 1.348445e+06 5.218384e+05 1.550875e+06 3.978660e+06 1.135179e+06 2.034374e+06 2.840973e+06 9.541819e+05 2.358496e+06 2.258573e+06 2.864824e+06 1.044851e+06 1.133638e+06 1.427992e+06 1.219917e+06 1.535772e+06 7.889371e+05 1.844054e+06 1.719150e+06 1.263877e+06 1.484984e+06 1.014367e+06 1.605578e+06 1.939158e+06 1.680213e+06 1.784973e+06 2.284622e+06 1.905814e+06 1.334362e+06 1.997964e+06 1.344541e+06 9.199181e+05 1.437004e+06 2.131113e+06 2.337428e+06 1.860301e+06 1.706239e+06 1.903058e+06 1.410539e+06 1.746034e+06 1.925485e+06 9.741222e+05 1.529464e+06 2.206948e+06 8.046691e+05 1.322620e+06 8.810472e+05 1.376582e+06 1.017893e+06 1.413680e+06 3.116920e+06 4.484423e+06 4.437638e+06 2.795635e+06 4.256150e+06 4.223305e+06 2.706670e+06 3.496705e+06 5.404269e+06 2.566416e+06 5.917267e+05 3.524532e+06 1.203249e+06 7.329082e+06 5.016982e+05 5.738619e+05 5.787087e+05 8.309152e+05 3.085649e+06 3.714544e+06 4.341916e+06 INDOLE-3-ACETATE 1.772425e+07 4.641084e+06 4.662144e+06 4.611432e+06 6.301423e+04 2.633352e+06 4.647463e+06 4.760333e+06 43443.99 4.688511e+06 4.374542e+06 5.082351e+06 37933.16 3.812600e+06 4.244602e+06 4.259332e+06 3.768237e+04 3.814974e+06 4.250411e+06 4.854341e+06 8.763316e+04 4.077325e+06 4.627016e+06 5.275802e+06 58519.594 3.682027e+06 4.227811e+06 4.180670e+06 7.150471e+04 4.117870e+06 4.698946e+06 4.837532e+06 86579.76 3.797152e+06 4.369261e+06 4.732300e+06 7.988448e+04 3.740424e+06 4.604060e+06 4.380129e+06 6.441690e+04 3.797525e+06 4.666905e+06 5.750608e+06 3.236278e+04 3.388244e+06 4.662131e+06 3.880878e+06 3.220075e+06 5.379527e+06 4.923708e+06 2.493547e+07 7.930305e+06 6.035434e+06 5.905572e+06 5.642897e+06 3.605275e+06 4.395358e+06 1.853220e+07 4.671720e+06 5.706358e+06 6.579421e+06 4.776819e+06 4.190203e+06 3.729408e+06 3.451814e+06 3.570910e+06 1.261320e+07 8.543869e+06 4.609076e+06 4.321194e+06 2.298352e+06 3.559345e+06 1.982969e+06 5.038297e+06 2.742405e+06 4.058312e+06 4.488909e+06 1.073196e+07 6.276765e+06 3.807210e+06 3.633583e+06 1.627037e+06 3.713339e+06 2.404186e+06 3.757260e+06 2.098097e+06 7.743520e+06 9.648989e+06 5.280017e+06 3.481588e+06 2.780309e+06 6.343858e+06 4.652499e+06 5.926485e+06 4.763116e+06 3.200995e+06 4.317069e+06 3.732205e+06 1.972174e+06 5.325750e+06 1.024584e+07 3.885118e+06 1.738309e+06 2.405462e+06 2.927213e+06 1.641856e+06 2.818810e+06 2.731295e+06 3.414366e+06 1.800908e+06 4.828814e+06 3.424479e+06 4.698938e+06 1.964978e+06 5.365926e+06 2.034399e+06 5.787910e+06 3.180151e+06 2.717309e+06 2.012527e+06 2.738212e+06 2.866980e+06 2.778760e+06 4.066462e+06 4.082002e+06 1.366148e+06 4.074406e+06 3.417520e+06 6.071997e+06 4.830177e+06 4.387572e+06 2.913412e+06 6.240007e+06 5.015301e+06 3.334013e+06 4.200826e+06 3.539792e+06 3.398694e+06 2.113001e+06 3.724835e+06 4.754569e+06 2.017061e+06 2.864319e+06 1.558922e+06 5.886664e+06 2.156964e+06 2.307013e+06 2.106525e+06 1.671168e+06 2.642784e+06 1.950338e+06 1.923244e+06 4.881968e+06 3.883252e+06 5.679108e+06 7.039322e+06 1.129705e+06 1.292642e+07 3.256452e+06 5.823025e+06 5.885805e+06 1.996069e+07 7.892339e+06 5.038243e+06 4.878177e+06 4.653365e+06 5.625407e+06 4.688682e+06 2.212634e+06 6.377610e+06 6.036105e+06 1.156751e+07 4.233341e+06 2.803374e+06 7.797003e+06 4.735681e+06 2.753892e+06 5.704744e+06 3.108017e+06 1.110070e+06 5.025874e+06 3.111151e+06 2.234150e+06 3.168879e+06 1.730470e+06 5.496195e+06 3.263677e+06 5.412985e+06 3.060904e+06 5.005863e+06 3.612386e+06 1.502259e+06 1.875225e+06 1.331432e+06 5.264307e+06 5.727534e+06 3.263872e+06 5.293797e+06 4.001255e+06 2.710410e+06 7.333778e+06 4.210443e+06 5.740231e+06 2.552075e+06 3.300765e+06 4.682062e+06 2.218290e+06 6.971428e+06 1.192336e+07 2.819723e+06 3.525549e+06 4.280794e+06 3.232532e+06 3.728659e+06 2.981585e+06 9.325034e+05 1.405823e+06 3.328808e+06 6.015784e+06 5.718051e+06 1.208986e+07 4.025812e+06 5.135438e+06 3.431938e+06 2.639904e+06 1.086570e+07 2.056649e+06 4.442382e+06 4.094937e+06 5.043943e+06 3.760967e+06 1.167583e+07 2.702821e+06 2.788767e+06 2.788528e+06 2.895493e+06 7.191147e+06 1.929068e+06 3.975691e+06 8.039769e+06 4.925418e+06 1.918560e+06 5.039187e+06 3.521706e+06 3.136954e+06 5.740343e+06 3.334820e+07 4.945342e+06 4.445465e+06 2.010225e+06 5.761859e+06 1.546035e+06 1.491649e+07 7.371173e+06 1.571390e+06 5.595001e+06 3.936470e+06 9.192863e+06 2.546615e+06 5.583817e+06 5.614291e+06 145.04142_1.873 9.399788e+04 1.130757e+06 9.845465e+05 1.240082e+06 1.177699e+05 7.585927e+05 1.813396e+06 1.312236e+06 51667.09 1.364112e+06 1.156561e+06 1.322639e+06 40293.82 1.235946e+06 1.123656e+06 1.615615e+06 3.704315e+04 9.600029e+05 8.894602e+05 1.383499e+06 8.432248e+04 1.445670e+06 1.421931e+06 1.607860e+06 60467.459 7.558542e+05 1.412915e+06 1.283710e+06 7.504605e+04 7.693926e+05 1.136864e+06 1.274672e+06 72878.25 1.576606e+06 1.212595e+06 1.215572e+06 6.071074e+04 1.362006e+06 1.177621e+06 1.155945e+06 5.416718e+04 1.403374e+06 1.081622e+06 1.579621e+06 3.361366e+04 1.170634e+06 1.431189e+06 9.114000e+05 1.071929e+06 1.402692e+06 7.031669e+05 7.560616e+05 5.871029e+05 1.023044e+06 1.025750e+06 9.140899e+05 1.192123e+06 9.870586e+05 8.252052e+05 1.968055e+06 1.143914e+06 1.018407e+06 1.242751e+06 1.124730e+06 7.695141e+05 8.536234e+05 1.415497e+06 1.097641e+06 9.366165e+05 1.140862e+06 1.366613e+06 1.148787e+06 1.494456e+06 1.739514e+06 1.291021e+06 1.146886e+06 1.208517e+06 1.429382e+06 5.878759e+04 8.653792e+05 9.644868e+05 8.455130e+05 8.867203e+05 9.703992e+05 9.604895e+05 8.687416e+05 6.021080e+05 8.536866e+05 9.962973e+05 1.312598e+06 1.669359e+06 1.070421e+06 2.205419e+06 1.165816e+06 1.606265e+06 1.288176e+06 1.466976e+06 6.687794e+05 8.896415e+05 9.454157e+05 1.102443e+06 1.458919e+06 8.187364e+05 1.000707e+06 1.458587e+06 1.612266e+06 1.052842e+06 1.542271e+06 1.034928e+06 6.539524e+05 8.800329e+05 1.579194e+06 1.492943e+06 7.014815e+05 1.179286e+06 1.525954e+06 1.556305e+06 8.964851e+05 9.160708e+05 1.064674e+06 5.143700e+05 7.186202e+05 7.705187e+05 8.164649e+05 1.002645e+06 8.635526e+05 1.626000e+06 1.140658e+06 1.128642e+06 1.208183e+06 9.942756e+05 6.529795e+04 9.085501e+05 9.481526e+05 1.101101e+06 1.250922e+06 1.519349e+06 1.455106e+06 1.284647e+06 1.393500e+06 5.874425e+05 2.026289e+06 1.610417e+06 1.094245e+06 1.247421e+06 1.059552e+06 7.733530e+05 1.120133e+06 1.308029e+06 2.065757e+06 1.544729e+06 3.558984e+06 2.491963e+06 1.047871e+06 1.182762e+06 1.000918e+06 1.705625e+06 1.476332e+06 2.183241e+06 6.977819e+05 9.842839e+05 9.225045e+05 8.314708e+05 6.331359e+05 1.250416e+06 5.854853e+05 8.701230e+05 7.305462e+05 4.452313e+05 9.109115e+05 1.058992e+06 1.333217e+06 9.564654e+05 1.192064e+06 1.560050e+06 1.000028e+06 1.046936e+06 8.853903e+05 1.356469e+06 9.602154e+05 1.812198e+06 1.304226e+06 7.073738e+05 1.863970e+06 9.214579e+05 9.686560e+05 7.063979e+05 1.745704e+06 2.422145e+06 6.103146e+05 2.021123e+06 1.139871e+06 9.622599e+05 9.414484e+05 1.462207e+06 9.467484e+05 1.936493e+06 2.292273e+06 8.398801e+05 1.351523e+06 2.063755e+06 2.203662e+06 7.556961e+05 8.578380e+05 1.005927e+06 9.957600e+05 1.400590e+06 8.747150e+05 1.750614e+06 1.213383e+06 1.019688e+06 1.114134e+06 8.262030e+05 9.488141e+05 1.479635e+06 9.048733e+05 1.938385e+06 1.046230e+06 1.277403e+06 1.078468e+06 1.150200e+06 8.184619e+05 9.549760e+05 1.340446e+06 1.766624e+06 1.433347e+06 9.836216e+05 9.329312e+05 1.569362e+06 8.735805e+05 1.192664e+06 1.586788e+06 9.767638e+05 1.539667e+06 2.199510e+06 1.021695e+06 1.962620e+06 1.051110e+06 1.325693e+06 9.396821e+05 1.538394e+06 1.241006e+06 1.909112e+06 2.051437e+06 1.835761e+06 1.579751e+06 1.973436e+06 1.138476e+06 1.190523e+06 1.976248e+06 9.703708e+05 8.872106e+05 1.127144e+06 7.171487e+05 2.855819e+06 7.917413e+05 8.270626e+05 7.789131e+05 5.725524e+05 9.077213e+05 1.697904e+06 1.834994e+06 Cyanohydroxy butene_1.877 4.002517e+04 7.018983e+06 6.327744e+06 6.867450e+06 7.952930e+04 4.705066e+06 6.912797e+06 7.087583e+06 53537.90 5.867472e+06 6.704982e+06 7.668357e+06 58108.43 5.637850e+06 5.983702e+06 6.874391e+06 4.243842e+04 5.974113e+06 6.104172e+06 6.670239e+06 9.386228e+04 5.290276e+06 6.956323e+06 8.270926e+06 154051.934 6.126514e+06 5.917687e+06 6.508518e+06 7.806484e+04 5.049488e+06 6.684292e+06 7.837757e+06 100995.56 5.901514e+06 6.028479e+06 6.861147e+06 1.398906e+05 5.639819e+06 6.766864e+06 6.482346e+06 7.181763e+04 6.065529e+06 6.517184e+06 7.984850e+06 3.475526e+04 4.809420e+06 7.206986e+06 5.964433e+06 1.313089e+06 5.284613e+06 5.146690e+06 8.743372e+06 4.802015e+06 5.018780e+06 9.573522e+06 5.357392e+06 7.803865e+06 6.951867e+06 1.123528e+07 8.192292e+06 1.175997e+07 5.584987e+06 1.596143e+07 8.904160e+06 9.117499e+06 5.550390e+06 6.109508e+06 6.753933e+06 7.130989e+06 6.803724e+06 1.101084e+07 7.103685e+06 9.067826e+06 1.007115e+07 7.465695e+06 4.762967e+06 5.230493e+06 4.956884e+06 6.774363e+04 6.114443e+06 5.265000e+06 6.458249e+06 4.551191e+06 7.205949e+06 5.008032e+06 3.568794e+06 2.742746e+06 2.273001e+06 2.799024e+06 3.815949e+06 7.409459e+06 5.911351e+06 9.053731e+06 4.607619e+06 4.611307e+06 5.585419e+06 5.008145e+06 2.700362e+06 4.459605e+06 4.386876e+06 5.659562e+06 5.782732e+06 2.133401e+06 5.014104e+06 4.119584e+06 3.847055e+06 3.417181e+06 5.157983e+06 6.869572e+06 4.159635e+06 5.174971e+06 9.419986e+06 5.156664e+06 3.145864e+06 5.439385e+06 3.904579e+06 4.747961e+06 3.824750e+06 3.964515e+06 5.621029e+06 2.376296e+06 3.960171e+06 3.025699e+06 8.509234e+04 3.486793e+06 2.799188e+06 7.838116e+06 1.739593e+06 5.203453e+06 7.338855e+06 7.287759e+06 9.705942e+04 5.037526e+06 6.262032e+06 4.132940e+06 4.576657e+06 6.198460e+06 6.622134e+06 5.334733e+06 8.104181e+06 5.842996e+06 5.739371e+05 6.860729e+06 4.911707e+06 5.829332e+06 6.063934e+06 5.757523e+06 7.247175e+06 1.566861e+05 1.272250e+07 8.568542e+06 1.000740e+07 5.538823e+06 1.020622e+07 4.149743e+06 6.228869e+06 1.614925e+07 9.890001e+06 8.973386e+06 4.284229e+06 2.628576e+06 7.757439e+06 4.878887e+06 4.763157e+06 8.192610e+06 5.015018e+06 4.361753e+06 6.579048e+06 5.363989e+06 5.836494e+06 5.381900e+06 6.853101e+06 6.744205e+06 6.641889e+06 7.464172e+06 5.177170e+06 7.679867e+06 6.466334e+06 1.479237e+07 1.079059e+07 7.784654e+06 5.855944e+05 6.185251e+06 7.638407e+06 1.286312e+06 6.814573e+06 1.106785e+07 4.728476e+06 9.392634e+06 6.214968e+06 9.425103e+06 1.028681e+06 2.280951e+06 1.056506e+07 2.336482e+06 1.003758e+07 1.086751e+06 1.516848e+06 7.754320e+06 5.134320e+06 1.233389e+07 9.576853e+06 7.749924e+06 7.376522e+06 7.439633e+06 4.557478e+06 1.048584e+07 7.896453e+06 9.484822e+06 1.044040e+07 6.448851e+06 8.445048e+06 6.523230e+06 9.201675e+06 1.443860e+06 1.057642e+07 2.907832e+06 1.526802e+07 9.449139e+06 1.095003e+07 9.423145e+06 7.528232e+06 7.333338e+06 1.025631e+07 1.286464e+07 7.014723e+05 1.481974e+07 4.361630e+06 1.481584e+07 1.186211e+07 1.254565e+07 1.270771e+06 1.583413e+06 9.824074e+06 8.090189e+06 8.636524e+06 1.079638e+07 1.211120e+06 9.836612e+06 6.463540e+06 7.495382e+06 5.524573e+06 4.985371e+06 7.442547e+06 5.344061e+06 8.915134e+06 8.432758e+06 5.068033e+06 4.825869e+06 1.115594e+07 7.501981e+06 8.437661e+06 6.167887e+06 9.795372e+06 1.718869e+07 3.859899e+06 7.013741e+06 5.758185e+06 2.632927e+05 1.324771e+05 6.233909e+06 3.619982e+06 C8 H28 N9 P_1.878 1.464105e+04 7.752891e+05 1.011305e+06 1.978836e+06 2.530030e+04 6.732228e+05 8.953218e+05 9.416727e+05 36534.96 9.271879e+05 8.247657e+05 1.617474e+06 40331.72 1.029569e+06 1.048737e+06 1.074403e+06 4.421106e+04 1.023212e+06 9.588023e+05 1.103243e+06 1.143472e+05 9.452774e+05 1.362464e+06 9.178547e+05 71789.632 1.083073e+06 9.111019e+05 9.005443e+05 7.332013e+04 1.360903e+06 1.115616e+06 1.147108e+06 79905.33 1.011391e+06 7.882924e+05 1.053844e+06 6.746225e+04 1.201760e+06 1.079772e+06 9.972718e+05 5.430859e+04 1.107883e+06 1.177217e+06 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3.247578e+06 7.057046e+05 2.480205e+06 1.986221e+06 3.460262e+06 5.296402e+05 5.860133e+05 6.929286e+05 6.524503e+05 8.303860e+05 1.640035e+05 1.408339e+06 1.040081e+06 6.661086e+05 7.062962e+05 6.459189e+05 1.038192e+06 4.916466e+05 1.012770e+06 2.548950e+06 1.255687e+06 1.382019e+06 4.780549e+05 1.121878e+06 8.073778e+05 2.657740e+05 7.169755e+05 8.258419e+05 1.275841e+06 9.940689e+05 9.450277e+05 8.580462e+05 5.482386e+05 6.870786e+05 1.360497e+06 9.887538e+05 6.722649e+05 1.051682e+06 9.512667e+05 1.184703e+06 6.334426e+05 4.867749e+05 4.377019e+05 9.820352e+05 7.267992e+05 1.211939e+06 9.173873e+05 8.679845e+05 9.952087e+05 9.893828e+05 8.445233e+05 1.036971e+06 1.412194e+06 9.534704e+05 7.009944e+05 8.568846e+05 5.161716e+05 1.264662e+06 3.373633e+05 2.936645e+05 5.422978e+05 5.283707e+05 1.073186e+06 1.177689e+06 8.396919e+05 C11 H24 O5_1.879 1.063047e+05 9.534277e+06 1.139954e+07 1.405803e+07 1.273213e+05 6.685873e+06 1.093819e+07 1.085492e+07 112733.38 1.083714e+07 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1.103442e+07 6.961335e+06 5.418233e+06 6.148894e+06 5.489922e+06 6.333703e+06 8.578832e+06 5.291034e+06 9.101294e+06 7.364480e+06 1.278606e+07 1.207310e+07 9.885121e+06 1.376259e+07 1.358459e+07 1.343635e+07 2.657407e+07 7.755080e+06 6.414622e+06 2.747118e+07 4.580083e+06 7.644040e+06 8.445095e+06 6.575142e+06 2.460145e+07 8.988587e+06 3.076645e+07 1.197807e+07 5.135415e+06 7.894384e+06 3.355993e+07 4.581597e+06 2.845450e+07 2.885538e+07 6.292517e+06 2.705088e+07 2.973421e+07 3.185142e+07 5.941366e+06 9.010471e+06 9.424663e+06 7.084801e+06 9.839568e+06 3.251938e+06 1.303647e+07 1.168052e+07 5.165133e+06 8.580414e+06 6.643871e+06 1.119917e+07 5.875320e+06 1.135989e+07 3.886889e+07 1.059779e+07 1.340194e+07 6.696110e+06 1.296262e+07 9.462698e+06 3.758555e+06 8.143507e+06 8.675625e+06 1.486020e+07 9.028928e+06 8.568409e+06 9.026134e+06 7.262526e+06 8.029489e+06 1.595008e+07 1.091584e+07 7.238807e+06 1.040392e+07 1.090706e+07 1.501253e+07 9.666954e+06 8.856771e+06 5.810934e+06 1.196093e+07 9.993302e+06 1.174102e+07 1.132771e+07 1.006026e+07 1.174714e+07 1.049671e+07 7.996254e+06 1.007148e+07 1.410535e+07 1.095693e+07 7.415220e+06 9.509530e+06 6.890268e+06 1.403162e+07 3.487036e+06 4.851562e+06 4.955300e+06 5.762494e+06 9.383930e+06 1.085048e+07 1.050024e+07 C43 H65 N3 O3 S_1.881 3.626661e+04 1.055090e+06 1.657112e+06 1.312898e+06 5.320852e+04 7.357495e+05 1.446732e+06 1.305578e+06 46118.89 1.145301e+06 1.310977e+06 1.339322e+06 42727.70 1.027760e+06 1.256209e+06 1.406491e+06 4.147440e+04 1.160022e+06 9.885509e+05 1.308336e+06 9.037652e+04 1.155295e+06 1.481731e+06 1.306014e+06 61287.446 1.201229e+06 1.146502e+06 1.071730e+06 7.131654e+04 1.333888e+06 1.232352e+06 1.271284e+06 73549.44 1.222535e+06 1.127455e+06 1.479366e+06 7.638460e+04 1.217853e+06 1.101300e+06 1.263531e+06 6.366574e+04 1.224931e+06 1.355891e+06 1.304055e+06 3.300082e+04 9.509639e+05 1.322797e+06 1.260762e+06 9.199429e+05 1.184749e+06 5.039275e+05 7.678835e+05 4.408545e+05 8.502613e+05 6.866883e+05 9.612658e+05 7.409449e+05 7.447153e+05 9.788990e+05 1.520670e+06 1.161795e+06 7.240785e+05 9.969547e+05 9.393588e+05 9.617768e+05 1.150877e+06 1.540797e+06 6.372267e+05 8.105105e+05 7.190011e+05 1.195615e+06 1.139173e+06 1.254371e+06 1.134037e+06 9.179197e+05 1.064814e+06 1.667247e+06 1.080393e+06 2.596783e+05 1.088052e+06 1.242926e+06 1.037352e+06 9.322228e+05 1.385683e+06 7.446291e+05 1.542967e+06 8.823048e+05 4.898728e+05 9.562141e+05 1.249514e+06 1.525761e+06 1.363781e+06 1.568948e+06 9.150347e+05 1.471127e+06 1.277687e+06 1.772318e+06 8.077902e+05 1.229885e+06 9.348672e+05 5.841732e+05 1.515575e+06 6.776456e+05 9.610254e+05 9.504809e+05 1.183598e+06 7.285096e+05 1.051165e+06 6.163750e+05 7.620142e+05 1.196260e+06 1.773199e+06 1.370610e+06 1.319348e+06 1.729486e+06 8.706892e+05 1.768146e+06 1.186927e+06 9.612658e+05 1.063536e+06 8.151615e+05 9.005986e+05 5.974372e+05 1.248958e+06 1.270567e+06 9.710500e+05 1.775746e+06 1.017943e+06 1.182771e+06 1.482458e+06 1.103316e+06 7.789761e+04 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1.356504e+06 1.030530e+06 1.014752e+06 8.808765e+05 1.345272e+06 1.563311e+06 1.537937e+06 1.781803e+06 2.015856e+06 1.824018e+06 1.348422e+06 1.746589e+06 1.157250e+06 8.644522e+05 1.815414e+06 2.089899e+06 2.195925e+06 1.540871e+06 2.022265e+06 1.424671e+06 1.143767e+06 1.880752e+06 2.691042e+06 1.021740e+06 1.411603e+06 1.891909e+06 1.255819e+06 1.397953e+06 1.170363e+06 1.403655e+06 1.231350e+06 1.392883e+06 1.641784e+06 2.223359e+06 2.304552e+06 1.987784e+06 2.397906e+06 2.503133e+06 1.664180e+06 1.961278e+06 3.191754e+06 2.336923e+06 6.788894e+05 2.016378e+06 1.369538e+06 3.475945e+06 6.146972e+05 5.496015e+05 5.845890e+05 8.035202e+05 2.263305e+06 1.926252e+06 2.206969e+06 C12 H34 N9 O3 P_1.882 2.762166e+04 4.325135e+05 3.783545e+05 4.180621e+05 4.183690e+04 3.908858e+05 3.706017e+05 4.586106e+05 43212.74 4.381605e+05 3.427354e+05 5.148802e+05 44646.52 2.940597e+05 3.813833e+05 4.110716e+05 4.483195e+04 4.690950e+05 3.392008e+05 4.538684e+05 9.833984e+04 3.111009e+05 4.783114e+05 4.133719e+05 62953.914 3.616994e+05 4.594851e+05 3.945076e+05 8.510656e+04 4.004753e+05 4.436928e+05 5.701658e+05 89256.96 1.713509e+05 3.620409e+05 3.969024e+05 9.164590e+04 4.233829e+05 3.230161e+05 4.795778e+05 6.346060e+04 3.985608e+05 4.612628e+05 5.046147e+05 3.603267e+04 2.921597e+05 5.503388e+05 2.019990e+05 4.006214e+05 3.215189e+05 2.374557e+05 1.526171e+05 1.929662e+05 1.381228e+05 8.402426e+04 1.892761e+05 7.554520e+04 7.373915e+04 1.097439e+05 3.636150e+05 1.175617e+05 1.152620e+05 1.503261e+05 1.887474e+05 1.976885e+05 1.178047e+06 3.107061e+05 2.648603e+05 1.337293e+05 1.027699e+05 2.032537e+05 1.723904e+05 1.662152e+05 1.419231e+05 5.448578e+05 3.670564e+05 4.265443e+05 6.111798e+05 7.138630e+05 8.664336e+05 3.365322e+05 2.666430e+05 3.021577e+05 5.397504e+05 2.760068e+05 9.733513e+05 4.615064e+05 1.078607e+05 4.709272e+05 3.934660e+05 5.321626e+05 7.684990e+05 2.736577e+05 2.327802e+05 2.850916e+05 1.927141e+05 3.225704e+05 7.299583e+04 1.849720e+05 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9.063099e+04 1.382559e+05 1.503732e+05 2.156747e+05 1.580375e+06 6.406860e+05 1.578225e+05 1.549963e+06 2.054708e+05 2.275006e+05 2.186318e+05 2.942978e+05 1.251772e+06 4.516851e+05 1.833572e+06 4.280854e+05 1.499665e+05 3.604372e+05 2.376009e+06 2.077075e+05 1.580073e+06 1.417791e+06 3.084960e+05 1.772542e+06 1.369903e+06 2.209914e+06 1.569811e+05 4.153658e+05 6.728752e+05 3.477567e+05 4.946164e+05 1.085389e+05 1.084371e+06 7.620383e+05 1.203945e+05 2.138674e+05 3.841030e+05 4.242217e+05 3.085443e+05 5.943016e+05 3.691238e+06 3.756354e+05 5.255055e+05 1.916575e+05 5.020203e+05 3.455685e+05 1.437520e+05 2.950216e+05 3.994114e+05 5.865060e+05 2.946767e+05 3.071854e+05 5.466682e+05 1.974729e+05 2.356994e+05 8.418103e+05 3.950868e+05 2.035212e+05 3.633295e+05 3.227337e+05 7.649870e+05 2.618355e+05 2.488064e+05 2.107038e+05 1.121687e+06 4.291396e+05 5.691659e+05 5.893779e+05 6.009289e+05 9.296967e+05 6.532268e+05 4.934348e+05 7.417543e+05 1.169842e+06 8.545693e+05 2.231859e+05 5.373804e+05 2.353673e+05 1.366130e+06 2.068525e+05 2.890383e+05 1.030450e+05 2.334429e+05 4.881429e+05 4.674394e+05 6.247029e+05 C16 H34 O7_1.882 7.031414e+04 4.216266e+06 4.818058e+06 5.141079e+06 1.025168e+05 2.528191e+06 4.425300e+06 4.743315e+06 84064.13 4.007506e+06 4.233899e+06 4.965854e+06 73637.13 3.928064e+06 3.601552e+06 5.106911e+06 3.528684e+05 4.150097e+06 3.849288e+06 4.873535e+06 1.621606e+05 3.308850e+06 4.285023e+06 5.328178e+06 112133.350 4.149584e+06 4.072844e+06 3.835791e+06 1.477961e+05 4.187208e+06 4.321998e+06 4.906951e+06 148102.00 3.627129e+06 4.052592e+06 4.434261e+06 1.572058e+05 4.449666e+06 4.605604e+06 4.462130e+06 1.382336e+05 4.590402e+06 3.493818e+06 3.386596e+06 7.414118e+04 4.091693e+06 5.601687e+06 3.885548e+06 3.133334e+06 1.905490e+06 2.452903e+06 3.759681e+06 1.997647e+06 3.643119e+06 2.763361e+06 3.454195e+06 4.564588e+06 3.027484e+06 4.067503e+06 3.855910e+06 5.656270e+06 4.030680e+06 4.679069e+06 5.904007e+06 4.970273e+06 7.015180e+06 6.127840e+06 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3.564741e+06 1.547056e+06 4.271317e+06 3.697651e+06 4.959856e+06 4.323718e+06 4.267209e+06 3.223702e+06 2.863404e+06 3.110964e+06 4.310577e+06 4.819529e+06 2.761198e+06 4.262659e+06 4.019983e+06 6.078119e+06 3.853797e+06 3.281412e+06 2.534686e+06 1.133007e+07 4.166770e+06 5.628483e+06 3.339872e+06 3.494415e+06 5.702492e+06 5.748976e+06 3.667231e+06 5.575936e+06 7.031019e+06 3.852549e+06 3.378588e+06 4.779104e+06 3.351492e+06 1.020448e+07 1.642770e+06 2.065715e+06 2.524613e+06 2.265774e+06 4.186633e+06 2.479158e+06 5.635956e+06 C17 H33 N5 O3_1.882 3.530179e+04 3.002242e+06 3.599424e+06 3.893789e+06 5.184817e+04 1.842455e+06 3.220955e+06 3.432229e+06 44165.48 3.051382e+06 3.203594e+06 3.399022e+06 39700.76 3.002155e+06 2.801728e+06 3.441464e+06 3.987515e+04 3.207641e+06 2.912866e+06 3.487841e+06 8.644288e+04 2.521781e+06 3.236938e+06 3.687061e+06 58723.515 3.177882e+06 3.077402e+06 2.844128e+06 8.262815e+04 3.156011e+06 3.135949e+06 3.517173e+06 77910.65 2.781011e+06 2.962618e+06 3.199188e+06 8.023726e+04 3.441853e+06 3.083430e+06 2.890715e+06 6.250778e+04 2.899324e+06 3.611933e+06 3.645661e+06 3.142446e+04 2.576960e+06 3.657978e+06 2.673909e+06 2.078116e+06 2.699639e+06 1.587873e+06 2.562707e+06 1.559820e+06 2.682993e+06 2.075020e+06 2.678827e+06 3.384296e+06 2.167045e+06 3.084848e+06 3.016496e+06 4.327755e+06 2.617697e+06 3.701731e+06 4.269141e+06 3.478857e+06 4.416928e+06 4.177568e+06 2.848975e+06 3.308582e+06 3.284005e+06 4.993655e+06 4.005784e+06 4.498788e+06 4.480697e+06 3.464924e+06 3.375026e+06 3.962795e+06 3.347481e+06 5.837072e+06 4.634690e+06 3.222792e+06 2.949739e+06 2.647875e+06 3.802491e+06 2.407321e+06 4.094826e+06 2.815754e+06 1.519303e+06 3.046704e+06 3.263535e+06 5.316614e+06 3.786347e+06 3.540938e+06 2.893815e+06 4.001938e+06 3.488929e+06 5.294479e+06 1.291040e+06 2.665764e+06 2.718409e+06 2.128365e+06 4.386631e+06 1.214241e+06 3.349468e+06 3.561152e+06 3.485645e+06 2.661917e+06 3.769470e+06 1.899390e+06 1.561043e+06 2.909955e+06 5.314498e+06 4.062753e+06 2.193996e+06 2.348599e+06 1.543900e+06 2.683658e+06 2.119457e+06 1.827294e+06 3.257109e+06 1.509423e+06 1.562025e+06 1.293869e+06 2.442084e+06 2.089528e+06 2.113894e+06 3.801644e+06 1.760158e+06 2.015866e+06 2.298999e+06 2.832574e+06 4.248342e+06 1.884592e+06 3.447766e+06 2.553979e+06 2.743574e+06 3.675730e+06 3.825814e+06 2.602192e+06 3.940483e+06 1.359384e+06 4.956363e+06 4.224521e+06 1.027677e+06 1.839534e+06 2.550478e+06 2.207918e+06 2.644095e+06 3.829689e+06 4.623144e+06 4.057734e+06 5.159732e+06 3.831813e+06 2.511520e+06 2.706958e+06 1.924497e+06 4.554238e+06 3.961873e+06 5.095868e+06 2.516275e+06 3.044668e+06 2.504292e+06 1.528307e+06 1.934557e+06 3.410536e+06 1.910703e+06 1.521619e+06 1.835345e+06 1.947128e+06 1.985927e+06 2.421583e+06 1.652441e+06 2.716661e+06 2.197984e+06 3.584546e+06 3.443279e+06 3.450326e+06 3.819990e+06 3.417757e+06 3.487763e+06 8.040503e+06 2.655253e+06 2.067610e+06 8.101521e+06 2.026587e+06 2.410412e+06 2.153022e+06 2.055373e+06 7.723533e+06 2.888952e+06 7.249989e+06 3.227359e+06 1.570711e+06 2.786673e+06 1.086692e+07 1.626289e+06 7.334908e+06 9.674589e+06 1.843565e+06 7.612550e+06 8.844992e+06 9.594987e+06 1.987440e+06 2.225060e+06 2.792526e+06 1.933296e+06 2.880984e+06 1.313309e+06 4.554313e+06 4.124051e+06 1.589971e+06 2.653118e+06 2.088446e+06 3.328063e+06 2.000384e+06 3.297698e+06 9.706492e+06 3.774557e+06 3.284046e+06 2.308316e+06 3.587150e+06 2.599115e+06 1.168239e+06 2.489577e+06 2.776003e+06 3.816161e+06 2.820115e+06 2.532495e+06 2.388515e+06 2.008653e+06 2.211257e+06 3.935446e+06 3.731664e+06 2.098455e+06 3.157058e+06 2.938083e+06 4.410621e+06 2.939569e+06 2.469391e+06 1.786076e+06 5.720158e+06 3.050866e+06 3.649862e+06 4.015463e+06 2.737178e+06 3.683543e+06 3.880250e+06 2.740365e+06 3.672462e+06 4.695076e+06 2.809359e+06 2.643026e+06 3.228078e+06 2.438855e+06 6.332115e+06 1.203090e+06 1.498796e+06 1.880779e+06 1.677396e+06 2.884151e+06 3.195384e+06 3.807930e+06 "3,4-Methyleneazelaic acid_1.883" 1.441454e+05 1.618333e+07 1.317763e+07 1.303645e+07 1.125229e+05 3.508034e+06 1.224764e+07 1.445360e+07 76773.96 1.218692e+07 1.224811e+07 1.299501e+07 66239.28 1.199592e+07 1.057309e+07 1.329244e+07 1.685123e+05 1.294401e+07 1.315561e+07 1.390588e+07 1.684326e+05 3.160189e+06 1.407811e+07 1.474835e+07 112402.110 1.146507e+07 1.368273e+07 1.236864e+07 1.367992e+05 1.062667e+07 1.124358e+07 1.486527e+07 137376.79 9.265020e+06 1.356173e+07 1.231341e+07 1.492581e+05 1.063579e+07 1.185124e+07 1.303794e+07 1.231308e+05 1.117603e+07 1.343027e+07 1.918527e+07 7.056786e+04 2.829592e+06 1.617815e+07 9.753439e+06 7.871671e+06 6.767012e+06 6.417557e+06 1.085418e+07 7.554666e+06 8.330884e+06 8.269511e+06 9.759203e+06 1.046697e+07 1.084371e+07 9.266489e+06 7.546182e+06 1.236076e+07 1.141126e+07 9.565422e+06 8.031234e+06 9.413974e+06 7.710615e+06 1.251765e+07 9.084856e+06 1.019685e+07 1.016573e+07 1.413761e+07 1.470978e+07 2.016287e+07 1.171028e+07 7.971473e+06 7.094461e+06 8.906419e+06 1.148239e+07 2.291534e+07 8.526241e+06 7.845277e+06 8.095763e+06 5.081557e+06 8.150096e+06 7.295994e+06 9.306803e+06 6.152002e+06 4.416027e+06 8.219504e+06 9.756247e+06 1.107710e+07 7.457909e+06 1.007214e+07 8.405208e+06 1.200947e+07 8.921641e+06 1.130055e+07 7.468222e+06 1.276170e+07 2.569275e+06 9.999096e+06 8.942051e+06 5.908580e+06 9.405055e+06 8.722573e+06 1.137140e+07 7.277046e+06 1.006184e+07 4.304135e+06 4.976050e+06 5.957148e+06 1.669058e+07 2.978966e+06 6.189079e+06 8.973223e+06 6.773956e+06 1.165254e+07 7.806731e+06 5.432081e+06 8.073483e+06 3.942387e+06 4.258290e+06 4.630409e+06 5.045340e+07 5.648308e+06 7.351391e+06 1.361814e+07 5.751400e+06 8.049489e+06 6.593128e+06 8.184412e+06 2.085774e+06 9.768259e+06 6.991236e+06 7.505239e+06 9.195355e+06 1.374008e+07 9.970713e+06 6.943771e+06 9.245185e+06 5.969025e+06 2.035861e+07 9.450215e+06 6.491850e+06 9.619469e+06 1.160354e+07 7.817164e+06 1.087730e+07 1.088702e+08 1.433013e+07 1.199405e+07 1.144582e+07 8.773717e+06 8.450623e+06 1.078863e+07 1.068513e+07 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1.189447e+07 9.591269e+06 8.472283e+06 1.161022e+07 9.447082e+06 1.018509e+07 9.438308e+06 1.509219e+07 8.918101e+06 1.091880e+07 1.041209e+07 7.318472e+06 9.762815e+06 9.049025e+06 7.282714e+06 8.718121e+06 1.073845e+07 9.189601e+06 1.004197e+07 9.787822e+06 8.258058e+06 1.636837e+07 6.211417e+06 8.288249e+06 8.883866e+06 6.330531e+07 1.736924e+08 8.761891e+06 9.846577e+06 C17 H30 N3 O P S_1.883 5.240258e+04 7.727618e+05 8.925108e+05 8.862077e+05 7.506915e+04 4.724225e+05 9.145567e+05 9.110794e+05 58066.10 6.613848e+05 8.901935e+05 8.286371e+05 51470.84 7.407897e+05 6.641368e+05 8.436053e+05 5.624034e+04 8.228588e+05 7.421552e+05 8.374008e+05 1.072153e+05 6.774812e+05 8.890984e+05 9.543938e+05 74293.904 6.897549e+05 7.850440e+05 6.980580e+05 1.051326e+05 7.721542e+05 7.757906e+05 1.087396e+06 108031.83 5.597461e+05 8.309633e+05 7.899453e+05 1.064976e+05 7.405052e+05 7.999457e+05 9.276776e+05 8.214292e+04 5.397646e+05 8.448603e+05 9.311294e+05 3.848472e+04 7.290612e+05 8.870658e+05 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6.685309e+06 4.571059e+06 6.584374e+06 8.509723e+06 5.961962e+06 4.690140e+06 5.727090e+06 4.101987e+06 1.106846e+07 2.231233e+06 2.672640e+06 2.808869e+06 2.447982e+06 4.955843e+06 5.561133e+06 6.869464e+06 C25 H53 N O11_1.886 4.302915e+04 1.960257e+06 3.098875e+06 2.673145e+06 6.138459e+04 1.824277e+06 2.800404e+06 2.868329e+06 47165.68 2.177865e+06 2.626447e+06 2.763873e+06 41953.05 2.026390e+06 2.525492e+06 2.781229e+06 4.746395e+04 2.303546e+06 2.329921e+06 2.538747e+06 8.421844e+04 2.216220e+06 2.586655e+06 3.025675e+06 67496.044 2.632156e+06 1.806464e+06 2.555505e+06 9.238858e+04 2.434776e+06 2.591200e+06 2.899377e+06 80729.26 1.975419e+06 2.514135e+06 2.541903e+06 7.965635e+04 2.381133e+06 2.701335e+06 2.267128e+06 6.292153e+04 2.752271e+06 2.445617e+06 2.785285e+06 3.175024e+04 2.035729e+06 2.557207e+06 2.504667e+06 2.135459e+06 2.217680e+06 1.033463e+06 1.393443e+06 8.942195e+05 2.046504e+06 1.035516e+06 1.444120e+06 1.455048e+06 1.192086e+06 1.737672e+06 2.890269e+06 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9.348275e+05 9.963175e+05 1.112615e+06 C7 H10 O3_1.888 6.449286e+05 4.276466e+05 4.062493e+05 3.333991e+05 5.771248e+04 2.998617e+05 4.024525e+05 4.156570e+05 44750.34 4.048372e+05 3.651569e+05 4.006007e+05 46701.74 3.903281e+05 3.111506e+05 4.685295e+05 4.501965e+04 3.065065e+05 4.146871e+05 3.493060e+05 7.703784e+04 3.462760e+05 4.040777e+05 4.842307e+05 60718.871 3.121575e+05 4.127562e+05 3.304191e+05 1.217840e+05 3.606074e+05 4.287844e+05 4.347850e+05 127719.83 2.896316e+05 3.720245e+05 3.947588e+05 1.003248e+05 3.868592e+05 3.935542e+05 3.245981e+05 7.557814e+04 4.125954e+05 3.483267e+05 3.730713e+05 6.551404e+04 4.146632e+05 5.475670e+05 2.269279e+05 3.868892e+05 5.028596e+05 2.154510e+05 5.299125e+05 3.031201e+05 3.892317e+05 3.543123e+05 3.441053e+05 3.798099e+05 2.797843e+05 7.419524e+05 4.519015e+05 5.917936e+05 2.599741e+05 4.020015e+05 5.271644e+05 2.638586e+05 2.581819e+05 3.826816e+05 4.918149e+05 4.415506e+05 4.349650e+05 4.422365e+05 5.192914e+05 5.690170e+05 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3.623149e+05 3.576379e+05 3.574598e+05 4.011337e+05 5.768459e+05 3.319224e+05 5.039924e+05 4.264436e+05 1.808855e+05 3.992639e+05 2.180038e+05 3.549287e+05 3.712214e+05 4.587229e+05 2.668333e+05 4.830958e+05 4.021520e+05 3.320424e+05 2.826617e+05 2.920000e+05 3.493402e+05 3.813021e+05 3.654930e+05 3.055647e+05 4.298371e+05 3.788440e+05 3.403562e+05 4.016399e+05 2.625029e+05 2.705180e+05 3.578444e+05 3.875989e+05 1.196745e+05 3.222546e+05 3.041812e+05 C25 H45 O4 P_1.888 3.935049e+04 1.153654e+06 1.491651e+06 1.014018e+06 5.696384e+04 5.328085e+05 1.109005e+06 1.133777e+06 44530.85 1.106562e+06 1.038395e+06 1.319789e+06 39034.75 1.124354e+06 8.349226e+05 1.141337e+06 4.599531e+04 1.116291e+06 9.284495e+05 1.216571e+06 8.089792e+04 9.846266e+05 1.088402e+06 1.028310e+06 61296.590 1.216879e+06 1.096952e+06 8.788512e+05 7.944930e+04 1.248352e+06 1.127681e+06 1.151560e+06 73141.04 8.829593e+05 1.093503e+06 1.036151e+06 7.516193e+04 1.138313e+06 1.219790e+06 8.437691e+05 6.073487e+04 1.220197e+06 1.070589e+06 1.209938e+06 3.008261e+04 9.626139e+05 1.086232e+06 1.080163e+06 7.627537e+05 9.620059e+05 5.367643e+05 9.468827e+05 5.184897e+05 6.874952e+05 7.812337e+05 5.941262e+05 6.181714e+05 7.173680e+05 7.811618e+05 1.102158e+06 1.038289e+06 7.507870e+05 1.028507e+06 9.247231e+05 7.493256e+05 1.164614e+06 1.271469e+06 8.248745e+05 7.635024e+05 7.057598e+05 9.758181e+05 7.951103e+05 9.084502e+05 1.156331e+06 5.791508e+05 8.470539e+05 1.087649e+06 1.082349e+06 6.161886e+04 9.501680e+05 1.030032e+06 1.077800e+06 7.300805e+05 1.136934e+06 7.092226e+05 1.308888e+06 6.126822e+05 4.427247e+05 1.027632e+06 1.041119e+06 1.378011e+06 1.083417e+06 1.233045e+06 7.774415e+05 1.323565e+06 1.285599e+06 1.308070e+06 8.276734e+05 1.167183e+06 8.423648e+05 6.770660e+05 1.254769e+06 7.042603e+05 1.001541e+06 9.610141e+05 1.180723e+06 8.341473e+05 1.107700e+06 6.453813e+05 7.297124e+05 1.046897e+06 1.278406e+06 1.117672e+06 1.093708e+06 1.400145e+06 7.123865e+05 1.432872e+06 1.246349e+06 1.247265e+06 8.971373e+05 6.515344e+05 8.346112e+05 5.711453e+05 1.228930e+06 1.131275e+06 9.864565e+05 1.387523e+06 8.626505e+05 1.101698e+06 1.242857e+06 1.165728e+06 7.729332e+04 1.175822e+06 1.488873e+06 9.355759e+05 1.082289e+06 1.430178e+06 1.153008e+06 9.379794e+05 1.220968e+06 4.648777e+05 1.460398e+06 1.160373e+06 1.845719e+05 4.929760e+05 7.709557e+05 6.613418e+05 7.626559e+05 1.085413e+06 9.937309e+05 6.377647e+05 1.105536e+06 6.945350e+05 9.953710e+05 8.897548e+05 1.019867e+06 1.553075e+06 1.798175e+06 1.731574e+06 8.110259e+05 1.213653e+06 1.202988e+06 7.838436e+05 7.913230e+05 9.976028e+05 6.561807e+05 5.859317e+05 6.568920e+05 6.441588e+05 1.059405e+06 1.062444e+06 6.761587e+05 1.122563e+06 7.985044e+05 1.187547e+06 1.264001e+06 8.032673e+05 7.279835e+05 8.211036e+05 9.027805e+05 1.897843e+06 8.102888e+05 8.568046e+05 1.342241e+06 1.851498e+06 1.274297e+06 8.321163e+05 1.336790e+06 1.154587e+06 8.833089e+05 1.458678e+06 1.037542e+06 7.185881e+05 1.734112e+06 1.941602e+06 4.835877e+05 1.183077e+06 1.531063e+06 6.165014e+05 1.168200e+06 1.313519e+06 1.497654e+06 1.070485e+06 1.024218e+06 9.474074e+05 1.030348e+06 1.032614e+06 6.241983e+05 1.509238e+06 1.031373e+06 1.070083e+06 1.058858e+06 7.688572e+05 1.006340e+06 1.496738e+06 1.092163e+06 1.659780e+06 1.576053e+06 1.590182e+06 1.355701e+06 1.039507e+06 9.401179e+05 1.020273e+06 1.592523e+06 2.035851e+06 1.508201e+06 1.718464e+06 1.851340e+06 1.577309e+06 1.308389e+06 1.476740e+06 1.252948e+06 1.254719e+06 1.482046e+06 1.400532e+06 1.435638e+06 1.362425e+06 7.844850e+05 7.939739e+05 1.565519e+06 1.292044e+06 1.786589e+06 2.234249e+06 1.827592e+06 1.736977e+06 1.953646e+06 2.154085e+06 1.483958e+06 1.681282e+06 2.355140e+06 1.818080e+06 6.881792e+05 1.848152e+06 1.006048e+06 2.108179e+06 4.793172e+05 5.372474e+05 4.843832e+05 7.576761e+05 1.982706e+06 1.903566e+06 1.549750e+06 C12 H14 O5_1.89 5.780794e+06 2.067318e+06 2.311684e+06 2.224877e+06 5.748222e+04 1.551849e+06 2.268141e+06 2.309359e+06 43713.06 2.034658e+06 2.200544e+06 2.459931e+06 38675.91 1.867015e+06 1.981374e+06 2.108373e+06 4.362873e+04 2.013503e+06 2.140474e+06 2.091537e+06 7.219544e+04 1.779328e+06 2.328055e+06 2.618490e+06 54346.603 1.954571e+06 2.159980e+06 1.901415e+06 7.721515e+04 1.866283e+06 2.181057e+06 2.583697e+06 62845.32 1.871158e+06 1.915085e+06 2.272280e+06 8.052137e+04 1.970683e+06 2.328847e+06 2.222957e+06 6.411732e+04 1.487117e+06 2.343595e+06 2.695050e+06 2.936144e+04 1.586060e+06 2.481687e+06 1.818865e+06 1.529292e+05 3.202025e+05 1.415248e+07 5.064974e+05 8.041720e+05 1.892871e+06 4.223852e+05 2.364206e+06 1.878821e+06 8.924452e+05 7.170788e+06 8.215528e+05 9.044106e+05 3.842947e+06 3.227587e+05 2.208937e+06 9.715844e+06 5.657220e+05 1.573167e+06 9.638999e+05 5.746757e+05 8.586842e+05 1.012955e+07 8.552265e+05 5.230504e+05 1.371970e+06 1.199799e+06 8.579847e+05 9.522863e+06 7.374740e+05 6.611108e+06 1.850735e+06 3.469329e+05 2.552180e+06 1.051488e+06 9.762171e+05 2.327693e+06 1.996907e+06 3.294148e+06 1.216636e+06 1.692872e+06 3.708418e+05 3.750802e+05 9.086765e+05 1.923702e+06 2.783293e+05 3.960356e+06 6.382316e+06 3.489697e+05 1.421493e+06 2.361187e+06 5.014906e+05 6.797610e+05 9.403496e+05 1.799987e+06 2.633969e+06 1.315784e+06 1.140235e+06 3.777442e+05 7.481129e+05 6.967142e+05 2.270140e+06 1.524132e+06 1.235295e+06 2.351801e+06 3.554677e+06 1.054266e+06 1.631250e+06 1.555498e+06 3.758492e+07 3.127538e+06 1.856849e+06 2.610313e+06 1.908413e+06 4.536158e+05 2.439190e+06 1.889426e+06 4.538459e+06 2.356439e+06 2.009133e+06 5.009022e+06 2.643347e+06 9.720867e+05 1.709601e+06 4.302740e+06 3.455733e+06 2.105942e+06 9.062454e+05 7.883526e+06 3.501389e+06 4.488871e+06 1.331138e+06 7.770930e+05 1.053054e+06 1.811730e+06 1.958691e+06 5.758891e+05 3.177251e+05 8.885134e+05 2.766701e+06 1.588891e+06 9.163703e+05 3.371991e+06 4.476735e+05 9.805814e+05 1.464533e+06 2.724795e+05 2.674122e+05 1.568702e+06 2.809441e+05 1.059716e+06 9.050704e+06 1.374556e+07 2.496343e+05 3.679180e+05 8.804882e+05 5.917547e+06 2.915372e+06 1.704438e+06 6.870692e+06 1.316771e+06 1.428692e+06 6.642679e+06 4.071979e+06 1.039036e+06 2.310075e+05 5.064491e+05 3.785593e+06 3.339989e+06 1.589678e+06 5.300864e+05 3.297707e+06 1.006988e+06 1.176038e+07 6.628604e+05 1.377100e+06 3.541227e+06 1.172658e+06 1.447477e+06 1.396681e+06 4.116529e+05 2.086994e+06 1.393187e+07 1.890173e+06 1.704015e+06 1.888332e+06 1.478134e+06 1.231572e+05 9.391688e+05 3.032570e+06 2.651698e+06 1.008186e+06 1.407666e+06 1.478672e+06 1.578960e+06 1.218904e+06 3.018354e+05 2.485841e+07 1.172316e+06 6.544631e+05 2.838333e+05 1.193991e+06 1.016148e+06 6.286428e+05 9.496090e+05 1.497783e+06 2.171232e+05 3.189664e+06 7.694047e+05 2.542931e+05 2.850895e+06 5.674801e+06 5.168743e+06 2.022625e+06 1.845222e+06 3.767151e+05 1.986027e+05 4.972766e+05 1.452053e+06 2.919627e+06 1.084691e+06 3.489663e+06 4.796197e+05 3.874701e+06 3.111117e+05 1.283801e+06 1.516820e+06 1.939557e+06 3.353013e+06 8.377204e+05 3.365960e+05 1.397432e+06 5.976999e+05 1.296518e+06 9.671262e+05 1.449286e+06 1.407377e+06 1.387889e+06 7.065348e+05 1.241273e+06 2.650209e+06 3.275999e+06 2.940028e+05 2.323857e+06 3.187627e+05 7.606581e+06 2.409087e+06 3.782779e+05 4.908776e+06 9.182626e+06 1.352796e+06 9.938606e+05 2.456764e+06 4.954004e+06 C36 H70 N6 O12_1.89 6.891563e+04 2.866437e+05 3.367813e+05 2.647531e+05 9.870559e+04 2.469658e+05 3.710527e+05 2.776265e+05 77992.57 2.994920e+05 2.914621e+05 3.562034e+05 71775.46 2.947914e+05 2.610458e+05 3.257468e+05 8.866719e+04 2.881094e+05 2.416505e+05 3.523148e+05 1.608147e+05 2.322105e+05 3.160411e+05 3.658809e+05 124357.003 2.830935e+05 2.909870e+05 2.356389e+05 1.733205e+05 4.092531e+05 2.499531e+05 2.103287e+05 131300.03 2.862982e+05 3.186608e+05 3.367982e+05 1.353391e+05 3.468538e+05 3.241502e+05 2.090378e+05 1.074927e+05 3.046239e+05 3.136499e+05 2.948110e+05 4.897023e+04 1.417276e+05 3.274470e+05 2.797397e+05 1.757618e+05 1.293108e+05 1.315340e+05 1.696746e+05 1.660783e+05 1.585662e+05 1.630245e+05 1.830727e+05 1.485602e+05 1.370403e+05 1.613399e+05 1.469469e+05 2.175010e+05 1.545227e+05 1.724132e+05 1.752005e+05 1.815884e+05 1.527943e+05 1.446107e+05 1.754304e+05 1.625912e+05 1.621872e+05 1.330335e+05 1.493135e+05 1.384112e+05 1.858095e+05 1.698253e+05 1.466749e+05 1.836210e+05 1.335485e+05 1.167296e+05 1.536175e+05 1.017147e+05 5.292677e+05 1.647603e+05 1.410727e+05 1.339548e+05 1.620598e+05 1.392100e+05 1.307022e+05 1.246180e+05 1.343666e+05 1.942314e+05 9.949175e+04 2.140272e+05 1.243404e+05 1.556040e+05 1.521248e+05 1.470390e+05 1.237593e+05 1.261437e+05 1.227537e+05 1.314824e+05 1.641595e+05 1.701593e+05 1.491328e+05 1.741860e+05 1.741319e+05 1.423760e+05 1.198980e+06 1.640675e+05 1.960869e+05 2.058017e+05 2.192354e+05 2.030222e+05 1.286285e+05 1.129568e+05 1.256502e+05 1.466632e+05 1.284299e+05 1.535734e+05 1.578862e+05 1.464632e+05 1.365141e+05 1.275413e+05 1.316665e+05 1.417658e+05 1.346783e+05 1.371709e+05 1.262015e+05 1.029658e+05 1.059190e+05 1.511902e+05 1.413996e+05 1.564679e+05 1.999576e+05 1.092033e+05 1.408149e+05 1.229031e+05 1.488213e+05 1.461352e+05 1.520509e+05 1.435954e+05 1.635469e+05 1.290995e+05 1.416645e+05 1.128773e+05 1.533764e+05 1.507214e+05 1.664460e+05 1.371516e+05 1.786423e+05 1.343376e+05 2.098882e+05 1.661934e+05 1.791447e+05 1.332491e+05 1.465954e+05 2.272634e+05 1.795771e+05 2.353462e+05 1.234229e+05 1.618285e+05 1.497061e+05 1.287001e+05 1.441522e+05 1.690728e+05 1.407460e+05 1.631924e+05 1.544360e+05 1.870930e+05 1.509138e+05 1.151544e+05 2.374260e+05 1.676321e+05 1.839027e+05 1.441293e+05 1.094286e+05 1.644256e+05 1.442583e+05 1.884075e+05 1.451802e+05 1.718295e+05 1.060401e+05 1.316460e+05 1.386050e+05 1.945319e+05 1.582443e+05 1.291436e+05 1.666188e+06 1.417555e+05 1.362533e+05 1.997844e+05 5.975212e+05 1.679638e+05 1.848947e+05 1.454722e+05 1.156115e+05 1.457118e+05 2.039307e+05 1.651071e+05 1.529408e+05 1.745759e+05 2.195901e+05 1.697984e+05 1.198641e+05 1.156988e+05 1.246340e+05 1.698282e+05 5.232472e+07 1.706515e+05 1.687526e+05 1.011505e+06 1.425125e+05 1.412104e+05 1.518418e+05 1.055871e+05 1.799234e+05 1.943034e+05 1.643623e+05 1.461711e+05 1.544803e+05 1.797214e+05 1.148363e+05 2.222066e+05 5.117239e+05 2.286527e+05 2.606185e+05 4.322221e+05 7.317571e+05 6.084739e+05 2.241693e+05 3.887471e+06 1.543949e+05 1.512584e+05 1.668415e+05 1.927277e+05 3.704458e+05 7.342693e+05 5.497635e+05 1.297743e+05 9.265432e+04 1.554867e+05 1.281296e+05 6.141100e+05 1.231939e+05 1.314966e+05 1.416986e+05 1.821052e+05 1.912851e+05 1.312417e+05 1.717342e+05 1.131655e+05 1.479954e+05 1.195414e+05 1.182069e+05 2.433069e+05 1.256799e+05 1.286221e+05 1.603043e+05 1.011471e+05 1.446837e+05 1.787048e+05 1.703325e+05 6-Hydroxycaproic acid_1.89 2.864860e+05 3.289759e+06 3.075301e+06 3.499137e+06 1.779512e+05 2.366415e+06 3.689192e+06 3.481465e+06 130729.45 3.259510e+06 3.206389e+06 3.393090e+06 136643.94 2.845746e+06 3.047101e+06 3.312087e+06 1.791563e+05 3.383249e+06 3.082558e+06 2.945610e+06 1.639017e+05 2.162459e+06 4.648507e+06 4.025956e+06 245224.290 2.572544e+06 2.720008e+06 2.943212e+06 1.503920e+05 3.189338e+06 3.779751e+06 3.124106e+06 252965.27 3.122825e+06 3.065195e+06 3.340927e+06 1.796089e+05 2.963511e+06 3.457185e+06 3.044113e+06 1.403363e+05 2.618231e+06 3.577198e+06 3.984748e+06 1.408714e+05 2.635855e+06 3.547640e+06 2.874363e+06 3.391509e+06 4.473005e+06 3.673625e+06 6.210886e+06 4.503953e+06 3.192728e+06 3.945748e+06 5.084266e+06 4.756625e+06 4.288755e+06 7.090104e+06 4.227376e+06 7.762475e+06 4.395186e+06 5.724398e+06 7.857651e+06 6.233824e+06 1.788984e+06 1.573378e+06 5.771542e+06 4.832970e+06 5.001904e+06 8.068451e+06 5.302973e+06 6.515951e+06 6.829544e+06 1.594116e+06 1.395078e+06 1.905976e+06 1.547544e+06 1.860231e+06 2.106326e+06 1.760000e+06 1.620151e+06 1.837847e+06 1.797425e+06 2.306480e+06 1.567330e+06 1.286079e+06 1.190315e+06 1.227633e+06 1.451991e+06 1.832160e+06 1.416983e+06 1.651124e+06 1.244797e+06 1.697963e+06 1.463003e+06 2.399069e+06 8.472357e+05 1.479204e+06 1.522454e+06 1.262686e+06 1.581440e+06 6.593125e+05 1.347583e+06 1.697602e+06 1.631694e+06 1.040974e+06 1.436359e+06 1.412737e+06 9.608986e+05 1.359143e+06 1.629977e+06 1.385266e+06 1.173116e+06 1.565828e+06 9.610092e+05 1.950830e+06 1.604543e+06 1.349575e+06 1.850723e+06 8.529979e+05 1.078537e+06 8.525908e+05 1.441390e+06 1.151253e+06 1.571055e+06 1.888372e+06 9.966568e+05 1.382053e+06 1.272400e+06 1.169040e+06 3.324944e+05 1.311946e+06 1.377142e+06 1.422940e+06 1.516345e+06 2.554123e+06 1.685652e+06 8.918618e+05 1.969470e+06 6.964063e+05 2.207141e+06 2.393474e+06 9.149080e+05 9.666298e+05 1.374862e+06 1.179650e+06 1.277829e+06 2.206796e+06 2.616164e+06 1.488479e+06 2.023441e+06 1.204918e+06 2.274444e+06 2.274503e+06 2.348096e+06 2.990662e+06 2.977926e+06 4.298437e+06 1.522731e+06 1.999329e+06 2.414061e+06 3.551090e+06 2.440371e+06 5.564773e+06 3.122222e+06 3.186181e+06 2.925813e+06 2.296200e+06 3.308854e+06 3.054249e+06 3.271806e+06 3.190221e+06 2.375794e+06 3.133795e+06 3.166930e+06 6.069654e+06 6.237233e+06 6.536520e+06 6.211254e+06 3.367588e+06 6.739092e+06 4.006944e+06 3.801007e+06 4.863341e+06 6.081864e+06 4.381818e+06 3.463361e+06 4.255921e+06 5.857603e+06 3.987342e+06 3.323195e+06 2.491999e+06 4.338256e+06 8.924083e+06 3.699459e+06 4.614836e+06 4.570066e+06 5.878581e+06 3.638317e+06 3.902304e+06 3.629131e+06 5.258022e+06 5.901821e+06 4.956034e+06 4.416626e+06 4.918325e+06 4.068388e+06 8.572438e+06 5.467705e+06 3.835079e+06 4.245937e+06 3.895189e+06 5.693842e+06 6.139202e+06 5.574982e+06 3.525687e+06 6.989299e+06 8.074256e+06 5.525812e+06 6.423170e+06 4.477828e+06 5.293357e+06 5.607804e+06 5.013838e+06 7.998135e+06 5.835522e+06 5.828709e+06 4.640923e+06 4.919915e+06 3.853702e+06 7.457287e+06 3.359521e+06 4.468051e+06 5.043160e+06 2.694519e+06 2.927068e+06 2.520443e+06 4.505748e+06 3.203532e+06 2.822134e+06 3.830516e+06 4.605035e+06 4.865433e+06 3.729616e+06 6.303461e+06 5.536501e+06 3.239216e+06 3.815834e+06 5.548496e+06 4.029662e+06 2.563526e+06 3.973057e+06 3.720685e+06 7.568046e+06 1.349607e+06 1.568618e+06 2.024697e+06 2.908937e+06 3.335206e+06 4.466496e+06 4.599459e+06 C5 H11 N5 P2_1.89 4.084009e+04 9.199572e+05 9.721304e+05 9.072051e+05 5.863538e+04 8.548221e+05 9.537487e+05 1.050791e+06 45916.03 9.273046e+05 9.467565e+05 1.015952e+06 40860.95 8.302235e+05 8.831681e+05 1.053788e+06 4.532485e+04 8.802551e+05 8.924076e+05 9.183187e+05 7.772726e+04 8.021067e+05 1.079589e+06 1.273690e+06 62528.777 7.124544e+05 8.963249e+05 8.889424e+05 9.122990e+04 8.369624e+05 9.545948e+05 1.045011e+06 71917.73 8.778365e+05 1.006834e+06 9.702795e+05 8.926770e+04 7.909373e+05 9.469064e+05 1.043000e+06 6.871231e+04 7.341584e+05 1.032249e+06 1.201202e+06 3.245483e+04 7.243558e+05 1.021143e+06 8.297257e+05 1.132714e+06 1.255053e+06 7.178579e+05 9.471059e+05 5.406004e+05 7.433836e+05 1.724160e+06 8.775752e+05 1.269893e+06 9.146153e+05 1.374508e+06 8.797106e+05 1.657483e+06 7.385502e+05 2.292987e+06 1.553108e+06 1.427327e+06 1.106497e+06 7.924649e+05 1.074104e+06 1.329953e+06 1.147095e+06 1.248917e+06 1.106462e+06 1.352790e+06 2.061697e+06 1.697562e+06 5.366814e+05 1.029225e+06 9.006479e+05 6.184663e+04 8.636575e+05 7.068492e+05 1.195035e+06 1.322634e+06 1.560395e+06 8.503512e+05 7.612473e+05 5.155612e+05 4.996060e+05 6.507224e+05 8.050496e+05 1.469950e+06 7.079384e+05 1.941295e+06 9.697755e+05 1.121496e+06 8.164890e+05 9.447637e+05 4.114193e+05 3.019579e+05 8.824620e+05 8.505071e+05 8.577508e+05 3.527112e+05 5.827469e+05 1.157258e+06 9.852006e+05 7.111759e+05 1.245013e+06 1.011824e+06 7.887578e+05 1.120504e+06 2.473736e+06 9.720909e+05 5.691833e+05 6.012086e+05 5.103258e+05 9.976125e+05 4.800539e+05 6.698937e+05 8.468840e+05 3.514953e+05 6.092928e+05 5.062658e+05 6.915750e+04 5.032765e+05 4.702639e+05 1.693258e+06 5.441481e+05 7.202700e+05 7.762910e+05 8.288832e+05 9.131262e+04 5.524290e+05 7.948825e+05 4.556014e+05 6.428778e+05 8.017102e+05 6.345640e+05 4.936674e+05 1.467780e+06 4.730372e+05 1.156729e+05 8.653378e+05 7.036967e+05 6.926334e+05 4.355009e+05 3.342280e+05 5.518058e+05 7.974911e+04 1.941458e+06 1.297288e+06 1.739460e+06 8.727217e+05 1.739747e+06 6.707817e+05 9.596807e+05 3.495900e+06 3.446686e+06 3.095058e+06 5.350468e+05 6.498206e+05 1.476598e+06 7.584398e+05 1.005962e+06 2.355683e+06 1.191452e+06 1.120524e+06 1.177205e+06 1.477539e+06 1.720939e+06 8.995403e+05 2.089965e+06 1.445133e+06 1.630253e+06 1.452227e+06 8.480839e+05 1.201028e+06 9.246252e+05 2.295898e+06 1.169215e+06 1.340330e+05 1.351719e+05 7.634136e+05 8.055419e+05 1.607978e+05 8.743409e+05 1.474386e+06 8.034160e+05 1.383333e+06 6.717778e+05 1.280122e+06 1.342253e+05 4.485536e+05 1.313827e+06 2.108513e+05 1.315102e+06 1.575996e+05 1.455250e+05 1.075529e+06 8.214958e+05 2.016147e+06 1.483070e+06 9.292580e+05 9.277776e+05 7.334416e+05 3.387265e+05 1.242111e+06 1.030132e+06 1.606161e+06 1.883421e+06 7.478390e+05 1.045037e+06 7.853442e+05 1.009889e+06 2.410232e+05 1.189770e+06 2.725904e+06 2.319513e+06 1.368335e+06 1.410489e+06 1.454787e+06 6.872280e+05 6.744107e+05 1.688251e+06 1.991619e+06 2.101939e+06 2.905348e+06 6.148316e+05 1.556074e+06 1.186546e+06 1.624033e+06 2.177199e+05 3.505359e+05 8.891294e+05 1.861990e+06 9.474729e+05 1.113744e+06 1.932625e+05 1.372257e+06 7.469154e+05 1.044760e+06 7.563439e+05 6.450792e+05 1.291674e+06 6.066277e+05 1.703379e+06 1.707512e+06 1.702756e+06 7.484975e+05 1.812021e+06 9.922082e+05 8.171676e+05 1.071043e+06 1.221132e+06 2.323196e+06 4.942772e+05 1.414238e+06 7.342267e+05 5.237757e+04 9.558182e+04 1.116169e+06 5.770269e+05 (3E)-3-Methyl-3-pentenoic acid_1.89 2.610688e+05 2.455983e+06 2.324458e+06 2.675768e+06 1.423625e+05 1.686587e+06 2.707273e+06 2.616013e+06 102402.92 2.477267e+06 2.434868e+06 2.486134e+06 112203.13 2.019074e+06 2.377371e+06 2.442162e+06 1.518356e+05 2.566020e+06 2.249322e+06 2.142264e+06 1.061160e+05 1.554855e+06 3.652821e+06 3.052391e+06 205491.448 1.863207e+06 1.937252e+06 2.227904e+06 2.385682e+05 2.377784e+06 2.926023e+06 2.131982e+06 209584.41 2.414613e+06 2.209005e+06 2.615315e+06 1.034012e+05 2.194527e+06 2.550469e+06 2.126249e+06 7.964722e+04 1.940669e+06 2.828966e+06 3.077899e+06 1.234759e+05 1.858626e+06 2.924999e+06 1.853083e+06 2.451975e+06 3.341529e+06 2.907689e+06 4.721028e+06 3.388072e+06 2.482380e+06 2.908014e+06 4.155877e+06 3.508397e+06 3.130914e+06 5.579843e+06 3.086091e+06 5.892080e+06 3.921082e+06 4.169554e+06 5.971619e+06 4.956077e+06 1.439618e+06 1.242391e+06 4.517650e+06 3.644932e+06 3.607377e+06 6.374844e+06 3.931866e+06 5.503122e+06 5.030684e+06 1.181043e+06 9.048443e+05 1.311470e+06 1.082313e+06 1.603251e+06 1.318293e+06 1.406633e+06 1.157237e+06 1.435169e+06 1.278969e+06 1.847490e+06 1.214127e+06 9.608587e+05 9.092187e+05 9.521363e+05 9.994013e+05 1.409659e+06 9.667665e+05 1.170684e+06 8.354190e+05 1.340942e+06 1.155222e+06 1.832228e+06 6.481030e+05 1.018449e+06 1.394068e+06 8.744398e+05 1.087571e+06 4.631751e+05 1.007300e+06 1.287541e+06 1.146470e+06 6.521682e+05 1.005634e+06 7.827940e+05 6.626121e+05 1.007268e+06 8.825766e+05 1.025994e+06 8.272415e+05 1.157233e+06 6.700377e+05 1.089046e+06 1.184582e+06 1.055568e+06 1.371465e+06 6.371564e+05 8.088296e+05 6.773635e+05 1.064704e+06 8.419482e+05 1.231325e+06 1.320166e+06 7.548478e+05 8.454998e+05 9.933410e+05 8.171413e+05 2.900212e+05 1.082276e+06 7.775888e+05 1.052710e+06 1.174089e+06 2.277363e+06 1.165876e+06 5.766151e+05 1.556295e+06 5.873923e+05 1.518835e+06 1.917937e+06 6.611164e+05 6.609691e+05 9.113524e+05 8.043618e+05 8.594261e+05 1.733094e+06 1.746380e+06 1.049683e+06 1.369055e+06 8.095281e+05 1.838039e+06 1.729367e+06 1.834037e+06 2.198216e+06 2.059990e+06 3.107054e+06 1.170661e+06 1.506649e+06 1.670914e+06 2.722085e+06 1.975445e+06 4.357883e+06 2.363869e+06 2.367120e+06 2.061905e+06 1.754746e+06 2.330642e+06 2.295243e+06 2.380485e+06 2.210289e+06 1.680838e+06 2.591958e+06 2.322275e+06 4.761849e+06 4.803991e+06 5.005943e+06 4.666945e+06 2.376386e+06 5.636130e+06 2.955339e+06 2.621745e+06 3.577975e+06 4.520200e+06 3.171595e+06 2.903394e+06 3.283750e+06 4.686365e+06 3.060566e+06 2.516964e+06 2.014905e+06 3.081566e+06 6.460404e+06 2.772705e+06 3.396277e+06 3.589669e+06 4.701808e+06 2.626829e+06 2.872649e+06 2.518974e+06 4.009570e+06 4.652175e+06 3.720688e+06 3.240646e+06 3.612385e+06 3.061197e+06 6.198943e+06 3.956779e+06 2.880431e+06 2.980977e+06 2.937506e+06 4.291251e+06 5.213315e+06 3.976018e+06 2.162380e+06 5.485164e+06 6.245745e+06 3.920831e+06 5.026732e+06 3.262642e+06 4.373298e+06 4.283105e+06 3.650316e+06 5.815344e+06 4.513995e+06 4.575685e+06 3.397027e+06 3.687613e+06 2.736661e+06 6.032877e+06 2.780446e+06 3.252017e+06 3.944183e+06 2.140679e+06 2.328505e+06 1.935691e+06 3.457053e+06 2.404816e+06 1.935259e+06 2.930050e+06 3.426122e+06 3.671881e+06 2.897238e+06 5.515364e+06 4.387950e+06 2.399303e+06 2.689374e+06 4.104781e+06 3.057141e+06 1.982316e+06 3.160160e+06 2.876055e+06 5.788408e+06 9.311017e+05 1.113658e+06 1.577109e+06 2.183164e+06 2.519073e+06 3.395406e+06 3.656898e+06 GLYCOCHENODEOXYCHOLATE (Peak 1) 5.168170e+07 4.749341e+07 5.007307e+07 5.198498e+07 2.138476e+05 3.699310e+07 5.102912e+07 5.431178e+07 169084.41 4.540976e+07 5.163821e+07 5.446586e+07 154292.13 4.175251e+07 4.485410e+07 5.157138e+07 1.868499e+05 4.631399e+07 4.486282e+07 5.151432e+07 3.149621e+05 4.076709e+07 5.296742e+07 5.525316e+07 239786.075 4.516749e+07 4.706039e+07 4.414671e+07 3.178821e+05 4.892702e+07 5.199882e+07 5.357523e+07 249878.75 3.998445e+07 4.872224e+07 4.985050e+07 3.068183e+05 4.440351e+07 5.223571e+07 4.854072e+07 2.397615e+05 4.361045e+07 5.079230e+07 5.977722e+07 1.129803e+05 3.511740e+07 5.270732e+07 4.590900e+07 4.580616e+06 4.570110e+07 1.721661e+07 2.164954e+07 2.826551e+07 6.517995e+07 2.953976e+07 1.226955e+08 1.297776e+08 2.038957e+08 5.650591e+07 9.024082e+07 1.547259e+07 5.191143e+07 6.709608e+06 4.265272e+07 7.650160e+07 6.024826e+06 6.945140e+07 6.189595e+06 1.055548e+08 5.671614e+07 5.608111e+07 5.319835e+07 1.993266e+07 1.790780e+07 5.792138e+07 1.685036e+08 3.512506e+07 2.411389e+07 5.459408e+07 6.501900e+07 5.922513e+07 2.709044e+07 1.163458e+08 8.010795e+06 2.794626e+06 5.019620e+07 2.286146e+07 4.284594e+07 4.181649e+07 2.851748e+07 2.004946e+07 3.244543e+07 1.112970e+08 3.894890e+07 5.370691e+07 2.129627e+07 2.158774e+07 8.534739e+07 2.503078e+07 1.666044e+07 6.510631e+07 7.243078e+07 1.726492e+08 4.724495e+07 1.885033e+07 3.284871e+07 6.521461e+07 2.882377e+07 1.392868e+07 2.545184e+07 7.113042e+07 1.300974e+08 7.185555e+07 4.061930e+07 2.919353e+07 3.873615e+07 2.535509e+07 1.320637e+07 5.863627e+07 5.609374e+07 4.867007e+07 1.847567e+07 2.669457e+07 1.066770e+08 7.101448e+07 2.751251e+07 1.222990e+08 1.312959e+07 7.610712e+07 5.842787e+07 5.645641e+06 2.672618e+07 1.144436e+08 6.208706e+07 4.245473e+07 7.076849e+07 4.962054e+07 5.115383e+07 6.487704e+07 8.798573e+07 3.729648e+07 5.088748e+07 2.986875e+07 7.585556e+07 1.216452e+08 3.213215e+07 1.544175e+08 7.202977e+07 1.330837e+08 3.131547e+07 1.066476e+08 6.299664e+07 3.769773e+07 2.204568e+07 5.723374e+07 9.065678e+06 2.075059e+08 3.438197e+07 3.166518e+07 2.528839e+08 2.584469e+07 3.958245e+07 1.104117e+08 4.403800e+07 2.865218e+07 2.437828e+07 5.981481e+06 2.380035e+07 2.181096e+07 2.447681e+07 5.137460e+07 7.099605e+07 5.728644e+07 1.195616e+07 4.954976e+07 1.633116e+07 7.676753e+07 1.289938e+08 2.907317e+07 2.396062e+07 2.865769e+06 3.865304e+07 6.865405e+07 7.626569e+06 6.307501e+06 1.721598e+07 5.900051e+07 2.994210e+07 3.780815e+06 1.426199e+07 2.673180e+07 3.441732e+07 1.484261e+07 4.865617e+07 3.632610e+07 3.405872e+07 4.588200e+07 2.816206e+07 2.908772e+07 1.195356e+07 4.032442e+07 2.483675e+07 3.861969e+07 3.989840e+07 2.106465e+07 3.031180e+07 8.053116e+06 1.590755e+07 1.746495e+07 7.973871e+07 2.077368e+07 2.028193e+07 4.042978e+07 7.067532e+07 4.315893e+06 5.602729e+07 2.576080e+07 4.165973e+06 1.500068e+07 1.231652e+07 5.799407e+07 2.512009e+07 4.320330e+07 2.286563e+07 6.404515e+07 1.550068e+07 3.689053e+07 8.614714e+07 4.303733e+07 1.066175e+08 3.619634e+07 7.755748e+07 6.932686e+07 1.146612e+07 2.460139e+07 1.346055e+07 3.939467e+07 8.087072e+07 4.186784e+07 4.719106e+07 2.443212e+07 5.115215e+07 2.871092e+07 2.573880e+07 1.875842e+07 6.274446e+07 5.345533e+07 5.339008e+06 4.561061e+07 1.262553e+07 2.555267e+07 6.249984e+06 6.352388e+07 5.537783e+07 4.889255e+07 2.402957e+07 4.791037e+06 1.604663e+08 4.602339e+07 2.745921e+07 1.287654e+07 1.713253e+08 C47 H78 N3 O P S2_1.891 2.872125e+04 2.202187e+05 2.430478e+05 1.964403e+05 4.070898e+04 1.994694e+05 3.033617e+05 2.202616e+05 31309.37 2.193430e+05 2.203976e+05 2.810173e+05 28270.13 2.273869e+05 1.926617e+05 2.498076e+05 3.690189e+04 2.237343e+05 1.791482e+05 2.843675e+05 6.733043e+04 1.640321e+05 2.470658e+05 2.870387e+05 52031.316 2.202337e+05 2.142999e+05 1.622380e+05 7.354078e+04 3.394150e+05 2.223152e+05 1.228677e+05 56951.08 2.050948e+05 2.494882e+05 2.662135e+05 5.657601e+04 2.760336e+05 2.561658e+05 1.306282e+05 4.419531e+04 2.335880e+05 2.687472e+05 2.160566e+05 2.005617e+04 5.809985e+04 2.683599e+05 1.999349e+05 8.358173e+04 5.288697e+04 5.445364e+04 7.002845e+04 7.164089e+04 6.754252e+04 6.764735e+04 7.737281e+04 6.211733e+04 5.688251e+04 6.777230e+04 6.022578e+04 9.416378e+04 6.354670e+04 7.123560e+04 7.276988e+04 6.253182e+04 5.552031e+04 6.056368e+04 7.522400e+04 6.810120e+04 6.813671e+04 5.356862e+04 6.253965e+04 5.801346e+04 7.763106e+04 7.188161e+04 6.196078e+04 7.691678e+04 5.578476e+04 4.827296e+04 6.358242e+04 4.085818e+04 4.667236e+05 6.847613e+04 5.849103e+04 5.611105e+04 6.604115e+04 5.731772e+04 5.362433e+04 5.192932e+04 5.611092e+04 8.400990e+04 3.997676e+04 9.036718e+04 5.005836e+04 5.792013e+04 6.362243e+04 6.065068e+04 4.774317e+04 5.277544e+04 5.041605e+04 5.248197e+04 6.984269e+04 7.132730e+04 6.384337e+04 7.371035e+04 7.487184e+04 6.156622e+04 1.131798e+06 6.920124e+04 8.452354e+04 8.860060e+04 9.158511e+04 9.006278e+04 5.269756e+04 4.574336e+04 5.097079e+04 6.124621e+04 5.303457e+04 6.172467e+04 6.670778e+04 5.985292e+04 5.564697e+04 5.195929e+04 5.606467e+04 5.774003e+04 5.587553e+04 5.508393e+04 5.311273e+04 4.176032e+04 4.292498e+04 6.362796e+04 5.947742e+04 6.459041e+04 8.556604e+04 4.565695e+04 5.897220e+04 5.112822e+04 6.245028e+04 6.135774e+04 6.349179e+04 5.856284e+04 6.886788e+04 5.307762e+04 5.958435e+04 4.559354e+04 6.619306e+04 6.154719e+04 7.072169e+04 5.442945e+04 7.536174e+04 5.477617e+04 8.971751e+04 6.946130e+04 7.301576e+04 5.120504e+04 5.111473e+04 9.712952e+04 7.207773e+04 9.827477e+04 4.747729e+04 7.004922e+04 6.355672e+04 5.390067e+04 5.976970e+04 7.121919e+04 5.792551e+04 6.774271e+04 6.290389e+04 7.671839e+04 6.276317e+04 4.640550e+04 1.166983e+05 6.935287e+04 7.712914e+04 5.877802e+04 4.417071e+04 7.128960e+04 5.973484e+04 7.865241e+04 6.066694e+04 7.099215e+04 4.427293e+04 5.030714e+04 5.552497e+04 9.560879e+04 6.796285e+04 5.196216e+04 1.538879e+06 5.689652e+04 5.577240e+04 8.311856e+04 5.302928e+05 7.770782e+04 8.903429e+04 6.013108e+04 4.652328e+04 5.950057e+04 7.205364e+04 7.036611e+04 6.393804e+04 7.016516e+04 9.183675e+04 6.517340e+04 4.591558e+04 4.718753e+04 5.144648e+04 7.166856e+04 4.844790e+07 7.126933e+04 6.911230e+04 9.600500e+05 5.782734e+04 5.916247e+04 6.505012e+04 4.453026e+04 8.595806e+04 7.750829e+04 6.697218e+04 6.055425e+04 6.452350e+04 1.107701e+05 4.641004e+04 1.513757e+05 4.198693e+05 1.393075e+05 1.847779e+05 3.292919e+05 6.488950e+05 5.343801e+05 1.257016e+05 3.749013e+06 6.297185e+04 6.533151e+04 6.989310e+04 8.149588e+04 2.366791e+05 6.501408e+05 4.970037e+05 5.215381e+04 3.764895e+04 6.493602e+04 6.632247e+04 5.389151e+05 4.970251e+04 5.383704e+04 5.275051e+04 7.704181e+04 8.297390e+04 5.494068e+04 7.082028e+04 4.405933e+04 6.347710e+04 4.808446e+04 4.744923e+04 6.657353e+04 5.240692e+04 5.171865e+04 6.647278e+04 4.200404e+04 5.996597e+04 7.623282e+04 7.078854e+04 C22 H51 N6 O4 P_1.891 7.550538e+05 5.018118e+05 5.863345e+05 6.305678e+05 2.941951e+04 4.129589e+05 4.725618e+05 5.697043e+05 37561.30 4.821674e+05 4.506752e+05 6.183642e+05 42100.59 4.792156e+05 5.672068e+05 5.718279e+05 5.284676e+04 5.348274e+05 4.348318e+05 5.011387e+05 9.583712e+04 5.022266e+05 5.948226e+05 4.111452e+05 66812.008 5.904946e+05 5.463996e+05 3.588175e+05 7.782897e+04 7.460090e+05 5.741323e+05 6.990921e+05 62451.03 2.902246e+05 3.000480e+05 5.653166e+05 6.876317e+04 6.150061e+05 5.166634e+05 4.848166e+05 4.902666e+04 6.150618e+05 5.526576e+05 5.788680e+05 2.523617e+04 4.515735e+05 4.451415e+05 5.663397e+05 8.053643e+04 5.295135e+05 2.370620e+05 1.541460e+05 2.365401e+05 7.145743e+05 3.078775e+05 1.247240e+06 1.729731e+06 2.329553e+06 9.293638e+05 1.292189e+06 9.858415e+04 6.537844e+05 1.670827e+05 5.442072e+05 1.265524e+06 8.273769e+04 7.473092e+05 8.953391e+04 1.237441e+06 6.200750e+05 4.413982e+05 5.897842e+05 1.057977e+05 1.080755e+05 6.365236e+05 1.551426e+06 3.344605e+05 1.542414e+05 6.637360e+05 6.666640e+05 6.153784e+05 2.893156e+05 1.427134e+06 1.306966e+05 9.796845e+04 3.670151e+05 2.812849e+05 3.486306e+05 4.409525e+05 2.218200e+05 1.511468e+05 2.841107e+05 1.164876e+06 4.827341e+05 5.262708e+05 1.641320e+05 1.865906e+05 1.092326e+06 1.795654e+05 1.389297e+05 8.827202e+05 7.177058e+05 2.252836e+06 3.942232e+05 1.766390e+05 3.864390e+05 1.048982e+06 4.558160e+05 7.890382e+04 2.147947e+05 1.012777e+06 1.590963e+06 5.601789e+05 4.329754e+05 2.545191e+05 4.781605e+05 2.098827e+05 1.579019e+05 7.656900e+05 6.636808e+05 7.071587e+05 2.055664e+05 3.802844e+05 1.742081e+06 1.179923e+06 2.947173e+05 1.439922e+06 1.360925e+05 9.405463e+05 7.053394e+05 1.412201e+05 2.775460e+05 1.290474e+06 8.387654e+05 4.651408e+05 7.830048e+05 4.803257e+05 5.028452e+05 7.292292e+05 9.477043e+05 5.379022e+05 3.542720e+05 3.273322e+05 9.136221e+05 1.186325e+06 3.115966e+05 1.528613e+06 8.107674e+05 1.194793e+06 4.000200e+05 1.469730e+06 9.016615e+05 4.401115e+05 1.678452e+05 8.618804e+05 5.498862e+04 2.209315e+06 4.561067e+05 2.869876e+05 3.038239e+06 3.494371e+05 6.183480e+05 1.765957e+06 5.045490e+05 4.397893e+05 2.167496e+05 7.942579e+04 1.292363e+05 4.055283e+05 2.313292e+05 4.432332e+05 1.150281e+06 1.113408e+06 1.275002e+05 5.806760e+05 8.061958e+04 1.004632e+06 1.633520e+06 3.131366e+05 1.413971e+05 7.971659e+04 3.893052e+05 9.715447e+05 7.095113e+04 1.122973e+05 8.034487e+04 7.947143e+05 3.197065e+05 6.632860e+04 6.239430e+04 2.712866e+05 1.879683e+05 2.210307e+05 8.230270e+05 2.069825e+05 4.311986e+05 2.978765e+05 1.244886e+05 3.645682e+05 9.151479e+04 3.401074e+05 4.053063e+05 5.059188e+05 3.957698e+05 1.989773e+05 3.561843e+05 8.111592e+04 1.193573e+05 9.829392e+04 1.181481e+06 2.109955e+05 8.082553e+04 4.860791e+05 9.294855e+05 6.321629e+04 6.485247e+05 1.026334e+05 7.714002e+04 1.697476e+05 8.634691e+04 6.694390e+05 2.897030e+05 3.904194e+05 2.448032e+05 8.988273e+05 8.345263e+04 9.330954e+05 9.628162e+05 6.292486e+05 1.278629e+06 3.955499e+05 8.295846e+05 7.543439e+05 2.273802e+05 1.639960e+05 7.546303e+04 4.298955e+05 7.431337e+05 4.961631e+05 5.760076e+05 9.099001e+04 3.295922e+05 1.246532e+05 2.091993e+05 9.553213e+04 4.574105e+05 4.544580e+05 8.844407e+04 4.503014e+05 2.818538e+05 2.489106e+05 9.466888e+04 6.758609e+05 6.630989e+05 4.719882e+05 1.607836e+05 5.367528e+04 1.972346e+06 5.096126e+05 1.927518e+05 7.861992e+04 1.624129e+06 C26 H41 N O4_1.891 2.187265e+07 2.070554e+07 2.130302e+07 2.366578e+07 1.185340e+05 1.711442e+07 2.267783e+07 2.480057e+07 90254.72 1.976881e+07 2.245071e+07 2.361958e+07 80842.35 1.875382e+07 2.127995e+07 2.209521e+07 9.829869e+04 2.075105e+07 1.929906e+07 2.467831e+07 1.628110e+05 1.787401e+07 2.316242e+07 2.369049e+07 126638.848 2.003525e+07 2.106746e+07 2.010439e+07 1.659816e+05 2.174226e+07 2.171003e+07 2.548957e+07 127031.33 1.715972e+07 2.213333e+07 2.253620e+07 1.544062e+05 1.926146e+07 2.260982e+07 2.178035e+07 1.197334e+05 1.952030e+07 2.253149e+07 2.635993e+07 5.535987e+04 1.606649e+07 2.244346e+07 2.109643e+07 2.297491e+06 1.927507e+07 8.703643e+06 9.194763e+06 1.128719e+07 3.456402e+07 1.151321e+07 5.547920e+07 5.704460e+07 9.443973e+07 2.383750e+07 3.921133e+07 7.838951e+06 1.694325e+07 2.509323e+06 1.549721e+07 4.002549e+07 2.382423e+06 3.106423e+07 2.976126e+06 4.767498e+07 2.578616e+07 2.888369e+07 2.465667e+07 1.037981e+07 7.914697e+06 2.913261e+07 6.946057e+07 1.383879e+07 1.085730e+07 1.946039e+07 3.093731e+07 2.418309e+07 1.260511e+07 4.449797e+07 3.356632e+06 1.332520e+06 2.013800e+07 1.046257e+07 1.860973e+07 1.940620e+07 1.299268e+07 7.775286e+06 1.406501e+07 5.179615e+07 1.829386e+07 2.443656e+07 1.092906e+07 9.585272e+06 4.008722e+07 1.187728e+07 6.906040e+06 2.806065e+07 3.038281e+07 7.998679e+07 2.066014e+07 7.202717e+06 1.447727e+07 2.849400e+07 1.350298e+07 6.732226e+06 1.272698e+07 3.093555e+07 6.184238e+07 3.300728e+07 1.816499e+07 1.430074e+07 1.839465e+07 1.194140e+07 5.126683e+06 2.744591e+07 2.259674e+07 2.087607e+07 8.485025e+06 1.205539e+07 4.743128e+07 3.332251e+07 1.254234e+07 4.912190e+07 2.469214e+06 3.397403e+07 2.112170e+07 3.076761e+06 1.431327e+07 5.142799e+07 2.524244e+07 1.899912e+07 3.413782e+07 2.200539e+07 2.256708e+07 2.601599e+07 4.192850e+07 1.319361e+07 2.505073e+07 1.331608e+07 3.672827e+07 6.126801e+07 1.550201e+07 6.916024e+07 3.312911e+07 6.043169e+07 1.464740e+07 4.725846e+07 2.821158e+07 1.744225e+07 8.375963e+06 2.269694e+07 4.531445e+06 9.439408e+07 1.531872e+07 1.288480e+07 1.238619e+08 1.290478e+07 1.489311e+07 4.944166e+07 1.772685e+07 1.072870e+07 1.081289e+07 2.792583e+06 1.046104e+07 1.154160e+07 1.061663e+07 2.462658e+07 3.403505e+07 2.309682e+07 5.943355e+06 1.941991e+07 7.622368e+06 3.534592e+07 5.093471e+07 1.256908e+07 9.284161e+06 1.723743e+06 1.325149e+07 3.162666e+07 3.535640e+06 2.989097e+06 7.966277e+06 2.237508e+07 1.204109e+07 1.643807e+06 6.754768e+06 1.014017e+07 1.586228e+07 6.154002e+06 1.941377e+07 1.666667e+07 1.428358e+07 1.651612e+07 1.262746e+07 1.295305e+07 5.389666e+06 1.718574e+07 1.100870e+07 1.438207e+07 1.601878e+07 8.716425e+06 1.185263e+07 4.441460e+06 7.903048e+06 8.736982e+06 3.172366e+07 8.543666e+06 1.017183e+07 1.916634e+07 2.808934e+07 1.995766e+06 2.321761e+07 1.171459e+07 2.088576e+06 5.603774e+06 5.532225e+06 2.737797e+07 1.043901e+07 2.039176e+07 9.906468e+06 2.682111e+07 5.874379e+06 2.197102e+07 3.387041e+07 2.014498e+07 4.576702e+07 1.854832e+07 3.175363e+07 3.023289e+07 5.291346e+06 1.190092e+07 6.930107e+06 1.981844e+07 3.335227e+07 1.695522e+07 2.112200e+07 9.506400e+06 2.317348e+07 1.209495e+07 1.113512e+07 7.591589e+06 2.309765e+07 2.337314e+07 2.365398e+06 2.062751e+07 4.869735e+06 9.371586e+06 2.772439e+06 3.042586e+07 2.705934e+07 2.083174e+07 1.007901e+07 1.931292e+06 7.658462e+07 2.039713e+07 1.383018e+07 5.881535e+06 8.421512e+07 C8 H11 N O3 S_1.891 1.282770e+05 2.846607e+08 2.895391e+08 2.848425e+08 1.803749e+05 2.213405e+08 2.881099e+08 3.179541e+08 134243.29 2.716366e+08 2.942381e+08 2.962955e+08 118650.06 2.614387e+08 2.595962e+08 2.881166e+08 1.341897e+05 2.712349e+08 2.789452e+08 2.881503e+08 2.311094e+05 2.363873e+08 3.007212e+08 3.535267e+08 182496.651 2.411705e+08 2.746037e+08 2.531050e+08 2.589654e+05 2.575380e+08 2.931887e+08 3.498346e+08 217754.52 2.600053e+08 3.162028e+08 3.127244e+08 3.066457e+05 6.402427e+07 3.392399e+08 3.125197e+08 2.165881e+05 2.725137e+08 2.992108e+08 3.209115e+08 9.542074e+04 2.290555e+08 2.948119e+08 2.663971e+08 2.994998e+08 3.317474e+08 2.200736e+08 2.754352e+08 1.941266e+08 2.432236e+08 4.549179e+08 2.070438e+08 3.569092e+08 2.830689e+08 4.444511e+08 2.976478e+08 4.682854e+08 2.645150e+08 6.766116e+08 4.716201e+08 4.291212e+08 3.125707e+08 2.387895e+08 3.616229e+08 3.731288e+08 3.138955e+08 3.884185e+08 3.184436e+08 3.838139e+08 5.600558e+08 4.266583e+08 1.682163e+08 3.105016e+08 2.280446e+08 3.861190e+06 3.170173e+08 2.110507e+08 3.399316e+08 3.891520e+08 4.063344e+08 2.574487e+08 2.178953e+08 1.518690e+08 1.545303e+08 1.843022e+08 2.548324e+08 4.584457e+08 2.186336e+08 5.179254e+08 2.627225e+08 2.958943e+08 2.611568e+08 3.044894e+08 1.148529e+08 1.052614e+08 2.526399e+08 2.728876e+08 2.417686e+08 1.051607e+08 1.953360e+08 3.456026e+08 2.996912e+08 2.294427e+08 3.374283e+08 2.766464e+08 2.372671e+08 2.956373e+08 7.686734e+08 4.852221e+07 1.728247e+08 1.872738e+08 1.547410e+08 3.041659e+08 1.778496e+08 2.006616e+08 2.939899e+08 1.121445e+08 2.060666e+08 1.774715e+08 4.596539e+06 1.742154e+08 1.717628e+08 4.895735e+08 1.393673e+08 1.967792e+08 2.404494e+08 2.443736e+08 4.198204e+05 1.892613e+08 2.143855e+08 1.506862e+08 2.054933e+08 1.971105e+08 2.033713e+08 1.334662e+08 3.884475e+08 2.057268e+08 4.397126e+07 2.577040e+08 2.184129e+08 2.078071e+08 1.603658e+08 1.118856e+08 1.878654e+08 3.357855e+06 6.804495e+08 3.666299e+08 4.457402e+08 2.845934e+08 5.182685e+08 2.176697e+08 2.918327e+08 1.039755e+09 8.858801e+08 8.339294e+08 1.959607e+08 2.503419e+08 4.887969e+08 2.325767e+08 2.532063e+08 6.971414e+08 3.197613e+08 3.801108e+08 3.646286e+08 2.874196e+08 5.095970e+08 2.461820e+08 5.525467e+08 4.651944e+08 4.254001e+08 2.823138e+08 2.080635e+08 3.969739e+08 3.770937e+08 6.101760e+08 3.318647e+08 7.083295e+07 5.212752e+07 3.493202e+07 2.595012e+08 5.293878e+07 2.676829e+08 3.867455e+08 1.628704e+08 4.129812e+08 4.420656e+07 3.605882e+08 4.783829e+07 1.532172e+08 4.610109e+08 4.257200e+07 3.504171e+08 8.315660e+07 6.623744e+07 2.794213e+08 2.575661e+08 5.468713e+08 4.470089e+08 3.229917e+08 2.860009e+08 2.327083e+08 9.069160e+07 3.367608e+08 2.808776e+08 4.683666e+08 5.127141e+08 2.452693e+08 2.878250e+08 2.234919e+08 2.964496e+08 8.558268e+07 3.297971e+08 7.673191e+08 6.742129e+08 3.723197e+08 3.830123e+08 4.098853e+08 1.986327e+08 2.234599e+08 5.306358e+08 5.603600e+08 5.697198e+08 8.431365e+08 2.111926e+08 4.505033e+08 3.078683e+08 4.238795e+08 7.776322e+07 1.083261e+08 2.758504e+08 4.684788e+08 4.223733e+08 3.304550e+08 7.327183e+07 3.774736e+08 2.041522e+08 3.102912e+08 2.114129e+08 1.996769e+08 3.858364e+08 1.841105e+08 4.422237e+08 3.876618e+08 4.086140e+08 2.001787e+08 5.056013e+08 2.834199e+08 2.895026e+08 1.843273e+08 3.667351e+08 6.313665e+08 1.407035e+08 3.949569e+08 2.175030e+08 2.693110e+07 2.068349e+06 3.452444e+08 1.743661e+08 "5-Acetyl-2,4-dimethylthiazole_1.892" 4.870898e+04 8.497888e+06 7.989708e+06 8.237380e+06 6.681131e+04 4.333091e+06 8.141755e+06 8.828286e+06 48075.95 7.317495e+06 8.471837e+06 7.651327e+06 42319.94 6.903404e+06 7.693141e+06 7.244794e+06 4.785610e+04 7.755477e+06 7.661422e+06 7.459950e+06 8.145056e+04 6.473521e+06 8.041445e+06 1.076929e+07 62564.576 6.187576e+06 7.246933e+06 6.874050e+06 8.820255e+04 7.296035e+06 7.777529e+06 9.195163e+06 69839.56 6.429980e+06 7.758327e+06 7.914689e+06 8.706366e+04 7.171059e+06 7.367513e+06 7.840740e+06 6.720057e+04 6.891481e+06 8.576385e+06 9.731624e+06 3.119405e+04 5.326428e+06 7.774581e+06 7.570155e+06 8.454273e+06 8.695108e+06 6.138328e+06 6.093220e+06 4.240237e+06 5.725316e+06 1.329710e+07 6.106984e+06 9.931112e+06 7.651577e+06 9.418404e+06 8.476637e+06 1.278247e+07 2.940873e+06 1.878178e+07 1.088807e+07 1.125187e+07 8.806676e+06 6.946819e+06 8.746927e+06 1.059479e+07 9.399876e+06 1.027236e+07 8.342103e+06 1.011506e+07 1.666912e+07 1.231392e+07 4.067377e+06 8.833962e+06 6.556258e+06 6.495006e+04 6.591179e+06 5.356273e+06 9.800673e+06 9.435090e+06 1.270073e+07 7.363728e+06 5.017692e+06 4.263646e+06 4.222914e+06 4.418925e+06 6.878710e+06 1.261306e+07 5.921618e+06 1.521559e+07 6.975352e+06 8.127677e+06 7.170453e+06 7.292831e+06 2.136692e+06 2.344316e+06 6.338557e+06 6.869730e+06 6.774210e+06 2.226828e+06 4.183479e+06 7.570521e+06 7.277281e+06 5.284376e+06 9.558208e+06 8.248605e+06 5.869241e+06 7.002637e+06 1.926375e+07 7.646099e+06 3.955146e+06 4.718089e+06 4.144225e+06 8.898237e+06 3.414742e+06 5.019973e+06 6.244953e+06 2.856951e+06 5.233383e+06 4.272667e+06 6.671049e+04 3.763080e+06 3.027446e+06 1.483615e+07 1.816624e+06 6.013814e+06 6.145855e+06 6.636241e+06 8.908219e+04 5.166533e+06 5.420882e+06 4.046460e+06 5.147283e+06 5.047471e+06 4.678650e+06 3.379152e+06 1.069072e+07 5.222273e+06 1.050243e+06 6.522484e+06 5.537735e+06 6.116716e+06 4.023616e+06 2.456051e+06 4.583106e+06 1.485962e+05 1.791874e+07 1.055712e+07 1.225737e+07 7.217725e+06 1.387714e+07 5.850105e+06 7.772588e+06 2.463536e+07 2.692250e+07 2.215196e+07 4.942177e+06 6.046188e+06 1.361397e+07 6.380108e+06 7.951218e+06 1.720704e+07 8.090567e+06 8.061228e+06 8.088049e+06 1.292112e+07 1.242192e+07 6.903583e+06 1.564139e+07 1.225139e+07 1.221929e+07 7.434232e+06 5.285414e+06 9.568962e+06 8.440398e+06 1.742055e+07 9.810327e+06 1.404738e+06 1.158739e+06 6.756356e+06 5.940130e+06 1.339797e+06 6.092713e+06 1.162451e+07 4.168087e+06 1.134602e+07 5.708458e+06 8.992163e+06 1.082306e+06 3.143828e+06 1.055405e+07 7.750355e+05 1.057814e+07 1.737246e+06 1.571582e+06 7.545877e+06 7.821335e+06 1.646083e+07 1.299798e+07 6.920107e+06 8.366067e+06 5.990807e+06 2.258067e+06 9.115078e+06 8.476227e+06 1.390856e+07 1.474212e+07 5.463326e+06 7.244180e+06 5.931645e+06 7.885340e+06 1.859485e+06 9.829476e+06 1.795712e+07 1.915191e+07 1.049109e+07 9.784292e+06 1.146982e+07 5.633609e+06 6.121010e+06 1.574857e+07 1.628659e+07 1.688844e+07 1.939036e+07 4.772380e+06 1.365739e+07 8.764248e+06 1.248189e+07 1.748845e+06 2.513193e+06 7.398509e+06 1.277507e+07 1.002267e+07 9.583858e+06 1.626018e+06 9.992200e+06 5.415464e+06 8.395478e+06 5.725761e+06 4.340534e+06 1.118340e+07 4.627097e+06 1.210863e+07 1.097714e+07 1.260123e+07 6.236743e+06 1.430860e+07 7.611546e+06 7.485809e+06 4.768758e+06 1.048880e+07 1.853242e+07 3.510839e+06 1.142345e+07 4.456077e+06 6.802129e+05 9.866127e+04 9.424072e+06 4.530775e+06 "4-{(Z)-[(4E,7Z,16Z,19Z)-1-Hydroxy-4,7,10,13,16,19-docosahexaen-1-ylidene]amino}butanoic acid_1.892" 5.261306e+06 5.049092e+06 5.614567e+06 5.684084e+06 6.111370e+04 3.580739e+06 5.523070e+06 6.069638e+06 46328.03 4.702834e+06 5.377054e+06 5.893609e+06 41076.74 4.414447e+06 4.946098e+06 5.348225e+06 4.678148e+04 5.262664e+06 4.755872e+06 5.715464e+06 8.183259e+04 4.204853e+06 5.577372e+06 6.224084e+06 63825.163 4.701025e+06 4.925932e+06 4.958688e+06 8.544878e+04 5.231056e+06 4.880885e+06 6.244151e+06 64280.72 3.954005e+06 5.832907e+06 5.267085e+06 7.657819e+04 4.784805e+06 5.529478e+06 5.039752e+06 6.019898e+04 4.661942e+06 5.501116e+06 6.187774e+06 2.777087e+04 4.090609e+06 5.442350e+06 5.058001e+06 5.692151e+05 4.683431e+06 2.151627e+06 2.406968e+06 2.693612e+06 8.237504e+06 2.717691e+06 1.318673e+07 1.419353e+07 2.274866e+07 5.910336e+06 9.471253e+06 1.847482e+06 2.823370e+06 5.506067e+05 1.971242e+06 1.116437e+07 5.071869e+05 8.001790e+06 8.223967e+05 1.189745e+07 6.426094e+06 7.117963e+06 5.987053e+06 2.832133e+06 1.948715e+06 7.357773e+06 1.733337e+07 3.171795e+06 2.291192e+06 4.271621e+06 7.341904e+06 5.999009e+06 2.759248e+06 1.068014e+07 7.051993e+05 3.574713e+05 4.873556e+06 1.914244e+06 4.164695e+06 4.920486e+06 3.496766e+06 1.582878e+06 3.249696e+06 1.187954e+07 4.465957e+06 5.910804e+06 2.661514e+06 2.003618e+06 9.141139e+06 3.004946e+06 1.496600e+06 7.009434e+06 7.713164e+06 1.992316e+07 5.295456e+06 1.793513e+06 3.312774e+06 7.308275e+06 3.305329e+06 1.842670e+06 3.293398e+06 8.011590e+06 1.464898e+07 8.504860e+06 4.487940e+06 3.380547e+06 4.465770e+06 2.672385e+06 1.681534e+06 6.866946e+06 4.617100e+06 5.051140e+06 1.982060e+06 3.085088e+06 1.138621e+07 8.491694e+06 2.564818e+06 1.256644e+07 9.251339e+05 8.733240e+06 5.586052e+06 9.869437e+05 3.011632e+06 1.382751e+07 6.105160e+06 4.345063e+06 8.346128e+06 5.395350e+06 5.441962e+06 6.364461e+06 1.015490e+07 3.215966e+06 6.147777e+06 3.252624e+06 8.988279e+06 1.483123e+07 4.033194e+06 1.790649e+07 8.194326e+06 1.465845e+07 3.532755e+06 1.185008e+07 6.842736e+06 4.091693e+06 1.998655e+06 4.966009e+06 1.435657e+06 2.244654e+07 3.682949e+06 2.957179e+06 3.248117e+07 3.024150e+06 3.471376e+06 1.174802e+07 4.267591e+06 2.306303e+06 2.595065e+06 5.391420e+05 2.570215e+06 3.112044e+06 2.428258e+06 6.004283e+06 7.707501e+06 5.513664e+06 1.657011e+06 4.505742e+06 1.665542e+06 8.535338e+06 1.154535e+07 2.634807e+06 2.102925e+06 6.456866e+05 3.297672e+06 8.187684e+06 9.334007e+05 7.919131e+05 1.988103e+06 5.580078e+06 3.022703e+06 5.365452e+05 1.696294e+06 2.267357e+06 4.143090e+06 1.611712e+06 4.805256e+06 4.014277e+06 3.232661e+06 3.974996e+06 2.920140e+06 3.102168e+06 1.599530e+06 4.462864e+06 2.153925e+06 3.582983e+06 3.816870e+06 2.121225e+06 2.697339e+06 9.984523e+05 1.922516e+06 1.770132e+06 7.571323e+06 1.968034e+06 2.142045e+06 4.387624e+06 6.532305e+06 5.939132e+05 5.875525e+06 2.914453e+06 6.935482e+05 1.471858e+06 1.350161e+06 6.800201e+06 2.328669e+06 5.167762e+06 2.431994e+06 6.756046e+06 1.347105e+06 4.929703e+06 8.505243e+06 5.014692e+06 1.106718e+07 4.316503e+06 7.963170e+06 7.428448e+06 1.596674e+06 2.929598e+06 1.585505e+06 4.784557e+06 8.199783e+06 4.115560e+06 5.136646e+06 1.939278e+06 5.515808e+06 3.501902e+06 2.600837e+06 2.288295e+06 5.716576e+06 5.597238e+06 8.560608e+05 4.778676e+06 1.226224e+06 2.752359e+06 8.438159e+05 7.418079e+06 6.558472e+06 5.640929e+06 2.408729e+06 3.943402e+05 1.951191e+07 4.772468e+06 3.576567e+06 1.652084e+06 2.063697e+07 C52 H86 N2 O10_1.893 8.565741e+05 1.152814e+06 1.380554e+06 1.200414e+06 4.015039e+04 8.028729e+05 1.242589e+06 1.334629e+06 33971.31 9.691594e+05 1.267428e+06 1.414394e+06 30420.06 9.578839e+05 1.111800e+06 1.316942e+06 3.767051e+04 1.102913e+06 1.051417e+06 1.306756e+06 6.623462e+04 6.653384e+05 1.251971e+06 1.757551e+06 48424.522 9.780071e+05 1.177730e+06 9.807481e+05 7.219924e+04 1.137543e+06 1.173099e+06 1.439995e+06 62774.38 7.570688e+05 1.405161e+06 1.203945e+06 7.985800e+04 9.453173e+05 1.216074e+06 1.228905e+06 5.978915e+04 8.200876e+05 1.555210e+06 1.478553e+06 2.744727e+04 7.475932e+05 1.278451e+06 1.062321e+06 8.508937e+04 9.491551e+05 7.687202e+04 1.525621e+05 3.323380e+05 2.350489e+06 3.919769e+05 8.308787e+06 6.514540e+06 1.427051e+07 1.799475e+06 3.504521e+06 9.850102e+04 1.018266e+06 7.407188e+04 9.385631e+05 4.047622e+06 7.758079e+04 2.204245e+06 9.223390e+04 4.041102e+06 1.711224e+06 1.409878e+06 1.495317e+06 4.177498e+05 7.420016e+04 1.692760e+06 9.194568e+06 6.092911e+05 2.370060e+05 1.730420e+06 2.191202e+06 1.731446e+06 3.810028e+05 6.214222e+06 8.566054e+04 5.563484e+04 1.391494e+06 2.695206e+05 7.536599e+05 9.404430e+05 4.317065e+05 1.257914e+05 5.081170e+05 4.506591e+06 7.555711e+05 1.537563e+06 1.238515e+05 8.603741e+04 3.512173e+06 2.896307e+05 5.900527e+04 2.147617e+06 2.595754e+06 1.024855e+07 1.370520e+06 1.543521e+05 5.722339e+05 2.041402e+06 3.883039e+05 1.236566e+05 3.204970e+05 2.536839e+06 6.022609e+06 2.167377e+06 9.102491e+05 4.067763e+05 6.153757e+05 1.935066e+05 2.538614e+05 1.748824e+06 1.645040e+06 1.334793e+06 1.585444e+05 3.604491e+05 5.243857e+06 2.473652e+06 2.946621e+05 6.128374e+06 7.847893e+04 2.404165e+06 1.666223e+06 5.985776e+04 4.484482e+05 5.521360e+06 1.793749e+06 8.115752e+05 2.006001e+06 1.153999e+06 1.360049e+06 2.006124e+06 2.953742e+06 8.066590e+05 1.184671e+06 4.154465e+05 2.548209e+06 4.947988e+06 5.012216e+05 1.127286e+07 2.427085e+06 6.319659e+06 4.988167e+05 4.784954e+06 1.905992e+06 6.323169e+05 1.771610e+05 1.374958e+06 6.937250e+04 1.617079e+07 5.922542e+05 5.373966e+05 1.948380e+07 3.569710e+05 8.306154e+05 4.854902e+06 9.627344e+05 3.270858e+05 2.668236e+05 9.643908e+04 2.349449e+05 4.568391e+05 1.576729e+05 1.108955e+06 1.808080e+06 1.922290e+06 7.195621e+04 1.347424e+06 6.212960e+04 2.909453e+06 6.479681e+06 3.199932e+05 2.304916e+05 9.825937e+04 7.147435e+05 2.266774e+06 7.586692e+04 6.261514e+04 1.120204e+05 1.994054e+06 4.562040e+05 6.164266e+04 7.468045e+04 2.328977e+05 5.865704e+05 1.172644e+05 1.652301e+06 7.953362e+05 5.956539e+05 9.113328e+05 4.511789e+05 3.922541e+05 6.442786e+04 8.734978e+05 1.670185e+05 1.017765e+06 6.965806e+05 2.166838e+05 2.997379e+05 6.818554e+04 5.591901e+04 2.134129e+05 2.628194e+06 1.825098e+05 1.097364e+05 7.297631e+05 2.445049e+06 6.491174e+04 1.797336e+06 2.654557e+05 8.916055e+04 2.679786e+05 6.031232e+04 1.642166e+06 2.494676e+05 7.490103e+05 2.340622e+05 1.672080e+06 2.830789e+05 2.150579e+06 3.572731e+06 1.039195e+06 3.759750e+06 8.667453e+05 3.151097e+06 2.335192e+06 9.371654e+04 2.480959e+05 1.487459e+05 6.463411e+05 3.248016e+06 8.934633e+05 1.042410e+06 1.323888e+05 1.388299e+06 3.504295e+05 2.981915e+05 1.444860e+05 1.804381e+06 1.262372e+06 8.860913e+04 1.142211e+06 7.397913e+04 3.216637e+05 6.414258e+04 1.719185e+06 1.238083e+06 1.182098e+06 2.784000e+05 5.543456e+04 1.127138e+07 7.891174e+05 3.469916e+05 1.472197e+05 1.089021e+07 C12 H34 N9 O4 P_1.893 5.635370e+04 9.332683e+05 9.040868e+05 9.789943e+05 7.627516e+04 5.647260e+05 9.261822e+05 9.723729e+05 59339.03 8.318626e+05 9.348476e+05 9.343014e+05 54259.13 8.028570e+05 8.860535e+05 8.836846e+05 6.501229e+04 7.961741e+05 8.584953e+05 8.898224e+05 8.920843e+04 5.594401e+05 1.152844e+06 1.047861e+06 65235.009 9.730638e+05 6.831339e+05 7.265535e+05 9.868865e+04 9.055790e+05 8.597215e+05 1.078298e+06 92617.08 6.202924e+05 9.373728e+05 8.151258e+05 9.205945e+04 8.660781e+05 1.049000e+06 8.906313e+05 7.456237e+04 7.766815e+05 7.864564e+05 1.098383e+06 3.900251e+04 7.469521e+05 9.269201e+05 8.039285e+05 3.675831e+05 5.361182e+05 1.721201e+05 3.301731e+05 1.039749e+05 5.818797e+05 1.922563e+05 1.721011e+05 3.251956e+05 3.251852e+05 1.693562e+05 5.050397e+05 4.452533e+05 1.268732e+05 3.862055e+05 4.011226e+05 2.602414e+05 6.042079e+06 3.405264e+05 1.118643e+05 3.444004e+05 8.720842e+04 3.399051e+05 1.133179e+05 1.255830e+05 1.590053e+05 1.983332e+06 6.550480e+05 1.641770e+06 1.685430e+06 1.409940e+06 2.993084e+06 1.052035e+06 6.399708e+05 9.832254e+05 1.177160e+06 8.811658e+05 4.004009e+06 2.136948e+06 2.874836e+05 1.537936e+06 1.487228e+06 1.030082e+06 2.576925e+06 2.440060e+05 2.444154e+05 2.289207e+05 3.445091e+05 3.526856e+05 8.788391e+04 8.803210e+04 4.539105e+05 1.114380e+05 3.969340e+05 9.023154e+04 3.218884e+05 1.435166e+05 3.063480e+05 1.825934e+05 2.277061e+05 2.511951e+05 1.421896e+05 1.167909e+06 2.753438e+05 3.880883e+05 2.218576e+05 2.603523e+05 1.054206e+05 2.576406e+05 1.241720e+05 2.232009e+05 3.750739e+05 2.491052e+05 1.206867e+05 9.588724e+04 3.513244e+05 1.269942e+05 9.175372e+04 3.338618e+05 2.272448e+05 2.543207e+05 1.624673e+05 4.299006e+05 9.879289e+05 4.583829e+05 6.682687e+05 4.559687e+05 2.905936e+05 7.231572e+05 3.730477e+05 4.012222e+05 5.390530e+05 1.039414e+05 5.633840e+05 5.516876e+05 5.030185e+05 2.214188e+05 3.515010e+05 5.993394e+05 2.635646e+05 4.026000e+05 8.832542e+05 5.448225e+05 1.296926e+06 7.697242e+05 5.259576e+05 1.317233e+05 1.161896e+05 2.605046e+05 3.936955e+05 2.882461e+05 1.585721e+05 1.787173e+05 1.723834e+05 3.623533e+05 6.772815e+05 1.724796e+06 9.180729e+05 3.018350e+05 7.051808e+05 5.065677e+05 5.943588e+05 1.655107e+06 2.601848e+05 4.950875e+05 5.084009e+05 1.143623e+06 1.150750e+06 3.372883e+05 1.924678e+05 3.018242e+05 2.399592e+05 9.271852e+05 2.775311e+06 5.602487e+05 3.791169e+06 3.176528e+05 5.169463e+05 7.787470e+05 3.133758e+05 1.292784e+06 1.183584e+06 3.823321e+06 9.252444e+05 5.951295e+05 2.288125e+05 2.077005e+06 3.837000e+05 1.856431e+06 4.621817e+06 1.570077e+06 3.700659e+06 2.205613e+06 3.160889e+06 3.491014e+05 1.509684e+06 1.848682e+06 7.663573e+05 9.396881e+05 3.538766e+05 2.178268e+06 1.990599e+06 2.048178e+05 4.651891e+05 1.672309e+06 1.584694e+06 1.996565e+05 1.470414e+06 8.134269e+06 9.053678e+05 9.717469e+05 9.352763e+05 1.325867e+06 1.108703e+06 1.411463e+05 8.167186e+05 5.439296e+05 8.776202e+05 3.753296e+05 4.298606e+05 7.612187e+05 4.086089e+05 2.847247e+05 1.531252e+06 1.076646e+06 2.413695e+05 6.589741e+05 1.125311e+06 2.424267e+06 6.124237e+05 4.636330e+05 6.952452e+05 1.297751e+07 5.468381e+05 5.370873e+05 8.830677e+05 1.051539e+06 1.328275e+06 4.351086e+05 4.747023e+05 9.912852e+05 8.074309e+05 1.548121e+06 6.657307e+05 4.269528e+05 7.301735e+05 1.853855e+06 8.805031e+05 1.637020e+06 5.672794e+05 7.086979e+05 2.396552e+05 5.757603e+05 6.305471e+05 C36 H61 O2 P3 S_1.893 2.944247e+04 1.267760e+06 1.374399e+06 1.247869e+06 4.200086e+04 8.720968e+05 1.077814e+06 1.471433e+06 30992.38 1.126738e+06 1.311372e+06 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5.014419e+05 8.457696e+05 2.553021e+05 2.315464e+06 2.018998e+06 1.276437e+05 7.592632e+05 5.757942e+05 6.158311e+05 7.352099e+04 1.103652e+06 2.003754e+06 2.449141e+06 3.834774e+05 2.054027e+05 2.632532e+06 5.876409e+04 6.772555e+04 3.930951e+05 1.889594e+06 C28 H51 O P S_1.894 2.105440e+06 1.965880e+06 2.124892e+06 2.041769e+06 4.655413e+04 1.388479e+06 2.028221e+06 1.835511e+06 43237.64 1.925831e+06 2.178552e+06 2.119291e+06 40983.75 1.635399e+06 1.869174e+06 2.007467e+06 5.876974e+04 1.933505e+06 1.808471e+06 1.743436e+06 9.129487e+04 1.665103e+06 2.162753e+06 1.904270e+06 65213.813 2.223179e+06 1.746648e+06 1.815663e+06 8.497983e+04 2.150260e+06 1.809539e+06 2.029486e+06 69327.21 1.755530e+06 1.867807e+06 1.969723e+06 8.767394e+04 1.923228e+06 2.070084e+06 1.611208e+06 7.001819e+04 1.873796e+06 2.185084e+06 2.093192e+06 3.211249e+04 1.600287e+06 2.025133e+06 1.881207e+06 1.053874e+05 1.936488e+06 8.859651e+05 5.894695e+05 1.052702e+06 3.028838e+06 8.659881e+05 3.856453e+06 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3.298394e+05 7.748570e+05 2.528178e+05 6.461964e+05 2.105483e+05 4.083831e+05 3.307186e+05 C46 H94 N2 O10 P2_1.896 6.936311e+06 6.084248e+06 6.478109e+06 6.474161e+06 5.428989e+04 4.569538e+06 6.431721e+06 6.606737e+06 43875.34 5.753923e+06 6.415834e+06 6.976529e+06 38546.34 5.311469e+06 5.652660e+06 6.202863e+06 2.878855e+05 6.057378e+06 5.702966e+06 6.457982e+06 7.975557e+04 5.304161e+06 6.840069e+06 6.750459e+06 62648.974 5.538240e+06 5.924552e+06 5.708609e+06 8.320289e+04 5.770601e+06 6.744754e+06 7.117248e+06 64484.47 4.845944e+06 6.060733e+06 6.311080e+06 8.013707e+04 5.670859e+06 6.407397e+06 5.979151e+06 6.323679e+04 5.729105e+06 6.329120e+06 7.174431e+06 2.955344e+04 4.730140e+06 6.711575e+06 5.739300e+06 6.379936e+05 5.420402e+06 1.987887e+06 3.403384e+06 3.732135e+06 8.086461e+06 3.775558e+06 1.400304e+07 1.541730e+07 2.287362e+07 7.439675e+06 1.069981e+07 1.936869e+06 7.610103e+06 8.638810e+05 6.092149e+06 1.163663e+07 9.116249e+05 8.429169e+06 8.610395e+05 1.282656e+07 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3.106615e+06 9.484772e+06 2.361350e+06 7.476861e+06 1.073929e+07 5.655074e+06 1.412743e+07 4.434508e+06 9.444811e+06 8.956026e+06 1.290068e+06 3.199360e+06 1.229205e+06 4.688929e+06 1.031911e+07 5.375347e+06 6.110619e+06 3.310206e+06 6.035494e+06 3.887768e+06 3.411486e+06 2.616359e+06 9.426984e+06 6.854541e+06 7.450818e+05 5.403733e+06 1.775382e+06 3.737013e+06 8.510066e+05 7.671654e+06 6.838979e+06 6.730810e+06 3.074637e+06 7.080632e+05 1.797447e+07 5.338204e+06 3.127339e+06 1.712504e+06 1.847085e+07 C10 H5 N2 P_1.897 3.539260e+04 5.580294e+05 8.037273e+05 6.291486e+05 4.966932e+04 4.773908e+05 5.871190e+05 7.263670e+05 38869.58 5.934869e+05 6.501298e+05 6.876453e+05 32419.25 5.276962e+05 6.516266e+05 6.909573e+05 4.137513e+04 5.023258e+05 6.764404e+05 6.506221e+05 6.330007e+04 5.170770e+05 6.943971e+05 7.898829e+05 53020.639 5.189427e+05 5.863027e+05 6.160800e+05 7.761149e+04 5.622860e+05 6.630486e+05 7.177964e+05 60732.93 4.413719e+05 6.686788e+05 7.289759e+05 7.409005e+04 6.582319e+05 5.999415e+05 6.468391e+05 6.417020e+04 5.462732e+05 5.217870e+05 8.788700e+05 2.898017e+04 3.579133e+05 7.836004e+05 5.717313e+05 6.908830e+05 7.384070e+05 4.666705e+05 6.512918e+05 3.215821e+05 5.126466e+05 1.073546e+06 3.779359e+05 6.732322e+05 5.530806e+05 8.570270e+05 5.364279e+05 1.320941e+06 6.620136e+05 1.524564e+06 1.021429e+06 1.006647e+06 8.434306e+05 5.074579e+05 7.570681e+05 7.562845e+05 7.455852e+05 7.898082e+05 6.715868e+05 7.519787e+05 1.263888e+06 1.151422e+06 4.456790e+05 6.877193e+05 4.483414e+05 4.988177e+04 6.960443e+05 4.879620e+05 7.050372e+05 8.452075e+05 8.659432e+05 5.613072e+05 4.118915e+05 3.225626e+05 3.438415e+05 3.651961e+05 6.193833e+05 9.909731e+05 4.505106e+05 1.222809e+06 5.753090e+05 7.882715e+05 5.077630e+05 5.767936e+05 1.703441e+05 1.471208e+05 4.669381e+05 6.160262e+05 5.098486e+05 2.018561e+05 3.260235e+05 6.585212e+05 7.356502e+05 4.641200e+05 7.262403e+05 7.280957e+05 5.490846e+05 5.539499e+05 1.520054e+06 6.064593e+05 4.018107e+05 3.825026e+05 3.309793e+05 6.057290e+05 2.922801e+05 4.121389e+05 6.719019e+05 2.019153e+05 4.782822e+05 3.453150e+05 6.779995e+04 3.695988e+05 3.375916e+05 1.203152e+06 2.353599e+05 3.808494e+05 4.784374e+05 5.902013e+05 7.524059e+04 3.438909e+05 5.215266e+05 2.994529e+05 3.919368e+05 5.292332e+05 4.254662e+05 2.798566e+05 8.098327e+05 3.877848e+05 1.207690e+05 5.219047e+05 5.434371e+05 4.691174e+05 3.058040e+05 1.931218e+05 4.210056e+05 6.523005e+04 1.469253e+06 7.982560e+05 1.099373e+06 5.980731e+05 1.248493e+06 4.724554e+05 6.617366e+05 1.991760e+06 2.368446e+06 1.975930e+06 3.692077e+05 5.089648e+05 8.133589e+05 3.886004e+05 7.425422e+05 1.502597e+06 6.891638e+05 6.372790e+05 9.009589e+05 9.436817e+05 1.253500e+06 5.128215e+05 1.130102e+06 1.199716e+06 9.576635e+05 7.054826e+05 4.628655e+05 7.195306e+05 8.474347e+05 1.222019e+06 7.140391e+05 1.531327e+05 7.199674e+04 4.824461e+05 4.563271e+05 1.187137e+05 5.581450e+05 9.628463e+05 2.541615e+05 9.164028e+05 5.134468e+05 9.064154e+05 6.745351e+04 1.774604e+05 8.407470e+05 1.474797e+05 8.409126e+05 1.445384e+05 7.055857e+04 6.991783e+05 5.535347e+05 1.300310e+06 1.011956e+06 5.931826e+05 6.147258e+05 5.358203e+05 1.243536e+05 8.161274e+05 6.174053e+05 1.077643e+06 1.087021e+06 4.097045e+05 6.928311e+05 4.861471e+05 7.156891e+05 1.367662e+05 6.707995e+05 1.517722e+06 1.174654e+06 8.404150e+05 9.654602e+05 9.153187e+05 4.220562e+05 4.785686e+05 1.404227e+06 1.299640e+06 1.378993e+06 1.891851e+06 4.428559e+05 1.131926e+06 7.518607e+05 1.015821e+06 2.767721e+05 9.537617e+04 5.858063e+05 1.151035e+06 9.366906e+05 7.554746e+05 8.455305e+04 8.362558e+05 3.865962e+05 6.141476e+05 4.336025e+05 3.617416e+05 6.942397e+05 3.398876e+05 1.154358e+06 1.052493e+06 9.955277e+05 4.990238e+05 1.090360e+06 5.835384e+05 6.068931e+05 4.200419e+05 8.096229e+05 1.523549e+06 2.304600e+05 8.702898e+05 4.420017e+05 4.218411e+04 8.337425e+04 8.564915e+05 3.817895e+05 C28 H25 N O2 S2_1.897 9.413596e+04 2.512395e+05 2.210398e+05 1.719247e+05 1.168023e+05 2.098547e+05 1.265876e+05 3.532142e+05 58168.00 1.777845e+05 1.491228e+05 2.535399e+05 40173.80 2.342389e+05 1.994009e+05 2.308590e+05 5.838664e+04 1.860347e+05 1.997666e+05 1.483025e+05 6.624301e+04 2.505713e+05 2.952010e+05 2.325325e+05 53444.635 1.760181e+05 1.710600e+05 2.808356e+05 7.557639e+04 2.023790e+05 1.005231e+05 2.114613e+05 51284.99 2.432916e+05 2.413534e+05 1.411342e+05 5.765340e+04 3.728447e+05 1.357377e+05 1.733265e+05 5.666463e+04 2.873068e+05 1.133045e+05 2.502996e+05 3.369639e+04 2.542709e+05 1.957244e+05 1.534325e+05 1.097187e+05 7.069733e+04 9.976396e+04 7.680051e+04 5.536895e+04 6.322520e+04 7.894061e+04 1.576126e+05 6.581943e+04 6.144044e+04 6.716618e+04 7.894307e+04 8.703501e+04 1.108762e+05 8.671739e+04 7.902799e+04 8.812442e+04 9.876937e+04 6.115078e+04 6.903336e+04 6.966593e+04 7.118508e+04 1.177724e+05 6.218323e+04 1.137694e+05 7.586182e+04 7.461067e+04 6.431043e+04 7.830815e+04 5.464455e+04 5.825636e+04 7.335116e+04 7.312388e+04 6.098358e+04 1.469940e+05 6.882023e+04 5.598044e+04 1.033616e+05 1.022898e+05 6.961378e+04 5.455586e+04 5.599120e+04 7.811408e+04 7.070547e+04 9.447377e+04 8.368560e+04 1.831349e+05 6.736291e+04 7.574255e+04 6.556992e+04 5.552304e+04 1.447429e+06 6.511736e+04 7.087222e+04 7.402052e+04 5.885135e+04 7.093507e+04 6.635461e+04 5.551543e+04 1.552282e+05 7.246078e+04 8.014354e+04 5.528832e+05 9.237946e+04 2.736526e+06 7.068260e+04 7.147369e+04 4.039152e+06 6.034664e+04 6.983696e+04 6.513722e+04 6.437093e+04 8.318722e+04 8.105514e+04 8.055995e+04 5.666118e+04 8.689821e+04 7.214633e+04 1.115850e+05 1.034155e+05 6.213766e+04 6.368491e+04 6.664160e+04 5.854832e+04 1.160342e+05 1.847077e+05 7.349510e+04 4.216707e+05 9.647012e+04 7.087539e+04 1.022954e+06 1.504266e+05 1.136216e+05 9.429446e+04 1.392800e+06 8.254918e+04 1.358614e+05 6.480159e+04 8.656542e+04 6.729140e+04 8.710152e+04 7.320058e+04 7.546334e+04 8.892152e+04 6.774359e+04 2.280550e+06 7.106453e+04 1.938527e+06 1.539301e+06 1.395466e+05 7.214951e+05 1.832788e+05 8.866434e+05 2.873440e+05 1.573403e+06 1.105861e+05 8.175232e+04 7.309764e+04 7.420501e+04 1.117866e+06 1.017115e+05 6.701516e+04 7.590130e+04 7.825437e+04 1.493685e+06 1.776338e+06 1.141707e+05 6.991571e+04 6.520382e+04 6.832666e+04 8.560183e+04 6.510043e+04 1.549574e+05 1.230796e+06 6.021823e+04 9.707283e+04 7.687334e+04 9.682601e+05 1.123366e+05 1.137638e+05 1.436277e+05 4.153083e+05 8.282260e+04 5.790887e+05 4.597911e+05 6.579175e+05 7.117705e+04 3.561396e+05 1.300432e+05 1.028263e+05 2.114239e+05 6.814538e+04 1.063157e+05 8.953906e+04 5.377212e+06 7.033382e+04 1.217004e+05 3.086359e+06 2.114041e+05 4.341940e+06 3.107491e+05 8.207156e+05 7.019946e+04 3.008635e+05 9.637312e+04 1.551163e+06 9.471121e+04 7.462011e+04 1.339455e+05 5.456214e+05 1.192403e+06 7.074938e+04 5.292594e+05 7.187078e+04 7.970533e+05 3.400264e+06 9.437308e+04 8.037655e+05 6.523482e+05 2.029616e+06 2.382513e+05 1.242977e+05 6.752400e+05 1.003849e+05 5.900759e+04 7.024889e+04 8.487206e+04 4.568463e+06 3.068279e+05 1.498634e+05 1.090833e+05 5.456790e+05 6.502749e+04 1.346877e+05 8.325652e+04 1.130427e+05 4.490934e+05 9.856222e+04 1.524047e+05 7.555808e+04 8.857570e+04 8.775393e+04 8.614109e+04 6.180822e+04 2.784100e+05 1.666294e+05 1.567168e+05 6.174417e+04 1.209246e+05 7.408997e+04 4.861941e+04 6.742042e+04 7.634487e+04 8.128174e+04 C14 H38 N9 O3 P_1.899 3.263925e+04 1.287390e+06 1.114808e+06 1.179763e+06 4.594647e+04 1.015413e+06 1.316256e+06 1.460901e+06 36923.27 1.055923e+06 1.149374e+06 1.424355e+06 33956.50 9.419787e+05 1.160039e+06 1.204944e+06 4.419944e+04 1.166548e+06 1.136043e+06 1.420964e+06 6.378957e+04 1.038605e+06 9.837668e+05 1.413446e+06 48068.066 1.409422e+06 1.113904e+06 1.012787e+06 6.831117e+04 1.113947e+06 1.151682e+06 1.357474e+06 51122.65 1.345615e+06 1.039860e+06 9.668872e+05 5.994133e+04 1.236299e+06 1.011838e+06 1.573926e+06 4.445298e+04 1.485751e+06 1.068201e+06 1.134034e+06 2.249168e+04 8.411996e+05 1.156987e+06 1.378899e+06 1.229287e+06 1.151039e+06 6.487327e+05 7.113826e+05 7.200039e+05 1.025616e+06 6.510540e+05 1.599450e+05 7.451863e+05 5.313209e+05 1.028243e+06 1.504898e+06 9.129708e+05 7.793349e+05 1.135113e+06 1.186500e+06 1.369163e+06 1.529425e+06 1.576436e+06 1.030360e+06 8.339688e+05 1.121822e+06 1.220168e+06 1.237496e+06 1.271441e+06 1.065588e+06 9.873471e+05 1.271978e+06 1.437299e+06 1.298601e+06 6.304178e+04 1.135619e+06 1.199588e+06 1.078318e+06 9.384740e+05 1.516200e+06 8.832604e+05 1.090326e+06 6.922112e+05 6.735227e+05 1.116079e+06 1.253544e+06 1.577483e+06 1.362231e+06 1.722821e+06 9.958491e+05 1.364118e+06 1.145622e+06 1.539211e+06 9.463366e+05 1.206570e+06 1.096142e+06 7.281918e+05 1.420607e+06 8.743990e+05 1.249812e+06 1.152553e+06 1.239464e+06 7.685968e+05 1.171328e+06 7.553030e+05 9.436461e+05 1.293128e+06 1.116129e+06 1.522779e+06 1.062162e+06 1.527540e+06 8.554572e+05 1.485556e+06 9.503095e+05 1.351240e+06 1.153655e+06 8.986831e+05 7.247960e+05 4.394615e+05 1.242031e+06 1.193691e+06 1.050555e+06 1.438388e+06 5.083558e+05 1.236272e+06 1.493327e+06 1.394096e+06 7.332121e+04 9.294226e+05 1.282149e+06 1.088962e+06 1.309622e+06 1.466999e+06 1.339063e+06 1.139700e+06 1.243970e+06 3.017381e+05 1.263845e+06 1.721621e+06 3.378076e+05 5.406923e+05 8.639418e+05 8.101134e+05 8.773225e+05 1.025422e+06 1.077571e+06 9.484044e+05 1.429926e+06 9.283781e+05 1.239745e+06 8.923644e+05 1.202816e+06 1.683208e+06 1.784100e+06 2.269325e+06 6.940015e+05 1.303440e+06 1.002377e+06 7.683300e+05 8.579412e+05 1.477897e+06 9.899238e+05 7.238021e+05 5.406215e+05 8.396448e+05 9.894622e+05 9.610212e+05 8.477190e+05 1.002919e+06 8.419682e+05 1.363815e+06 1.519157e+06 9.660031e+05 8.088466e+05 9.605767e+05 1.157931e+06 2.354809e+06 9.715159e+05 1.075965e+06 1.858975e+06 1.486034e+06 1.364919e+06 9.017171e+05 1.301634e+06 1.553400e+06 1.026671e+06 1.375920e+06 1.219438e+06 8.473047e+05 1.342104e+06 2.265038e+06 1.141009e+06 1.407148e+06 1.839278e+06 8.436010e+05 1.355439e+06 1.388748e+06 1.664058e+06 1.021997e+06 9.777286e+05 1.432685e+06 1.225218e+06 1.321922e+06 6.770459e+05 1.353203e+06 1.557209e+06 1.043531e+06 1.002144e+06 9.021494e+05 1.318253e+06 1.464327e+06 1.436661e+06 1.988371e+06 1.559812e+06 1.601924e+06 1.134337e+06 1.357396e+06 1.144373e+06 1.021145e+06 1.101289e+06 2.255888e+06 1.501357e+06 1.509913e+06 1.137954e+06 1.809933e+06 1.412834e+06 1.219557e+06 1.224825e+06 1.052568e+06 1.525742e+06 2.235424e+06 8.221052e+05 1.543416e+06 9.332258e+05 1.188595e+06 9.077706e+05 1.054988e+06 1.601842e+06 2.779150e+06 2.175492e+06 2.415734e+06 2.182093e+06 2.500522e+06 1.877162e+06 2.286121e+06 2.965994e+06 2.562490e+06 8.007177e+05 2.339293e+06 1.178816e+06 3.628534e+06 4.519600e+05 7.303602e+05 6.383469e+05 8.792381e+05 2.262731e+06 1.926752e+06 2.118922e+06 C18 H32 N2 O3_1.899 9.591434e+04 1.279347e+06 1.366403e+06 1.651275e+06 2.827243e+04 1.682570e+06 1.172330e+06 1.572813e+06 32292.62 1.364156e+06 1.225024e+06 1.543239e+06 33028.72 1.444929e+06 1.567455e+06 1.620714e+06 2.732427e+05 1.338911e+06 1.305458e+06 1.528760e+06 7.206002e+04 1.263793e+06 1.573450e+06 1.404271e+06 54593.799 1.454606e+06 1.256692e+06 1.644036e+06 6.988300e+04 1.557339e+06 1.414366e+06 1.754769e+06 55421.16 1.127289e+06 1.068057e+06 1.388552e+06 6.258630e+04 1.498223e+06 1.537813e+06 1.840102e+06 4.623512e+04 1.234442e+06 1.766449e+06 1.665666e+06 4.768453e+04 6.087257e+05 1.315142e+06 1.738668e+06 1.063638e+06 1.542985e+06 7.055580e+05 1.098843e+06 5.633025e+05 9.010145e+05 7.849604e+05 7.816320e+05 1.114144e+06 6.978230e+05 1.250719e+06 1.978966e+06 1.685909e+06 1.488810e+06 1.349708e+06 1.620781e+06 1.818629e+06 2.431266e+06 1.937730e+06 9.490760e+05 1.248446e+06 1.450507e+06 1.783721e+06 1.723778e+06 1.819874e+06 2.168617e+06 1.468979e+06 1.343750e+06 1.577895e+06 1.774266e+06 4.172628e+05 1.909870e+06 1.335586e+06 1.265372e+06 1.092346e+06 1.660078e+06 1.269957e+06 2.018059e+06 1.562824e+06 7.492179e+05 1.539918e+06 1.770392e+06 2.180577e+06 1.496824e+06 1.221744e+06 2.451184e+06 2.099298e+06 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2.629095e+06 9.851073e+06 6.436835e+06 1.745574e+06 4.092543e+06 7.884965e+06 1.529663e+07 4.949637e+06 3.712980e+06 3.777602e+06 3.591032e+07 2.951300e+06 3.233680e+06 5.456347e+06 4.692079e+06 5.285339e+06 2.372650e+06 2.215694e+06 6.395521e+06 5.772585e+06 6.566370e+06 3.635850e+06 2.378885e+06 4.320488e+06 9.644394e+06 3.861536e+06 5.307385e+06 3.492682e+06 5.109003e+06 1.858283e+06 3.086224e+06 3.456516e+06 C10 H23 N O6_1.902 9.863528e+04 5.277271e+05 6.444667e+05 4.618984e+05 8.623506e+04 5.194562e+05 4.919036e+05 7.972348e+05 52131.76 5.866080e+05 6.429610e+05 5.434965e+05 48811.09 5.543605e+05 5.012425e+05 5.322956e+05 2.292483e+05 4.579647e+05 7.399886e+05 5.380953e+05 9.238065e+04 4.901862e+05 6.292513e+05 7.204388e+05 71481.135 5.032861e+05 6.202095e+05 4.978640e+05 1.060518e+05 5.633080e+05 4.335072e+05 5.953659e+05 87955.67 6.164360e+05 6.546848e+05 7.057274e+05 1.041412e+05 4.487635e+05 5.689049e+05 6.700849e+05 9.036096e+04 4.510462e+05 4.463891e+05 7.180980e+05 3.996455e+04 5.461421e+05 5.636078e+05 5.852386e+05 3.835786e+05 3.097566e+05 2.312047e+05 3.424405e+05 1.253860e+05 4.103197e+05 2.631686e+05 1.638955e+06 2.749570e+05 2.521152e+05 1.022255e+06 4.050067e+05 1.599400e+06 2.191089e+05 3.402304e+05 3.053849e+05 4.817851e+05 1.837249e+06 2.587274e+05 2.539669e+05 4.260852e+05 3.334430e+05 4.348828e+05 3.268382e+05 1.479212e+05 2.979663e+05 1.825171e+06 6.154617e+05 1.382045e+06 8.203551e+05 3.234845e+05 2.894939e+06 6.122373e+05 5.127694e+05 6.284969e+05 8.196272e+05 5.721367e+05 2.547334e+06 1.378374e+06 3.596338e+05 8.303673e+05 1.050209e+06 5.964909e+05 2.417101e+06 3.341325e+05 2.673746e+05 1.609491e+05 3.675995e+05 2.517562e+05 1.395709e+05 2.475662e+05 2.649117e+05 1.073150e+05 2.752356e+05 1.548065e+05 3.845877e+05 2.672957e+05 1.876006e+05 2.246191e+05 1.809987e+05 3.903651e+05 1.206158e+05 3.513464e+05 2.948102e+05 3.783901e+05 4.329773e+05 2.368035e+05 1.986936e+05 1.740688e+05 2.374318e+05 3.285301e+05 3.080051e+05 1.268755e+05 1.189748e+05 1.066336e+05 1.930872e+05 1.716644e+05 4.450903e+05 2.846433e+05 1.245385e+06 2.453685e+05 2.712021e+05 3.293299e+05 1.077767e+05 6.510133e+05 5.515453e+05 3.642390e+05 3.056204e+05 3.292920e+05 2.700988e+05 3.241963e+05 5.089276e+05 1.682125e+05 4.698543e+05 3.234948e+05 3.472468e+05 2.721793e+05 4.488450e+05 6.213854e+05 3.868290e+05 3.520306e+05 5.252908e+05 4.746503e+05 1.030213e+06 6.340009e+05 4.322946e+05 2.213983e+05 1.866559e+05 3.938467e+05 2.909521e+05 4.689401e+05 3.772958e+05 1.961976e+05 3.226666e+05 2.619513e+05 5.173641e+05 9.379851e+05 7.832435e+05 2.204976e+05 5.598042e+05 3.320730e+05 5.352312e+05 1.851005e+06 4.758105e+05 4.178841e+05 5.389328e+05 7.916697e+05 6.633459e+05 1.372625e+05 6.290740e+05 2.892909e+05 4.193419e+05 6.388432e+05 2.549277e+06 6.084263e+05 2.359688e+06 4.343604e+05 6.165711e+05 1.172315e+06 3.350251e+05 5.035122e+05 1.919050e+06 2.873420e+06 6.628722e+05 5.094001e+05 4.340761e+05 2.320766e+06 3.127438e+05 1.213502e+06 2.578881e+06 8.271797e+05 2.751253e+06 8.161501e+05 2.866499e+06 4.882261e+05 1.844993e+06 2.427088e+06 6.137159e+05 1.128688e+06 3.596371e+05 2.571330e+06 1.787793e+06 2.394651e+05 5.493172e+05 1.058326e+06 1.753591e+06 3.278118e+05 1.745697e+06 5.782666e+06 3.773277e+05 1.181534e+06 8.097916e+05 9.035728e+05 9.191734e+05 3.039101e+05 5.191269e+05 5.595042e+05 8.065322e+05 7.639657e+05 4.231382e+05 6.612144e+05 4.049875e+05 3.917796e+05 1.076362e+06 7.311677e+05 2.780380e+05 4.366142e+05 9.999557e+05 2.885210e+06 6.632729e+05 4.881807e+05 3.260405e+05 5.661582e+06 4.221976e+05 5.478773e+05 5.245958e+05 7.553212e+05 5.996725e+05 4.645014e+05 2.943782e+05 7.256961e+05 7.487945e+05 7.689737e+05 3.666986e+05 4.486051e+05 6.539914e+05 9.212203e+05 5.839742e+05 5.097927e+05 3.629285e+05 6.960035e+05 4.829669e+05 4.696813e+05 5.270089e+05 C20 H30_1.902 7.747989e+05 2.604542e+05 2.920800e+05 3.233490e+05 5.973776e+04 1.411247e+05 3.128966e+05 2.638352e+05 45136.14 2.399220e+05 2.878306e+05 2.731499e+05 41422.31 2.813813e+05 2.466442e+05 2.769918e+05 5.035212e+04 2.190043e+05 2.979993e+05 2.694704e+05 7.284759e+04 2.110751e+05 2.923567e+05 3.388055e+05 54656.183 1.987331e+05 2.744444e+05 2.277944e+05 7.650534e+04 3.024966e+05 2.695608e+05 3.327722e+05 69477.91 1.671635e+05 3.206627e+05 1.610217e+05 8.397289e+04 3.134780e+05 2.720304e+05 2.913964e+05 5.999117e+04 1.732164e+05 3.220691e+05 3.655172e+05 2.955313e+04 1.882511e+05 2.633053e+05 2.509835e+05 5.667410e+05 6.503916e+04 7.196675e+04 9.447702e+04 1.176199e+05 1.410214e+05 5.767959e+05 1.302668e+05 9.188603e+04 6.802739e+04 1.965200e+05 1.402541e+05 1.258882e+06 2.538506e+06 4.462582e+05 1.629463e+06 1.293386e+05 7.300398e+04 1.459616e+05 9.702987e+04 7.634497e+04 7.269671e+04 1.414727e+06 1.191581e+05 7.744746e+04 2.057316e+06 7.230970e+05 1.002132e+05 8.599307e+04 2.276602e+05 3.590418e+05 1.722863e+05 1.509357e+05 3.161797e+05 1.381563e+05 1.233984e+05 7.647394e+04 8.575933e+04 1.320863e+06 4.674377e+05 1.355859e+05 6.840497e+04 1.341354e+06 5.961925e+04 2.360222e+05 7.283949e+04 1.094196e+05 1.888298e+05 8.605760e+04 6.370241e+04 2.149715e+05 1.278295e+05 1.199478e+05 2.925870e+05 7.664931e+04 8.332780e+04 1.260387e+05 1.453441e+05 7.387246e+04 4.419002e+05 8.560067e+05 8.406981e+04 2.492459e+05 5.112186e+05 2.714649e+05 4.570543e+05 5.861797e+05 5.425236e+05 8.284494e+04 1.122784e+05 7.720745e+04 2.353870e+05 7.795179e+04 1.246038e+05 7.404818e+04 2.066832e+05 1.088611e+05 8.235653e+04 1.544699e+05 7.635604e+04 1.190827e+05 2.531050e+05 6.749980e+04 8.632168e+04 6.465060e+04 1.969549e+05 1.346728e+05 2.562167e+05 2.737543e+05 3.764555e+05 6.558717e+04 6.909573e+04 7.715087e+04 7.611604e+04 4.360344e+05 2.783060e+05 4.149641e+05 2.481304e+05 8.411356e+04 7.690182e+04 6.282734e+04 1.078048e+05 1.402413e+06 7.543367e+05 1.682211e+05 1.012450e+06 7.130523e+04 7.650801e+04 2.077442e+05 1.072401e+05 7.293627e+05 2.919992e+05 8.264520e+04 4.089712e+05 5.834372e+04 7.912272e+04 3.661901e+05 2.054943e+05 1.001503e+05 5.272159e+05 2.100428e+05 8.392964e+05 2.665121e+05 1.999687e+05 1.478447e+05 7.400439e+05 2.413032e+05 3.812281e+05 4.393817e+05 7.728965e+05 4.021616e+05 7.937824e+04 1.861859e+05 3.683791e+05 7.614981e+04 4.443207e+05 7.771522e+04 8.768440e+04 2.170042e+05 1.830091e+05 8.888693e+05 9.556951e+04 2.515453e+06 4.870208e+05 8.794120e+04 9.455680e+04 1.156072e+05 6.730543e+04 7.077904e+04 1.265767e+05 1.011444e+05 7.368927e+04 2.094910e+05 1.812380e+05 9.713241e+04 7.414852e+04 9.446480e+04 6.634646e+04 7.537375e+04 1.349028e+05 1.547802e+05 3.149866e+05 7.691831e+04 6.979508e+04 3.083035e+05 8.303426e+04 5.964572e+04 8.526309e+04 1.014067e+05 8.777981e+04 1.409139e+05 7.621590e+05 8.042406e+04 6.542974e+04 3.191924e+05 5.385923e+05 7.444434e+05 1.306178e+05 5.255212e+05 1.149220e+05 9.729174e+04 1.885760e+05 1.368640e+05 1.647364e+05 1.883778e+05 3.218143e+05 8.524289e+04 5.277903e+05 1.601477e+05 3.381858e+06 1.445952e+05 5.625049e+04 7.057177e+04 8.874851e+05 7.964814e+04 1.323279e+06 8.737081e+04 7.551281e+04 9.186484e+04 8.451098e+05 4.927926e+05 2.262233e+05 6.334565e+04 3.912667e+06 6.977543e+04 7.072163e+04 2.102768e+06 8.545976e+04 2.069611e+06 1.083080e+06 5.906349e+04 8.038428e+04 8.737014e+04 8.608971e+04 C37 H81 N10 O4 P3_1.903 3.231470e+04 1.285397e+06 9.431545e+05 1.304823e+06 4.455146e+04 1.079235e+06 1.164797e+06 1.362274e+06 36791.07 9.903594e+05 1.063427e+06 1.455793e+06 33791.34 9.338810e+05 1.252908e+06 1.113301e+06 3.992928e+04 1.134430e+06 1.159639e+06 1.318571e+06 5.819738e+04 1.013361e+06 8.294262e+05 1.383451e+06 44578.498 1.467441e+06 1.236492e+06 9.991226e+05 6.630656e+04 9.536919e+05 8.282721e+05 1.472267e+06 49430.94 1.288111e+06 1.220528e+06 9.497735e+05 6.086485e+04 1.190697e+06 1.172176e+06 1.053955e+06 4.913718e+04 1.377109e+06 1.283540e+06 1.250254e+06 2.305287e+04 7.159647e+05 1.197597e+06 1.271673e+06 1.369060e+06 1.117793e+06 6.478983e+05 8.728336e+05 7.653515e+05 1.014626e+06 5.997571e+05 1.628496e+05 7.056248e+05 3.945459e+05 9.996733e+05 1.412403e+06 9.589361e+05 5.880959e+05 1.085244e+06 1.352117e+06 1.683491e+06 1.277237e+06 1.422426e+06 9.734250e+05 7.881637e+05 1.089969e+06 1.242275e+06 1.081197e+06 1.287118e+06 1.110075e+06 1.092168e+06 1.276206e+06 1.285525e+06 1.239552e+06 6.361178e+04 1.377307e+06 1.310144e+06 1.019908e+06 1.042784e+06 1.582104e+06 8.906232e+05 1.074242e+06 5.732619e+05 6.706629e+05 1.101640e+06 1.206002e+06 1.517854e+06 1.338123e+06 1.398325e+06 1.070463e+06 1.443055e+06 1.084968e+06 1.944550e+06 9.901310e+05 1.182126e+06 9.620921e+05 5.544344e+05 1.293624e+06 8.814366e+05 1.341890e+06 1.179690e+06 1.502123e+06 8.048927e+05 1.108707e+06 7.859156e+05 9.483670e+05 1.216099e+06 1.390990e+06 1.583646e+06 1.271384e+06 1.529056e+06 9.284061e+05 1.520030e+06 1.148406e+06 1.226826e+06 1.165903e+06 1.020317e+06 8.460974e+05 6.164230e+05 1.501566e+06 1.346851e+06 1.046471e+06 1.557413e+06 5.736257e+05 1.324322e+06 1.519154e+06 1.291490e+06 2.604494e+05 1.027021e+06 1.375760e+06 1.242278e+06 1.304327e+06 1.590055e+06 1.375617e+06 1.050483e+06 1.265361e+06 3.443590e+05 1.777161e+06 1.700473e+06 3.574069e+05 5.950886e+05 9.375657e+05 7.827422e+05 8.468852e+05 9.887311e+05 1.040002e+06 8.234411e+05 1.421348e+06 7.309926e+05 1.177305e+06 8.101789e+05 1.229973e+06 1.690630e+06 1.745053e+06 1.494577e+06 7.323757e+05 1.451935e+06 1.052112e+06 6.432506e+05 7.855795e+05 1.328315e+06 9.282988e+05 7.863926e+05 7.058512e+05 2.177441e+06 9.630383e+05 1.022369e+06 1.023145e+06 1.207976e+06 8.279809e+05 1.471110e+06 1.427861e+06 8.616906e+05 9.381421e+05 1.036112e+06 1.155387e+06 3.038943e+06 9.519187e+05 1.016077e+06 2.072616e+06 1.753922e+06 1.356466e+06 8.803596e+05 1.294174e+06 1.739216e+06 1.201106e+06 1.531563e+06 1.264361e+06 7.354467e+05 1.444146e+06 2.024593e+06 1.203012e+06 1.596938e+06 1.753713e+06 8.552842e+05 1.455497e+06 1.566829e+06 1.555649e+06 8.357884e+05 9.184260e+05 1.267657e+06 9.949243e+05 1.339372e+06 8.168741e+05 1.223603e+06 2.250266e+06 1.018145e+06 9.715889e+05 9.226502e+05 1.511051e+06 1.049135e+06 1.271375e+06 1.990627e+06 1.335665e+06 1.655741e+06 1.211921e+06 1.501415e+06 1.084605e+06 1.035659e+06 1.713026e+06 1.999450e+06 1.170939e+06 1.803428e+06 2.399913e+06 1.837132e+06 1.528363e+06 1.245885e+06 1.281133e+06 1.072049e+06 1.495300e+06 1.940464e+06 8.773783e+05 1.571659e+06 1.023552e+06 1.237084e+06 8.778007e+05 1.069043e+06 1.974140e+06 2.934948e+06 2.128677e+06 2.072850e+06 2.628776e+06 2.605406e+06 2.045290e+06 2.278490e+06 2.646256e+06 2.195018e+06 8.048293e+05 2.605766e+06 1.261711e+06 3.776960e+06 4.446258e+05 7.258591e+05 9.874333e+05 7.917159e+05 2.503963e+06 1.486234e+06 1.694520e+06 C12 H18 O4_1.903 6.050603e+04 2.170436e+06 2.004359e+06 1.956734e+06 4.975956e+04 1.261601e+06 1.921531e+06 2.157331e+06 38768.49 1.743591e+06 2.167732e+06 1.959094e+06 37502.06 1.879356e+06 1.622986e+06 2.082606e+06 6.907973e+04 1.812057e+06 1.896580e+06 2.020747e+06 7.456848e+04 1.508640e+06 1.956742e+06 2.224524e+06 52304.542 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8.642054e+05 7.757740e+05 2.936575e+06 4.882387e+06 1.503695e+06 1.272920e+06 C22 H53 N7 O9_1.903 5.803678e+04 1.734234e+05 1.979507e+05 2.685369e+05 5.611829e+04 3.891258e+05 1.949222e+05 2.605106e+05 49390.84 2.145029e+05 1.858200e+05 2.191610e+05 47001.30 1.908402e+05 2.260849e+05 2.416536e+05 5.465296e+04 2.004362e+05 1.574779e+05 2.835503e+05 7.901462e+04 1.744789e+05 2.026335e+05 2.769459e+05 61896.598 1.943797e+05 9.036040e+04 1.949600e+05 1.004736e+05 2.200086e+05 2.027488e+05 1.639503e+05 92080.27 2.301133e+05 2.108267e+05 1.782403e+05 9.645131e+04 2.712920e+05 2.464061e+05 1.923875e+05 7.446811e+04 1.864140e+05 2.536396e+05 2.725891e+05 3.467860e+04 1.188609e+05 1.813337e+05 2.539327e+05 3.113790e+05 7.623822e+04 2.561500e+05 1.061866e+05 2.057508e+05 1.113817e+05 1.777357e+05 1.218685e+05 1.648133e+05 1.577042e+05 1.834000e+05 1.171101e+05 3.449536e+05 1.113625e+05 1.826711e+05 2.258718e+05 1.418735e+05 1.098324e+05 2.180965e+05 1.214504e+05 1.026558e+05 2.168631e+05 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2.102677e+05 2.374604e+05 1.533673e+05 1.617711e+05 1.273010e+05 1.011655e+05 8.418741e+04 2.481450e+05 2.671656e+05 2.235373e+05 1.711140e+05 1.723863e+05 2.793041e+05 2.043429e+05 1.642116e+05 7.414813e+04 6.583310e+05 1.805120e+05 1.180255e+05 1.690374e+05 1.295034e+05 1.039072e+05 1.627467e+05 1.236819e+05 2.445035e+05 3.952518e+05 2.005600e+05 1.605458e+05 1.873749e+05 1.322787e+05 4.329337e+05 1.057496e+05 7.950744e+04 1.125403e+05 5.594480e+04 1.954996e+05 2.180165e+05 1.892855e+05 C9 H14 O2_1.903 8.052677e+04 4.516411e+06 3.510406e+06 2.567469e+06 1.358741e+05 3.253499e+06 5.124893e+06 2.877091e+06 56618.96 2.641514e+06 3.180653e+06 5.506508e+06 101997.51 4.257257e+06 2.661404e+06 2.511640e+06 2.972996e+05 4.279819e+06 2.586228e+06 4.274305e+06 9.140509e+04 2.381160e+06 5.182546e+06 3.793277e+06 67856.586 3.747670e+06 4.138814e+06 2.490361e+06 2.390452e+05 2.719359e+06 3.507313e+06 4.641199e+06 144879.05 4.153789e+06 3.089336e+06 3.440859e+06 2.331930e+05 3.044519e+06 3.814092e+06 3.505378e+06 1.199686e+05 2.974473e+06 3.233842e+06 6.708960e+06 3.457935e+04 1.810739e+06 3.930129e+06 3.053966e+06 3.107523e+06 5.849280e+06 1.744558e+06 6.682096e+06 5.107574e+06 2.700474e+06 2.981336e+06 2.178487e+06 3.089393e+06 2.679700e+06 7.835908e+06 5.595410e+06 8.687769e+06 4.644959e+06 4.318055e+06 9.361929e+06 4.559787e+06 3.755246e+06 4.810524e+06 7.020834e+06 5.718962e+06 4.751496e+06 5.985656e+06 4.587981e+06 4.459216e+06 5.440560e+06 2.261555e+06 3.209126e+06 4.265163e+06 2.819595e+06 4.788509e+05 2.872323e+06 4.047856e+06 2.726358e+06 4.320174e+06 4.202068e+06 3.566301e+06 3.660134e+06 1.045538e+06 2.804600e+06 2.165865e+06 1.831254e+06 5.155865e+06 3.064796e+06 2.652376e+06 4.357587e+06 4.352305e+06 4.068981e+06 6.989070e+06 1.536352e+06 4.693704e+06 3.825657e+06 3.367693e+06 5.327135e+06 8.573888e+05 4.905115e+06 6.176881e+06 3.135365e+06 4.324698e+06 3.204938e+06 4.161655e+06 1.510261e+06 3.563831e+06 2.802028e+06 4.553936e+06 2.986091e+06 2.624221e+06 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1.916250e+06 4.139373e+06 1.973524e+07 1.682297e+06 1.168221e+07 1.254957e+07 2.643030e+06 6.978629e+06 1.189939e+07 7.092180e+06 2.395607e+06 3.423937e+06 3.997499e+06 1.867625e+06 3.390173e+06 2.296586e+06 3.430579e+06 2.549104e+06 1.984078e+06 2.376901e+06 1.904276e+06 2.698689e+06 1.630630e+06 2.919838e+06 8.538845e+06 5.189750e+06 5.465192e+06 1.669545e+06 5.524744e+06 3.540700e+06 1.449343e+06 3.886199e+06 3.433064e+06 6.123662e+06 2.868603e+06 3.564933e+06 3.351181e+06 3.175318e+06 2.152011e+06 5.263106e+06 3.274087e+06 2.135546e+06 3.203950e+06 2.394645e+06 2.975115e+06 2.794146e+06 3.445563e+06 1.675556e+06 2.153402e+06 3.447614e+06 6.230717e+06 6.768071e+06 6.015067e+06 2.299128e+06 3.837064e+06 6.791006e+06 4.327258e+06 5.029274e+06 4.442535e+06 4.450956e+06 3.476239e+06 3.506219e+06 6.812240e+06 1.131125e+06 1.249552e+06 2.002876e+06 1.758519e+06 7.170862e+06 5.733157e+06 3.318687e+06 C31 H59 N5 O9_1.903 4.924817e+04 1.901502e+06 2.076205e+06 1.660669e+06 5.690248e+04 1.290129e+06 1.839121e+06 2.004628e+06 43857.82 1.744903e+06 1.860437e+06 1.879997e+06 42153.84 1.686480e+06 1.823227e+06 1.782632e+06 5.384441e+04 1.677354e+06 1.870972e+06 1.672723e+06 8.135796e+04 1.458175e+06 1.985373e+06 2.144152e+06 60039.731 1.728790e+06 1.830048e+06 1.561213e+06 8.441946e+04 1.740233e+06 1.834406e+06 2.008125e+06 70333.60 1.647112e+06 1.675275e+06 1.755363e+06 7.791941e+04 1.704407e+06 1.778163e+06 1.919033e+06 5.843067e+04 1.952628e+06 1.760679e+06 1.985696e+06 2.764730e+04 1.400099e+06 1.944636e+06 1.716270e+06 1.782115e+06 1.525805e+06 7.283508e+05 1.078085e+06 7.801519e+05 1.392739e+06 1.109325e+06 1.887811e+06 1.122136e+06 1.073322e+06 1.312405e+06 2.288748e+06 1.600858e+06 1.226677e+06 1.472216e+06 1.506390e+06 1.224436e+06 1.956206e+06 2.182510e+06 1.032373e+06 1.072365e+06 1.388224e+06 1.553576e+06 1.570201e+06 1.680861e+06 1.696419e+06 1.401326e+06 1.818633e+06 1.987347e+06 1.995160e+06 4.344340e+05 1.620322e+06 1.603523e+06 1.677497e+06 1.210813e+06 1.913426e+06 1.220346e+06 1.699459e+06 1.099436e+06 7.680771e+05 1.267110e+06 1.702321e+06 1.941160e+06 1.759121e+06 2.144090e+06 1.361667e+06 1.678187e+06 1.644504e+06 2.074609e+06 1.390176e+06 1.652326e+06 1.370666e+06 1.272508e+06 2.028770e+06 1.201174e+06 1.544095e+06 1.672514e+06 1.686607e+06 1.114290e+06 1.745644e+06 1.042404e+06 1.271828e+06 1.734595e+06 2.545317e+06 2.034194e+06 1.893536e+06 2.090845e+06 1.296882e+06 2.423465e+06 1.665281e+06 1.541565e+06 1.657173e+06 9.164419e+05 1.061414e+06 9.236687e+05 1.961851e+06 1.609483e+06 1.428984e+06 3.014259e+06 8.578385e+05 1.710811e+06 2.016679e+06 1.670728e+06 1.416817e+05 1.524572e+06 1.992337e+06 1.358654e+06 1.845644e+06 1.859463e+06 2.434441e+06 1.452686e+06 2.262205e+06 4.622394e+05 2.981148e+06 2.614049e+06 2.943038e+05 8.629967e+05 9.932159e+05 1.118614e+06 1.047121e+06 1.248658e+06 1.560102e+06 1.136543e+06 1.695661e+06 1.184873e+06 1.743219e+06 1.328914e+06 1.705118e+06 2.507977e+06 2.751085e+06 3.269492e+06 1.740295e+06 1.870021e+06 1.782803e+06 1.445937e+06 1.275164e+06 2.194777e+06 1.342595e+06 1.007629e+06 1.182763e+06 1.352410e+06 1.360986e+06 1.377356e+06 1.503309e+06 1.605934e+06 1.320414e+06 1.867639e+06 1.961849e+06 1.186406e+06 1.008571e+06 1.352082e+06 1.253839e+06 2.605692e+06 1.839085e+06 1.844501e+06 2.737625e+06 2.103399e+06 1.806220e+06 1.729583e+06 1.654682e+06 2.263479e+06 1.536012e+06 2.256364e+06 2.197818e+06 1.198669e+06 2.185090e+06 3.363624e+06 1.492492e+06 2.507713e+06 2.241406e+06 1.286572e+06 2.311491e+06 2.490476e+06 3.020322e+06 1.714893e+06 1.276178e+06 1.829682e+06 1.571420e+06 2.077066e+06 1.266463e+06 2.725954e+06 2.223168e+06 1.670822e+06 1.469903e+06 1.397124e+06 1.819533e+06 2.014167e+06 2.271167e+06 2.676538e+06 2.613821e+06 2.542442e+06 1.834658e+06 2.018200e+06 1.585557e+06 1.341787e+06 1.760962e+06 3.257536e+06 2.484881e+06 2.695243e+06 3.041684e+06 2.482144e+06 1.974993e+06 2.455364e+06 1.966060e+06 1.548849e+06 2.166282e+06 2.416529e+06 1.645794e+06 2.000706e+06 1.653880e+06 1.797279e+06 1.707932e+06 2.069138e+06 3.295669e+06 3.394793e+06 3.321075e+06 2.672788e+06 3.057280e+06 4.065886e+06 3.052559e+06 2.328328e+06 4.767682e+06 3.561738e+06 9.402077e+05 3.468370e+06 1.780415e+06 5.921595e+06 8.788850e+05 8.421291e+05 7.805334e+05 1.272169e+06 3.508057e+06 2.388962e+06 3.745691e+06 C8 H9 N O2 S_1.904 7.307893e+04 1.334601e+06 1.384435e+06 1.475506e+06 5.684369e+04 6.477725e+05 1.387821e+06 1.406908e+06 38226.53 1.278359e+06 1.366798e+06 1.349594e+06 35443.60 1.273533e+06 1.120728e+06 1.346133e+06 4.488876e+04 1.200143e+06 1.237164e+06 1.421783e+06 6.760914e+04 1.008640e+06 1.402910e+06 1.587154e+06 52647.221 1.061373e+06 1.295035e+06 1.257623e+06 7.635549e+04 1.231080e+06 1.284294e+06 1.406019e+06 66191.46 1.025089e+06 1.460939e+06 1.268204e+06 7.605741e+04 1.110259e+06 1.439017e+06 1.255602e+06 5.808586e+04 1.111498e+06 1.313687e+06 1.626416e+06 2.526063e+04 1.073101e+06 1.342550e+06 1.167686e+06 1.287181e+06 1.446320e+06 9.727335e+05 1.210728e+06 8.015061e+05 1.179422e+06 2.060773e+06 8.096284e+05 1.669709e+06 1.224345e+06 1.674123e+06 1.246986e+06 2.131069e+06 1.231520e+06 2.962951e+06 1.659393e+06 1.735043e+06 1.579754e+06 1.139796e+06 1.351644e+06 1.718569e+06 1.723301e+06 1.760287e+06 1.571965e+06 1.794881e+06 2.828299e+06 1.924895e+06 8.463255e+05 1.709235e+06 1.039242e+06 5.021800e+04 1.106121e+06 9.005994e+05 1.915185e+06 1.501488e+06 1.829187e+06 1.334173e+06 9.721631e+05 7.196651e+05 6.477727e+05 7.307243e+05 1.119328e+06 2.002938e+06 9.461929e+05 2.718161e+06 1.178982e+06 1.545625e+06 1.120700e+06 1.197590e+06 4.825877e+05 5.158553e+05 1.109736e+06 1.094487e+06 1.082586e+06 3.911694e+05 7.262063e+05 1.473411e+06 1.348255e+06 9.566728e+05 1.504616e+06 1.376717e+06 9.257488e+05 1.414605e+06 3.346138e+06 1.364883e+06 7.200489e+05 7.982844e+05 6.474644e+05 1.401016e+06 6.052334e+05 8.817988e+05 1.101993e+06 3.666947e+05 1.007742e+06 6.289819e+05 5.812101e+04 7.734782e+05 6.446988e+05 2.185045e+06 5.876652e+05 8.760644e+05 1.054350e+06 1.078438e+06 7.812010e+04 8.532245e+05 8.698137e+05 6.711219e+05 9.075561e+05 1.037540e+06 9.180009e+05 6.565905e+05 1.858077e+06 6.643502e+05 1.295394e+05 1.146184e+06 1.033948e+06 8.930453e+05 6.776613e+05 3.281897e+05 7.625498e+05 5.209336e+04 3.146736e+06 1.964892e+06 2.377811e+06 1.417258e+06 2.614663e+06 9.690565e+05 1.393066e+06 4.620274e+06 4.758477e+06 3.879137e+06 7.143083e+05 1.079620e+06 2.158469e+06 1.010840e+06 1.353562e+06 2.986341e+06 1.527532e+06 1.358464e+06 1.520246e+06 2.301172e+06 2.036859e+06 1.072932e+06 2.817565e+06 2.079978e+06 1.936096e+06 1.474517e+06 8.137297e+05 1.662328e+06 1.687770e+06 3.077030e+06 1.570908e+06 1.008663e+05 2.191241e+05 1.093185e+06 1.041401e+06 2.568106e+05 1.061651e+06 2.141082e+06 7.927533e+05 1.890533e+06 8.782679e+05 1.852151e+06 2.055928e+05 6.458740e+05 1.850838e+06 2.072860e+05 1.614452e+06 2.631125e+05 1.972368e+05 1.350204e+06 1.168683e+06 2.495858e+06 2.107046e+06 1.165974e+06 1.275273e+06 1.087568e+06 3.304850e+05 1.361624e+06 1.450611e+06 2.279885e+06 2.701780e+06 9.097849e+05 1.249103e+06 1.118390e+06 1.334965e+06 3.774465e+05 1.593752e+06 3.445568e+06 3.213801e+06 1.650789e+06 1.968441e+06 2.121132e+06 7.675665e+05 9.610587e+05 2.673732e+06 2.732519e+06 2.510579e+06 3.396333e+06 9.477179e+05 2.249312e+06 1.452430e+06 2.074542e+06 3.570761e+05 4.845346e+05 1.291347e+06 2.465937e+06 1.712301e+06 1.499839e+06 2.517521e+05 1.548691e+06 8.985821e+05 1.303636e+06 9.782911e+05 9.305633e+05 1.601744e+06 8.197072e+05 2.107045e+06 1.771601e+06 2.031770e+06 1.000231e+06 2.542704e+06 1.285324e+06 1.279089e+06 7.781141e+05 1.569111e+06 2.500973e+06 6.385102e+05 1.766622e+06 8.651281e+05 7.343429e+04 7.419193e+04 1.499280e+06 7.853128e+05 (+)-Retronecine_1.904 1.834438e+06 1.164723e+06 9.805720e+05 9.327082e+05 5.714170e+04 1.393439e+06 1.246800e+06 1.304594e+06 43444.62 1.188508e+06 1.179611e+06 1.328670e+06 42243.79 7.983901e+05 1.080509e+06 1.223455e+06 5.778417e+04 1.085204e+06 1.167916e+06 1.396612e+06 6.652992e+04 9.597729e+05 1.131533e+06 1.588640e+06 54488.806 9.024280e+05 1.156351e+06 9.443229e+05 8.547722e+04 1.098848e+06 1.227441e+06 1.529483e+06 75573.06 7.648937e+05 1.427397e+06 1.026062e+06 9.185980e+04 9.103295e+05 1.250817e+06 1.205323e+06 7.014100e+04 1.225893e+06 1.373144e+06 1.156611e+06 3.078589e+04 7.040282e+05 1.300038e+06 1.205743e+06 3.080490e+05 1.584765e+06 1.001359e+06 1.819154e+06 6.532560e+05 5.230220e+05 4.207449e+06 2.497438e+06 2.791695e+06 1.640103e+05 1.590962e+06 2.435743e+06 2.416148e+07 5.977856e+05 9.015995e+05 5.229530e+06 9.497000e+05 1.235577e+06 8.014802e+05 1.564126e+06 1.914462e+06 1.172904e+06 9.264895e+05 1.238300e+06 3.568137e+06 8.978267e+05 2.885724e+05 2.472515e+05 8.555465e+05 3.536880e+05 7.377912e+06 3.151079e+05 2.073723e+05 5.810174e+05 2.633487e+06 6.253001e+05 2.954017e+06 5.070789e+06 2.864582e+05 7.516369e+04 5.560276e+05 8.406166e+05 1.425776e+06 2.962300e+05 4.660856e+06 1.602351e+05 1.052427e+06 8.388300e+05 1.045347e+06 5.997886e+06 1.537094e+06 9.755539e+04 1.159319e+06 1.291879e+05 8.185412e+05 1.264058e+05 1.774180e+06 2.534002e+06 8.642211e+05 1.868623e+06 5.142398e+05 2.984748e+05 1.095816e+06 1.099406e+06 1.300101e+06 1.955979e+06 1.101662e+06 1.891496e+06 8.096432e+05 6.658221e+05 1.197312e+06 4.864791e+05 6.151628e+05 1.453477e+07 3.582346e+05 2.213153e+05 8.336181e+04 1.935689e+06 1.608917e+06 1.367156e+06 4.647869e+05 1.059711e+06 1.439015e+06 5.354512e+06 8.997015e+04 1.365183e+05 2.614838e+05 7.886307e+04 8.169503e+04 8.614011e+05 3.152190e+05 8.520520e+05 6.815390e+05 1.432852e+06 9.596846e+05 8.926308e+04 1.780189e+05 8.015423e+04 5.552420e+05 6.471143e+05 1.537557e+05 9.578030e+05 6.669255e+05 1.048849e+06 5.637439e+05 2.253125e+07 8.159801e+05 1.691246e+06 1.110122e+06 1.331293e+06 1.296747e+06 7.859137e+05 9.958472e+05 1.032089e+06 9.801871e+05 5.117450e+05 3.355505e+06 4.982197e+06 1.579786e+06 3.745128e+05 8.351223e+05 4.384314e+05 1.074780e+06 8.520405e+04 1.163404e+06 3.652203e+05 7.830886e+05 3.242147e+05 6.637494e+05 6.992859e+05 9.200896e+05 9.334736e+05 1.485037e+07 8.031708e+06 2.365061e+05 1.223679e+05 1.809099e+05 1.683161e+05 1.158742e+06 8.562871e+05 7.376744e+05 1.647794e+05 1.187080e+06 1.809739e+05 3.678385e+05 3.081876e+05 7.091648e+05 2.007901e+06 1.312101e+05 2.630624e+05 6.744128e+05 5.875880e+05 7.724046e+05 5.730277e+05 2.185250e+05 2.229298e+05 2.750585e+05 3.132735e+05 2.270583e+05 2.668379e+06 4.287303e+05 2.840829e+05 2.473843e+05 2.140167e+05 2.296444e+06 3.519275e+06 1.500724e+05 1.928145e+05 8.607338e+05 4.596967e+05 1.901257e+06 1.601398e+05 1.923872e+05 2.356260e+05 1.048871e+06 1.661016e+05 2.552088e+05 3.421940e+05 6.869912e+05 2.811977e+05 1.502865e+06 1.272432e+06 2.024602e+05 3.886942e+05 9.820237e+04 5.000940e+05 1.437151e+05 5.396790e+05 1.382302e+05 2.309152e+05 1.326122e+06 3.570334e+05 1.156004e+06 3.673993e+05 1.125143e+06 1.187475e+07 2.911007e+05 3.977492e+05 1.532071e+06 1.465398e+06 2.781518e+06 2.868705e+06 9.842083e+05 2.386422e+05 8.064861e+05 9.979812e+05 2.555906e+06 1.163713e+05 5.227987e+05 1.478986e+05 2.432112e+05 1.558887e+06 1.353726e+06 9.828074e+05 C5 H18 N5 O2 P_1.905 3.549595e+04 1.581470e+05 1.855675e+05 7.643263e+04 4.615370e+04 7.848981e+04 1.686624e+05 1.556410e+05 34062.13 1.366774e+05 1.038155e+05 1.569329e+05 26532.41 1.301152e+05 1.372554e+05 1.262825e+05 3.157080e+04 1.325522e+05 1.436591e+05 1.457500e+05 4.783254e+04 8.885211e+04 1.874164e+05 1.520161e+05 37740.529 1.278275e+05 7.641930e+04 1.241308e+05 6.348807e+04 1.475349e+05 1.432306e+05 1.548370e+05 52653.36 1.409387e+05 1.803616e+05 9.900248e+04 7.123705e+04 7.781321e+04 1.304971e+05 1.324343e+05 4.680653e+04 1.123836e+05 1.954547e+05 2.065489e+05 2.307512e+04 8.658878e+04 9.380047e+04 1.289802e+05 1.697264e+05 6.747736e+04 1.449268e+05 7.300075e+04 1.181699e+05 7.180317e+04 7.354364e+04 1.314924e+05 6.205269e+04 6.563442e+04 7.956740e+04 1.423051e+05 9.085295e+04 8.320135e+04 7.862455e+04 2.235734e+05 1.377648e+05 1.388134e+05 5.792649e+04 9.408397e+04 6.464890e+04 1.245802e+05 2.783062e+05 1.583020e+05 2.528257e+05 2.273570e+05 1.066334e+05 5.290247e+04 5.570423e+04 5.775386e+04 3.859740e+04 1.290176e+05 4.329421e+04 1.267330e+05 1.009280e+05 4.520689e+04 6.602795e+04 9.110816e+04 1.317502e+05 6.906134e+04 4.220406e+04 1.012544e+05 8.596068e+04 6.490288e+04 1.149713e+05 9.848640e+04 7.427780e+04 5.714728e+04 1.261165e+05 5.407849e+04 6.944053e+04 4.133321e+04 6.600415e+04 9.728395e+04 6.123818e+04 8.959860e+04 1.731158e+05 6.079004e+04 8.708275e+04 6.924183e+04 6.122076e+04 6.537114e+04 6.661435e+04 1.097433e+05 1.692037e+05 6.003016e+04 4.252915e+04 5.506895e+04 4.775435e+04 6.122122e+04 5.906202e+04 9.162383e+04 6.626987e+04 8.878357e+04 6.232491e+04 4.568078e+04 5.785218e+04 7.126585e+04 8.206308e+04 1.230514e+05 5.342388e+04 4.728723e+04 5.602837e+04 6.720462e+04 1.078148e+05 7.190823e+04 7.078125e+04 4.271829e+04 8.232855e+04 5.410218e+04 9.497968e+04 5.094304e+04 7.551125e+04 7.035513e+04 5.056161e+04 5.234056e+04 5.814363e+04 7.838363e+04 7.603092e+04 5.936782e+04 6.226149e+04 8.792701e+04 5.057749e+04 9.157233e+04 9.119556e+04 8.120467e+04 4.461355e+04 5.232259e+04 9.994318e+04 8.854701e+04 1.499636e+05 7.693129e+04 9.691144e+04 6.633716e+04 8.533340e+04 8.923316e+04 1.088353e+05 6.103753e+04 8.056361e+04 8.691595e+04 8.770728e+04 8.060836e+04 6.498329e+04 5.932229e+04 1.083558e+05 6.652825e+04 2.691520e+05 1.788802e+05 8.213840e+04 1.964901e+05 1.433049e+05 2.495605e+05 1.700503e+06 7.185934e+04 5.707340e+04 1.504463e+06 4.110850e+04 9.093944e+04 5.009615e+04 1.398258e+05 1.112515e+06 8.220595e+04 1.494754e+06 7.699659e+04 1.014180e+05 1.213118e+05 1.299937e+06 8.689129e+04 1.338369e+06 1.508101e+06 7.707416e+04 1.107293e+06 1.508002e+06 1.439808e+06 7.869036e+04 4.469370e+04 5.482124e+04 5.842300e+04 9.482727e+04 7.647199e+04 8.768001e+04 7.693484e+04 8.543303e+04 1.348358e+05 1.026896e+05 6.591263e+04 1.502547e+05 4.189991e+04 1.474365e+06 2.193199e+05 5.888860e+04 5.599080e+04 1.310421e+05 7.789445e+04 6.462043e+04 1.607131e+05 6.085865e+04 1.083081e+05 9.658719e+04 6.468816e+04 7.607198e+04 5.573003e+04 5.544552e+04 1.460074e+05 5.377205e+04 4.694552e+04 9.391278e+04 7.938711e+04 7.589937e+04 1.597694e+05 5.355868e+04 9.617413e+04 8.623162e+04 2.385071e+05 1.935992e+05 1.384344e+05 1.092345e+05 2.875107e+05 1.591147e+05 1.262293e+05 1.131321e+05 1.929529e+05 1.954649e+05 5.248385e+04 1.318692e+05 6.607470e+04 3.061338e+05 7.229342e+04 9.173607e+04 8.447096e+04 3.213638e+04 1.702683e+05 1.488207e+05 1.481474e+05 3448_1.906 2.176776e+05 1.338433e+07 1.517939e+07 1.350491e+07 2.023160e+05 1.221316e+07 1.488304e+07 1.666020e+07 293169.26 1.306446e+07 1.524356e+07 1.413906e+07 145749.06 1.365805e+07 1.319693e+07 1.414853e+07 2.944165e+05 1.406958e+07 1.364403e+07 1.418822e+07 2.782926e+05 1.338973e+07 1.393239e+07 1.539329e+07 214506.894 1.459029e+07 1.478711e+07 1.387467e+07 3.049061e+05 1.260121e+07 1.508026e+07 1.561423e+07 268417.03 1.136470e+07 1.515398e+07 1.473315e+07 3.151637e+05 1.174648e+07 1.463921e+07 1.487761e+07 2.386915e+05 1.257222e+07 1.620099e+07 1.709673e+07 1.228199e+05 1.026252e+07 1.797260e+07 1.033038e+07 1.050964e+07 6.351058e+06 5.326927e+06 1.132460e+07 9.592529e+06 1.198208e+07 9.421446e+06 1.182675e+07 8.111038e+06 1.174591e+07 9.385038e+06 1.005505e+07 1.690867e+07 8.175926e+06 1.270270e+07 9.531486e+06 8.986053e+06 7.005419e+06 1.520485e+07 1.253841e+07 1.232790e+07 1.133349e+07 1.860332e+07 1.964533e+07 2.060029e+07 1.367044e+07 7.763541e+06 1.098021e+07 1.098803e+07 1.185183e+07 1.982189e+07 1.164745e+07 1.101545e+07 1.205355e+07 5.956214e+06 8.183872e+06 7.665350e+06 1.267927e+07 6.939939e+06 4.324694e+06 7.859171e+06 1.191361e+07 1.301198e+07 1.143355e+07 1.276692e+07 1.046319e+07 1.060785e+07 1.161159e+07 1.447250e+07 8.412455e+06 1.645281e+07 1.404170e+07 1.020430e+07 9.300821e+06 6.426807e+06 9.707732e+06 1.225968e+07 1.171052e+07 9.639622e+06 1.663142e+07 1.371427e+06 5.154777e+06 6.166116e+06 1.884385e+07 1.683820e+07 4.156221e+06 1.081694e+07 6.923537e+06 8.742857e+06 8.116770e+06 6.965596e+06 7.946149e+06 4.092898e+06 5.457058e+06 5.108380e+06 1.340659e+07 6.692122e+06 6.750295e+06 1.018972e+07 8.093770e+06 6.013071e+06 6.364729e+06 1.012538e+07 1.971326e+06 7.499365e+06 7.605642e+06 7.115841e+06 7.188729e+06 1.556445e+07 1.226125e+07 1.001520e+07 1.006605e+07 7.031350e+06 1.873915e+07 1.264775e+07 7.709769e+06 1.189440e+07 1.792721e+07 1.294667e+07 1.596488e+07 2.732653e+07 2.124102e+07 1.396788e+07 1.072750e+07 8.639480e+06 1.114289e+07 9.933077e+06 1.213743e+07 9.957567e+06 1.149497e+07 1.150563e+07 1.852933e+07 1.017293e+07 1.005891e+07 6.863644e+06 1.329306e+07 8.292592e+06 9.722757e+06 5.865463e+06 9.610678e+06 6.486411e+06 1.005636e+07 1.283334e+07 8.674490e+06 3.672959e+06 8.777444e+06 1.703900e+07 1.337622e+07 1.131961e+07 1.181722e+07 9.238227e+06 1.902170e+07 5.016721e+07 2.419255e+07 1.685993e+07 3.860303e+07 1.047990e+07 2.126405e+07 1.797784e+07 1.368343e+07 4.572091e+07 8.442971e+06 4.636764e+07 2.172381e+07 1.868477e+07 2.018186e+07 4.831469e+07 1.800783e+07 5.102059e+07 4.463049e+07 1.642677e+07 4.735969e+07 4.425715e+07 4.417170e+07 8.242396e+06 1.727218e+07 2.268257e+07 1.648431e+07 2.189136e+07 1.355745e+07 2.544179e+07 2.124854e+07 1.560536e+07 1.693486e+07 1.475747e+07 1.930387e+07 3.908401e+07 2.296488e+07 6.212327e+07 1.964938e+07 3.049225e+07 2.897592e+07 2.349388e+07 1.715381e+07 1.340328e+07 2.430121e+07 2.989656e+07 3.386424e+07 2.016765e+07 2.959709e+07 2.450693e+07 2.514670e+07 2.178493e+07 2.367911e+07 2.097536e+07 2.275873e+07 2.030280e+07 1.696485e+07 2.164730e+07 1.921840e+07 1.891206e+07 1.022274e+07 1.571768e+07 1.121213e+07 1.352081e+07 1.461833e+07 8.446265e+06 8.316955e+06 1.022623e+07 6.033183e+06 9.303566e+06 1.710136e+07 1.130707e+07 1.305238e+07 1.305690e+07 8.492403e+06 2.199678e+07 7.486320e+06 7.700344e+06 9.034830e+06 1.629440e+07 2.352651e+07 9.450517e+06 1.306245e+07 872.85714_1.906 3.604798e+04 1.544516e+05 1.286333e+05 1.127597e+05 3.593344e+04 8.587509e+04 1.731190e+05 1.785220e+05 26136.54 1.090463e+05 1.242722e+05 2.192896e+05 27979.79 1.010598e+05 1.185537e+05 9.398071e+04 3.982259e+04 9.872611e+04 1.608034e+05 1.066271e+05 5.038496e+04 9.742321e+04 1.311217e+05 2.585891e+05 32097.085 9.582730e+04 9.046338e+04 1.335227e+05 6.315404e+04 1.404394e+05 1.086270e+05 1.504648e+05 64194.19 1.675143e+05 8.348685e+04 1.392826e+05 7.589777e+04 8.038032e+04 1.097675e+05 1.266332e+05 4.296592e+04 6.379267e+04 1.617661e+05 2.032361e+05 1.863381e+04 6.786233e+04 1.336628e+05 1.258821e+05 4.330863e+05 2.041905e+05 7.143194e+04 4.177417e+05 1.183708e+05 9.878404e+04 4.045176e+05 1.128411e+05 1.153776e+05 6.320931e+04 1.781310e+05 2.563696e+05 6.188232e+05 9.857063e+04 5.842340e+05 2.504435e+05 7.083065e+05 2.091401e+05 1.477211e+05 8.966724e+04 5.776825e+04 1.144563e+05 1.042758e+06 1.120622e+05 3.616930e+05 1.176608e+06 5.766790e+04 1.354306e+05 8.022571e+04 8.869828e+04 4.383532e+04 1.175686e+05 1.267665e+05 2.212220e+05 8.037902e+04 2.503089e+05 5.633952e+04 7.255842e+04 8.320140e+04 5.090956e+04 4.842969e+04 3.964319e+04 1.828854e+05 2.340479e+05 7.194942e+04 7.088789e+04 1.271480e+05 2.592844e+05 1.564658e+05 5.632546e+04 1.366759e+05 1.406219e+05 8.724290e+04 3.126700e+05 5.196491e+04 2.471488e+05 9.493775e+04 6.996485e+04 7.322350e+04 1.069814e+05 7.580669e+04 1.184710e+05 6.842457e+04 6.466108e+04 7.215837e+04 5.906293e+04 3.078742e+05 7.445550e+04 5.203100e+04 2.124547e+05 8.504931e+04 1.481333e+05 1.211124e+05 6.017423e+04 5.512603e+04 4.808275e+04 1.134530e+05 7.315970e+04 9.894304e+04 1.511664e+05 9.382801e+04 2.309637e+05 9.471875e+04 7.408669e+04 7.673423e+04 7.279041e+04 8.792281e+04 8.807258e+04 7.508577e+04 1.132502e+05 4.111505e+04 1.489066e+05 1.196180e+05 4.639657e+04 1.910295e+05 5.893178e+04 1.484187e+05 1.785191e+05 8.038346e+04 1.786562e+05 3.932379e+04 4.057672e+05 1.188185e+05 7.701942e+04 4.786280e+04 1.802754e+05 4.469396e+04 4.741656e+04 1.606374e+05 6.538139e+04 1.670316e+05 5.496078e+04 7.643256e+04 1.666763e+05 5.151998e+04 6.237849e+04 1.797345e+05 8.115019e+04 3.460209e+05 1.247974e+05 1.998338e+05 2.946527e+05 7.782291e+04 1.695920e+05 8.705274e+04 8.672212e+04 1.638011e+05 3.709816e+05 1.398740e+05 1.623143e+05 2.505523e+05 1.167990e+06 8.144045e+04 4.860852e+04 5.905292e+04 2.025054e+05 6.059958e+04 1.916291e+05 6.169946e+04 5.926508e+04 5.140860e+04 5.178799e+04 7.483970e+04 3.598842e+04 1.680591e+05 2.426930e+05 7.419192e+04 6.082744e+04 5.739910e+04 8.885734e+04 7.292335e+04 5.646482e+04 6.354547e+04 2.516571e+05 8.223894e+04 5.071863e+04 5.627155e+04 9.955755e+04 2.118380e+05 4.980027e+04 5.386623e+04 7.451869e+04 2.022574e+05 4.546367e+04 4.291743e+04 7.388127e+04 4.200592e+04 4.804506e+04 7.998225e+04 9.396359e+04 5.047329e+05 9.886863e+04 5.019267e+04 1.146728e+05 5.097428e+04 1.006545e+05 2.800526e+05 1.693998e+05 9.670464e+04 6.788903e+04 1.073416e+05 7.664529e+04 3.352683e+05 5.898299e+04 9.847074e+04 1.198027e+05 1.064843e+05 2.038116e+05 5.709138e+04 7.843748e+04 5.237294e+04 6.409248e+04 2.102977e+05 4.200815e+05 4.686667e+05 9.409955e+04 3.139117e+05 8.043972e+05 2.527901e+05 9.860997e+04 1.026059e+05 1.030844e+06 1.054169e+06 2.253056e+05 2.551986e+05 9.677793e+04 6.373675e+05 1.844858e+05 9.055432e+04 1.106889e+05 3.925824e+04 7.104833e+04 2.137511e+05 8.054729e+04 "(3Z,5Z)-6-(3,4-Dihydroxyphenyl)-4-hydroxy-3,5-hexadien-2-one_1.907" 4.610357e+04 1.736693e+06 1.594083e+06 1.740214e+06 5.212001e+04 1.414838e+06 1.740613e+06 1.862796e+06 37037.52 1.618462e+06 1.872882e+06 1.717562e+06 34677.68 1.538257e+06 1.566999e+06 1.785002e+06 4.301953e+04 1.669564e+06 1.610919e+06 1.755335e+06 6.399938e+04 1.397768e+06 1.762969e+06 2.145460e+06 44388.584 1.422848e+06 1.633591e+06 1.593492e+06 7.044902e+04 1.671227e+06 1.724590e+06 1.977147e+06 60806.24 1.442603e+06 1.597283e+06 1.614728e+06 7.105186e+04 1.587123e+06 1.772952e+06 1.781643e+06 4.967093e+04 1.589269e+06 1.665735e+06 2.089836e+06 2.470405e+04 1.296345e+06 1.970414e+06 1.417280e+06 1.660083e+06 1.954081e+06 1.101145e+06 1.466371e+06 9.238528e+05 1.297440e+06 1.298112e+06 1.337461e+06 1.443035e+06 1.148183e+06 1.768933e+06 1.878931e+06 2.166413e+06 1.448287e+06 1.981048e+06 1.906743e+06 1.447819e+06 1.875509e+06 3.108889e+06 1.559303e+06 1.472962e+06 1.504323e+06 2.357486e+06 1.719689e+06 2.156393e+06 2.166314e+06 1.404662e+06 1.426325e+06 2.027635e+06 1.939852e+06 4.835489e+04 1.927353e+06 1.606616e+06 1.761215e+06 1.403437e+06 2.032875e+06 1.438122e+06 1.824276e+06 1.093610e+06 9.935979e+05 1.548082e+06 1.803320e+06 3.869594e+06 1.937052e+06 2.739776e+06 2.441086e+06 3.569962e+06 2.824992e+06 3.739374e+06 9.115366e+05 2.124760e+06 2.381392e+06 1.834331e+06 2.729260e+06 8.582678e+05 2.576465e+06 3.571488e+06 2.785517e+06 2.065580e+06 3.103546e+06 1.025452e+06 1.063046e+06 1.363804e+06 3.928967e+06 2.952457e+06 1.505236e+06 1.712143e+06 1.319265e+06 1.894237e+06 1.408016e+06 1.440840e+06 1.864766e+06 9.615993e+05 9.234351e+05 9.490828e+05 1.469599e+06 1.423882e+06 1.220355e+06 2.177860e+06 1.453256e+06 1.507706e+06 1.967470e+06 1.830913e+06 6.897525e+04 1.623006e+06 1.454430e+06 1.829353e+06 1.834807e+06 2.675577e+06 2.206781e+06 1.412883e+06 2.129433e+06 9.453823e+05 2.856347e+06 2.925839e+06 9.711018e+05 1.363991e+06 1.704073e+06 1.247953e+06 1.823113e+06 2.003320e+06 2.491789e+06 2.036928e+06 2.189925e+06 1.899902e+06 1.979921e+06 1.525006e+06 1.925006e+06 2.661140e+06 3.342292e+06 3.979667e+06 1.652408e+06 1.951567e+06 2.011649e+06 1.337500e+06 1.213865e+06 2.153796e+06 1.449522e+06 1.282094e+06 1.162684e+06 1.145494e+06 1.408162e+06 1.521547e+06 1.276680e+06 1.355291e+06 1.281350e+06 2.156914e+06 1.965647e+06 1.566869e+06 1.533455e+06 2.004583e+06 1.733898e+06 4.037236e+06 9.413675e+05 8.947551e+05 5.206439e+06 1.059598e+06 1.040465e+06 1.032922e+06 9.364530e+05 5.289269e+06 6.533489e+05 4.673364e+06 1.344866e+06 9.152738e+05 1.165943e+06 5.461396e+06 7.743883e+05 5.584576e+06 5.448404e+06 8.090371e+05 4.302195e+06 5.596984e+06 5.991515e+06 8.547541e+05 7.712284e+05 1.127354e+06 8.701434e+05 9.732940e+05 7.771785e+05 1.261613e+06 1.134320e+06 7.220323e+05 9.287441e+05 6.197451e+05 9.910867e+05 1.375581e+06 1.180902e+06 5.216887e+06 1.416267e+06 1.349726e+06 9.624228e+05 1.150689e+06 9.202589e+05 6.470214e+05 1.039256e+06 1.330691e+06 1.607464e+06 1.354572e+06 8.942263e+05 1.073163e+06 8.733506e+05 1.111419e+06 1.237848e+06 1.018552e+06 9.262859e+05 1.165401e+06 1.088144e+06 1.783539e+06 1.186973e+06 1.168120e+06 9.728393e+05 2.129076e+06 1.460778e+06 1.549648e+06 1.834661e+06 1.044123e+06 1.320350e+06 1.881031e+06 1.436285e+06 1.678097e+06 2.032178e+06 1.537114e+06 1.641422e+06 1.512232e+06 1.306787e+06 3.088082e+06 1.052163e+06 1.117509e+06 1.112757e+06 7.721459e+05 1.163538e+06 1.546629e+06 1.455954e+06 "6-Deoxy-2,3-di-O-methyl-D-allopyranose_1.908" 1.222970e+05 1.107678e+06 1.102845e+06 1.118901e+06 9.869851e+04 7.465161e+05 1.054216e+06 1.156358e+06 78805.96 1.011767e+06 1.146803e+06 1.203867e+06 75445.14 9.557568e+05 9.394434e+05 1.027825e+06 9.863928e+04 1.155932e+06 9.622911e+05 1.129300e+06 1.542328e+05 7.641660e+05 1.046498e+06 1.446663e+06 106475.185 9.827985e+05 1.024843e+06 8.761493e+05 1.588299e+05 9.638468e+05 1.163458e+06 1.398697e+06 138899.18 7.824138e+05 1.082524e+06 9.994253e+05 1.816798e+05 1.078063e+06 8.411354e+05 9.797582e+05 1.384085e+05 1.146417e+06 9.931045e+05 1.476134e+06 6.151043e+04 8.224620e+05 1.227955e+06 8.272504e+05 7.521803e+05 8.301855e+05 3.174977e+05 5.990884e+05 2.737210e+05 1.018639e+06 3.097966e+05 3.356087e+05 6.685026e+05 7.305517e+05 2.883807e+05 7.159738e+05 8.120543e+05 2.543420e+05 3.501642e+05 9.385193e+05 2.849386e+05 3.048244e+06 4.314685e+05 3.116745e+05 6.272258e+05 2.046630e+05 3.958568e+05 2.334162e+05 2.080635e+05 1.843908e+05 1.600864e+06 1.009757e+06 2.337013e+06 1.863545e+06 2.816523e+05 3.995479e+06 1.248718e+06 8.227827e+05 1.504111e+06 1.452956e+06 1.022850e+06 3.913893e+06 1.828250e+06 4.976667e+05 1.754262e+06 1.425796e+06 1.596610e+06 2.594151e+06 6.021145e+05 3.141636e+05 2.966036e+05 5.446040e+05 6.651307e+05 2.657439e+05 2.050722e+05 6.371533e+05 1.585411e+05 4.555988e+05 2.151862e+05 3.452279e+05 3.992136e+05 4.284094e+05 3.173642e+05 2.899601e+05 6.741359e+05 2.569493e+05 9.176787e+05 4.647246e+05 5.089432e+05 1.897824e+05 5.548128e+05 2.268439e+05 6.819231e+05 5.903043e+05 7.734943e+05 9.062160e+05 2.943254e+05 1.803580e+05 2.522250e+05 4.429254e+05 1.899606e+05 3.300630e+05 1.070178e+06 2.933737e+05 5.655843e+05 6.628599e+05 1.199587e+06 3.968421e+05 1.286820e+06 1.473504e+06 7.398160e+05 9.158545e+05 1.478161e+06 9.308500e+05 7.405911e+05 1.148224e+06 3.962600e+05 1.078726e+06 9.320190e+05 8.141330e+05 5.359354e+05 8.366058e+05 1.312841e+06 4.294975e+05 9.155330e+05 1.824929e+06 1.383171e+06 2.270144e+06 1.583715e+06 6.515646e+05 4.204569e+05 2.275306e+05 5.603099e+05 7.970467e+05 5.655949e+05 3.910889e+05 2.061255e+05 4.969967e+05 6.499424e+05 1.296018e+06 2.217213e+06 1.271217e+06 6.260986e+05 1.148206e+06 3.388188e+05 9.350326e+05 2.007685e+06 8.033066e+05 6.842164e+05 8.474294e+05 1.889355e+06 1.272488e+06 3.543685e+05 3.418102e+05 3.241417e+05 5.754622e+05 1.258842e+06 3.322602e+06 7.023754e+05 2.747737e+06 4.541724e+05 8.633999e+05 1.506215e+06 6.418243e+05 1.257680e+06 2.469515e+06 2.889484e+06 9.998202e+05 8.093802e+05 7.297642e+05 2.762334e+06 5.881583e+05 1.920398e+06 2.541824e+06 1.550650e+06 3.131816e+06 1.562106e+06 3.325059e+06 6.803980e+05 2.167481e+06 2.868551e+06 6.768111e+05 1.654730e+06 5.367836e+05 2.995565e+06 1.929985e+06 5.451270e+05 8.106521e+05 1.916909e+06 2.781198e+06 4.863738e+05 2.379697e+06 5.859503e+06 1.010619e+06 1.786216e+06 1.478286e+06 1.861369e+06 1.344630e+06 4.689752e+05 1.003340e+06 5.882143e+05 1.267847e+06 8.680955e+05 1.018610e+06 1.034330e+06 7.284195e+05 5.877447e+05 2.167834e+06 1.144842e+06 3.934976e+05 9.410213e+05 1.409650e+06 2.958616e+06 1.019908e+06 9.436211e+05 9.493226e+05 5.371950e+06 5.381880e+05 6.775130e+05 1.334279e+06 8.091007e+05 7.775766e+05 4.633739e+05 4.360482e+05 1.382454e+06 9.501162e+05 1.020875e+06 7.656550e+05 4.565306e+05 7.984067e+05 1.827066e+06 7.899129e+05 1.115641e+06 7.093675e+05 1.109675e+06 3.416469e+05 5.521657e+05 6.530014e+05 C12 H18 O5_1.909 6.184054e+04 3.464628e+05 4.606047e+05 4.848025e+05 5.708633e+04 2.443307e+05 3.782067e+05 3.526962e+05 39218.17 3.260916e+05 4.866433e+05 4.405525e+05 33522.77 4.575847e+05 3.673244e+05 3.364138e+05 5.953849e+04 3.300948e+05 4.387560e+05 3.465896e+05 9.027116e+04 2.853637e+05 3.992963e+05 3.879341e+05 56112.446 4.352533e+05 5.331102e+05 3.594342e+05 7.909610e+04 2.799776e+05 3.017208e+05 6.208321e+05 64928.47 2.128615e+05 5.552123e+05 3.182189e+05 8.298510e+04 2.761743e+05 4.842589e+05 3.363745e+05 6.477024e+04 3.696201e+05 4.450378e+05 3.950571e+05 3.032111e+04 2.665480e+05 5.518619e+05 3.138480e+05 1.593867e+05 2.091139e+05 1.023554e+05 1.542667e+05 1.625159e+05 1.672316e+05 1.870442e+05 1.201380e+05 1.661617e+05 2.146349e+05 3.595174e+05 2.943451e+05 6.531104e+05 1.825515e+05 5.912037e+05 4.183714e+05 6.530287e+05 8.945901e+04 4.576270e+05 2.268227e+05 2.995773e+05 4.364889e+05 5.697595e+05 6.414822e+05 5.599926e+05 6.762329e+05 1.598331e+05 1.638939e+05 2.807616e+05 7.383367e+04 3.433563e+06 2.210401e+05 2.251148e+05 3.332364e+05 1.484697e+05 4.833640e+05 1.773960e+05 2.840296e+05 1.511341e+05 1.099652e+05 1.719730e+05 2.212422e+05 3.106216e+05 1.293705e+05 2.415446e+05 3.619643e+05 8.459744e+05 3.635221e+05 3.952548e+05 1.229851e+05 3.676656e+05 3.954381e+05 3.384960e+05 2.883635e+05 8.217730e+04 2.338576e+05 1.806058e+05 4.584793e+05 1.523898e+05 5.348624e+05 7.579768e+04 1.589097e+05 7.446491e+04 4.810177e+05 4.398135e+05 8.510519e+04 4.627295e+04 9.289051e+04 4.214561e+05 2.398322e+05 1.073765e+05 2.420530e+05 1.057000e+05 1.109587e+05 9.240706e+04 1.297632e+05 8.346233e+04 9.986269e+04 1.794268e+05 1.086006e+05 2.400518e+05 1.114119e+05 2.062412e+05 2.419049e+05 2.706611e+05 1.094773e+05 3.125760e+05 1.407355e+05 4.175958e+05 5.235586e+05 1.566604e+05 3.325517e+05 4.446843e+05 4.017397e+05 3.769927e+05 3.489803e+05 5.082631e+05 6.696533e+05 6.933003e+05 6.170827e+05 1.008463e+06 9.692732e+05 7.728045e+05 3.626125e+05 4.380036e+05 9.277142e+04 3.442978e+05 3.974641e+05 4.409141e+05 2.157462e+05 5.878919e+05 1.625362e+05 8.587626e+04 8.177482e+04 9.935294e+04 3.610044e+05 5.705456e+05 4.160328e+05 1.337709e+05 4.090359e+05 1.429696e+05 3.109900e+05 4.515722e+05 1.260831e+05 4.430443e+05 6.076102e+05 5.023675e+05 3.843715e+05 2.568053e+05 4.286008e+05 4.326996e+05 3.960847e+05 1.094598e+06 1.878379e+05 1.613422e+05 7.713708e+05 8.188621e+05 2.151050e+05 3.520435e+05 1.016348e+05 7.887424e+05 4.729212e+05 7.979783e+05 2.965623e+05 4.585043e+05 4.361231e+05 1.183589e+06 2.434910e+05 1.359325e+06 9.704663e+05 2.373740e+05 5.656814e+05 5.948694e+05 8.872685e+05 9.275144e+04 1.994463e+05 3.477842e+05 3.534938e+05 2.244683e+05 1.976605e+05 1.922657e+05 1.307965e+05 1.063324e+05 2.272482e+05 2.364589e+05 8.407043e+04 1.153779e+06 5.234920e+05 5.075096e+05 3.591017e+05 7.483660e+05 1.023113e+06 2.099607e+05 1.197605e+05 4.187157e+05 4.571537e+05 5.009334e+05 1.599718e+05 2.610240e+05 3.005781e+05 4.172852e+05 7.009104e+05 3.263018e+05 8.124902e+05 2.712944e+05 8.081627e+04 4.369002e+05 1.731719e+05 3.669774e+05 2.480159e+05 2.234122e+05 4.815983e+05 7.409212e+05 4.068149e+05 4.605213e+05 3.549144e+05 2.135046e+05 2.416909e+05 2.370914e+05 3.100841e+05 5.388521e+05 4.287391e+05 4.765778e+05 3.540318e+05 1.016711e+05 3.534813e+05 6.000966e+05 7.913314e+05 5.373761e+05 1.342034e+05 3.401024e+05 3.875367e+05 4.463972e+05 1.929466e+05 C23 H43 N5 O6_1.91 5.151893e+04 1.110258e+06 1.091045e+06 9.777968e+05 3.892080e+04 9.352636e+05 1.070166e+06 1.214215e+06 41711.37 1.109569e+06 1.094279e+06 1.109200e+06 41067.48 8.716795e+05 1.109842e+06 1.042776e+06 5.121002e+04 9.843448e+05 1.008439e+06 1.134049e+06 7.411591e+04 9.877952e+05 1.101095e+06 1.151627e+06 49339.959 9.947561e+05 1.208358e+06 9.780598e+05 7.500100e+04 1.044303e+06 9.712688e+05 1.284921e+06 67462.80 9.507632e+05 9.982817e+05 8.269825e+05 7.729168e+04 1.103152e+06 1.113509e+06 1.261081e+06 4.750339e+04 9.465984e+05 1.227133e+06 1.086981e+06 2.459082e+04 8.395776e+05 1.086820e+06 1.069765e+06 9.947181e+05 1.223554e+06 2.016967e+05 4.086990e+05 2.550936e+05 9.637070e+05 4.076606e+05 2.256021e+05 4.105097e+05 3.958890e+05 7.318216e+05 1.195634e+06 7.679768e+05 4.027305e+05 4.715930e+05 5.825267e+05 4.574750e+05 1.095020e+06 1.078394e+06 4.062256e+05 4.690379e+05 4.329120e+05 6.003993e+05 4.810320e+05 6.766264e+05 6.559093e+05 7.046180e+05 9.244538e+05 1.072411e+06 9.973114e+05 5.171602e+05 9.773967e+05 7.755752e+05 9.369304e+05 6.790100e+05 1.178756e+06 6.195349e+05 1.181949e+06 5.415564e+05 3.475998e+05 8.026205e+05 8.841850e+05 1.105092e+06 9.933253e+05 9.856232e+05 7.200483e+05 1.040384e+06 7.877973e+05 1.214787e+06 7.966551e+05 6.928082e+05 6.714464e+05 5.861947e+05 8.176320e+05 6.868506e+05 9.140377e+05 7.261122e+05 9.189438e+05 5.534790e+05 8.973136e+05 4.892975e+05 7.380351e+05 9.784837e+05 1.322108e+06 9.458380e+05 9.684809e+05 1.188795e+06 8.537009e+05 1.249144e+06 1.050256e+06 7.473790e+05 1.087618e+06 6.880813e+05 7.088557e+05 5.235936e+05 1.058224e+06 9.719917e+05 9.621288e+05 1.807174e+06 8.571382e+05 1.024924e+06 1.447239e+06 1.085618e+06 2.942148e+05 8.546717e+05 1.131050e+06 1.118051e+06 1.190242e+06 1.076311e+06 1.304677e+06 8.608403e+05 1.278171e+06 1.093734e+05 1.542444e+06 1.932267e+06 1.383452e+05 3.099887e+05 2.867180e+05 3.557120e+05 4.908587e+05 5.097763e+05 7.568351e+05 5.290443e+05 7.011532e+05 5.449499e+05 1.088862e+06 6.454025e+05 8.150196e+05 1.821844e+06 1.547358e+06 1.990731e+06 8.895602e+05 1.158864e+06 1.053684e+06 9.117517e+05 6.569264e+05 1.391356e+06 6.307737e+05 7.333823e+05 7.707941e+05 7.610162e+05 9.332949e+05 8.865944e+05 9.883932e+05 1.007660e+06 7.750804e+05 1.295568e+06 1.139999e+06 5.390682e+05 4.364199e+05 5.741434e+05 5.391836e+05 1.712601e+06 1.037055e+06 1.011365e+06 1.737633e+06 1.105542e+06 1.333023e+06 1.162743e+06 1.045967e+06 1.578828e+06 8.991219e+05 1.246039e+06 1.037488e+06 5.555476e+05 1.250901e+06 2.968314e+06 8.738124e+05 1.760994e+06 1.768760e+06 8.356392e+05 1.516714e+06 1.984976e+06 2.242322e+06 8.961864e+05 8.754793e+05 1.052408e+06 8.497896e+05 1.060929e+06 7.670415e+05 1.454336e+06 1.393402e+06 7.437177e+05 9.864638e+05 7.572707e+05 1.103944e+06 1.303044e+06 1.415118e+06 1.957573e+06 1.783500e+06 1.726800e+06 1.113890e+06 1.491403e+06 1.028570e+06 6.073754e+05 1.365296e+06 1.796210e+06 1.832365e+06 1.484037e+06 1.191439e+06 1.460751e+06 1.056471e+06 1.244346e+06 1.467200e+06 8.400549e+05 1.190003e+06 1.308199e+06 8.812948e+05 9.738664e+05 8.489434e+05 1.068806e+06 7.864925e+05 1.090128e+06 2.198687e+06 2.590993e+06 2.446276e+06 1.937270e+06 2.486355e+06 3.290866e+06 2.081978e+06 2.583742e+06 4.098400e+06 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3.531243e+05 5.543456e+05 2.424409e+05 3.033642e+05 3.316454e+05 C11 H30 N5 O7 P_1.914 5.262323e+04 1.404791e+05 1.354815e+05 1.445679e+05 3.575070e+04 8.414152e+04 1.327512e+05 1.741179e+05 35803.40 1.311100e+05 1.323824e+05 1.688940e+05 42522.08 1.428991e+05 1.216583e+05 1.375824e+05 4.165387e+04 1.537386e+05 1.357716e+05 1.849805e+05 6.470463e+04 5.557011e+04 1.891658e+05 1.399285e+05 44600.765 1.671288e+05 6.670381e+04 9.663777e+04 7.027057e+04 1.515861e+05 1.401841e+05 1.493432e+05 57390.28 7.070973e+04 1.617295e+05 1.157353e+05 6.669703e+04 1.755009e+05 1.112997e+05 1.313934e+05 4.240440e+04 1.416239e+05 1.376803e+05 2.060944e+05 2.204768e+04 1.191680e+05 1.033494e+05 1.104850e+05 9.817643e+04 8.412817e+04 1.074896e+05 1.194393e+05 6.033382e+04 6.824680e+04 9.474680e+04 1.136926e+05 1.305362e+05 5.839474e+04 7.079955e+04 7.715937e+04 1.662520e+05 7.731612e+04 6.815393e+04 7.278907e+04 9.065204e+04 7.128260e+04 9.086349e+04 1.180310e+05 1.209290e+05 8.011313e+04 1.196050e+05 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1.914886e+05 1.012534e+06 8.886862e+04 6.225343e+04 5.513517e+05 5.948877e+04 6.268458e+04 7.175958e+04 4.263515e+05 4.925110e+04 1.048997e+05 4.263274e+05 8.777100e+05 5.203891e+05 1.017710e+05 7.481019e+04 3.610325e+05 3.552110e+05 1.540594e+05 7.241178e+04 6.685466e+04 8.285989e+05 1.373413e+05 8.020898e+04 5.928096e+04 8.044189e+05 1.315412e+05 1.164204e+05 1.415577e+05 7.462580e+04 5.094577e+04 5.120666e+05 6.063070e+04 1.780020e+05 2.020368e+05 1.698204e+05 2.547929e+05 4.299341e+05 7.632788e+04 1.982631e+05 5.945997e+05 1.894418e+05 2.291736e+05 2.061146e+05 4.137969e+05 1.661918e+05 5.499107e+05 6.002758e+05 1.186380e+06 2.564757e+06 1.697998e+05 2.439026e+06 1.488088e+06 5.916836e+05 1.392536e+05 8.134895e+04 1.399691e+06 1.939728e+06 3.632732e+05 1.178384e+06 2.824463e+05 5.485869e+05 8.100891e+05 2.744708e+05 2.333754e+05 1.455966e+05 3.115732e+06 3.751495e+05 2.719133e+05 C19 H34 N4 O4_1.915 1.088709e+05 5.053323e+06 4.592664e+06 5.001796e+06 7.441718e+04 4.364677e+06 4.793269e+06 5.745321e+06 76820.19 4.474571e+06 5.014622e+06 5.671206e+06 72474.87 4.302033e+06 4.444322e+06 5.046493e+06 4.720785e+05 4.704153e+06 4.344370e+06 5.265761e+06 1.379935e+05 3.971948e+06 5.503849e+06 6.020506e+06 94342.875 4.522329e+06 4.516989e+06 4.516007e+06 1.457619e+05 4.611574e+06 4.947941e+06 5.806375e+06 122743.34 4.089559e+06 4.820795e+06 4.168546e+06 1.392403e+05 5.220204e+06 5.254228e+06 4.781305e+06 8.818930e+04 5.048554e+06 5.314787e+06 5.635548e+06 4.728512e+04 2.943146e+06 4.841405e+06 5.358256e+06 3.124366e+06 3.961902e+06 2.238011e+06 4.039238e+06 2.208701e+06 3.489743e+06 3.667098e+06 2.720675e+06 3.987643e+06 3.277284e+06 4.478598e+06 5.211207e+06 7.050071e+06 4.670102e+06 5.239700e+06 6.110250e+06 5.127434e+06 5.742429e+06 6.433553e+06 3.659373e+06 5.083678e+06 5.394032e+06 7.783682e+06 6.062062e+06 6.249046e+06 6.638114e+06 4.651707e+06 4.643375e+06 5.965653e+06 5.113876e+06 9.058416e+06 5.661377e+06 4.257528e+06 4.515216e+06 3.257171e+06 6.039210e+06 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4.568944e+06 2.405660e+06 2.081637e+06 4.245032e+06 2.452899e+06 2.325508e+06 2.571247e+06 2.583385e+06 3.432165e+06 3.527051e+06 2.334366e+06 3.770579e+06 2.856937e+06 4.743904e+06 4.792335e+06 5.350637e+06 5.350049e+06 6.728162e+06 6.083858e+06 1.273393e+07 3.332722e+06 3.604322e+06 1.314824e+07 3.730838e+06 3.755568e+06 3.537946e+06 3.129058e+06 1.291644e+07 3.216571e+06 1.231974e+07 5.638040e+06 2.484693e+06 3.842809e+06 1.641603e+07 2.231981e+06 1.120244e+07 1.393083e+07 2.384476e+06 1.138100e+07 1.286369e+07 1.418272e+07 2.724925e+06 3.013655e+06 4.505445e+06 3.296394e+06 4.826840e+06 2.020568e+06 5.652373e+06 5.778092e+06 2.098967e+06 3.570791e+06 3.049986e+06 4.740561e+06 2.808599e+06 5.064160e+06 1.573334e+07 6.439075e+06 5.505312e+06 3.491810e+06 5.644633e+06 3.608911e+06 1.683115e+06 3.367334e+06 4.229926e+06 6.249720e+06 3.494050e+06 3.373157e+06 4.177487e+06 3.685672e+06 3.651605e+06 6.367747e+06 5.459552e+06 3.324708e+06 5.074377e+06 4.704488e+06 6.269045e+06 4.673634e+06 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5.287054e+05 1.518115e+05 7.049465e+04 1.762396e+05 4.221222e+05 2.115620e+05 3.744030e+05 1.155662e+05 2.753397e+05 1.385363e+05 1.872609e+05 1.191903e+05 C17 H6 N9 O14 P3 S2_1.917 3.924298e+04 1.722069e+06 1.987577e+06 1.987672e+06 2.762769e+04 1.901329e+06 1.738333e+06 2.133231e+06 36831.21 1.861857e+06 1.858490e+06 1.737147e+06 39371.91 1.930006e+06 1.990228e+06 1.999468e+06 5.409206e+04 1.945330e+06 1.585609e+06 2.282909e+06 9.086568e+04 1.629204e+06 1.767892e+06 1.728532e+06 58125.674 1.962537e+06 1.831094e+06 1.798695e+06 5.440850e+04 2.353168e+06 1.777472e+06 2.192696e+06 54603.48 1.799534e+06 1.186639e+06 1.918844e+06 5.690576e+04 2.315013e+06 2.225415e+06 1.471899e+06 4.052998e+04 1.739182e+06 2.490616e+06 1.423750e+06 2.185509e+04 1.880448e+06 1.810150e+06 2.053384e+06 3.825127e+06 1.355042e+06 1.157160e+06 4.799441e+06 3.217127e+06 1.327268e+06 2.330736e+06 3.283461e+06 1.853307e+06 1.782667e+06 1.377849e+06 3.365052e+06 2.683121e+06 2.429997e+06 2.508178e+06 1.455015e+06 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2.936246e+06 9.515866e+05 1.695902e+05 1.246459e+06 5.793653e+05 7.581863e+05 2.255334e+06 5.365178e+05 1.082309e+06 2.059589e+06 9.857320e+05 1.353824e+06 1.433459e+06 7.662898e+05 1.179251e+06 2.371198e+06 3.778883e+05 1.665783e+06 8.352906e+05 1.454237e+06 4.490996e+05 2.129078e+06 9.571132e+05 3.141718e+06 4.735752e+06 1.456830e+06 4.857170e+06 5.161509e+06 2.391296e+06 9.958812e+05 1.634758e+06 3.123953e+06 3.864742e+06 2.302620e+06 3.876753e+06 9.936591e+05 2.380519e+06 2.354053e+06 1.219922e+06 1.698959e+06 7.860373e+05 8.004629e+06 2.144878e+06 1.601809e+06 C19 H37 N5 O4_1.918 6.609640e+04 4.072598e+06 3.791337e+06 4.092640e+06 3.983093e+04 3.478445e+06 3.846152e+06 4.620354e+06 42680.82 3.578303e+06 3.979332e+06 4.469167e+06 40328.68 3.693863e+06 3.522869e+06 4.198817e+06 4.251116e+05 3.739142e+06 3.464997e+06 4.233495e+06 8.207922e+04 3.208524e+06 4.501863e+06 4.813844e+06 50371.619 3.637292e+06 3.764308e+06 3.511435e+06 7.749795e+04 3.732775e+06 4.034912e+06 4.609539e+06 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9.514963e+04 7.956439e+04 2.237123e+06 1.348080e+06 6.000369e+06 3.985812e+06 2.519673e+05 4.406263e+06 4.948732e+06 7.784663e+05 1.084812e+06 3.649388e+05 1.772030e+06 2.981522e+05 8.895315e+05 9.016364e+05 2.424110e+06 1.123150e+06 1.154493e+06 1.342451e+06 3.624136e+06 6.944450e+05 8.326295e+06 2.755739e+06 4.136220e+05 4.230605e+06 1.715411e+06 2.500567e+05 2.299104e+05 2.925469e+06 1.920313e+06 C13 H28 O6_1.919 1.620418e+05 1.507137e+07 1.480068e+07 1.646439e+07 9.647271e+04 1.508812e+07 1.486761e+07 1.702005e+07 107000.57 1.462637e+07 1.767531e+07 1.677204e+07 103633.24 1.394115e+07 1.421157e+07 1.574249e+07 1.641114e+05 1.452790e+07 1.512714e+07 1.656359e+07 2.119282e+05 1.349878e+07 1.676397e+07 1.934233e+07 155510.022 1.392893e+07 1.468928e+07 1.408558e+07 1.639726e+05 1.531225e+07 1.428635e+07 1.918869e+07 171868.22 1.443002e+07 1.552933e+07 1.354155e+07 1.887763e+05 1.619571e+07 1.592715e+07 1.579886e+07 1.294991e+05 1.476557e+07 1.635463e+07 1.734211e+07 6.803043e+04 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2.187935e+06 1.548375e+06 5.862476e+05 1.396684e+05 8.289377e+04 1.351817e+06 1.794095e+06 3.638482e+05 1.133303e+06 2.818269e+05 5.498932e+05 8.104396e+05 2.743902e+05 2.431000e+05 1.461104e+05 2.909360e+06 3.758298e+05 2.629667e+05 C13 H28 O7_1.92 1.079989e+05 2.785056e+06 1.970977e+06 1.826781e+06 5.995080e+04 1.155975e+06 2.401357e+06 2.879945e+06 50846.60 1.916853e+06 2.174830e+06 2.233863e+06 48749.94 1.933450e+06 1.951497e+06 2.154613e+06 3.460204e+05 2.080402e+06 2.031948e+06 2.147257e+06 1.098813e+05 1.579377e+06 2.141231e+06 3.151726e+06 86971.749 1.816938e+06 2.050832e+06 1.813623e+06 9.807303e+04 2.210584e+06 1.933340e+06 2.658324e+06 86848.84 1.790583e+06 2.422005e+06 1.591392e+06 1.047030e+05 1.882381e+06 2.442689e+06 2.112118e+06 7.449527e+04 2.131499e+06 2.131292e+06 2.539510e+06 3.303174e+04 1.744131e+06 2.265058e+06 1.971446e+06 6.971952e+05 1.286206e+06 4.352115e+05 1.456782e+06 5.322510e+05 2.123460e+06 5.956622e+05 1.366985e+06 1.728505e+06 1.005956e+06 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3.147917e+06 6.854061e+06 1.805541e+06 7.406157e+06 1.427482e+06 1.865176e+06 2.387225e+06 1.269528e+06 2.917182e+06 3.788595e+06 8.419280e+06 2.424273e+06 1.925548e+06 9.358716e+05 6.606656e+06 1.321475e+06 4.881583e+06 8.088754e+06 4.279204e+06 9.292552e+06 3.932284e+06 1.064363e+07 1.192647e+06 5.027275e+06 5.553406e+06 2.019684e+06 3.886257e+06 1.274117e+06 4.775464e+06 4.392713e+06 8.375468e+05 1.866696e+06 4.510955e+06 5.179513e+06 7.753572e+05 4.938698e+06 7.317461e+06 2.832117e+06 2.780162e+06 3.161241e+06 3.984136e+06 3.012421e+06 7.778313e+05 2.391030e+06 1.891299e+06 2.701121e+06 1.451720e+06 1.547678e+06 2.246051e+06 1.035904e+06 1.321159e+06 3.933077e+06 3.037704e+06 8.957780e+05 2.017113e+06 2.610193e+06 6.146306e+06 2.047523e+06 1.614055e+06 1.611472e+06 2.133355e+07 1.350897e+06 1.537082e+06 2.309447e+06 2.411556e+06 3.063710e+06 1.160305e+06 1.152921e+06 3.123080e+06 2.650119e+06 3.131069e+06 1.457171e+06 1.369793e+06 1.804871e+06 4.789065e+06 2.461893e+06 3.437559e+06 1.736645e+06 2.287609e+06 9.211115e+05 1.593738e+06 1.361052e+06 C8 H28 N9 O P_1.921 7.131997e+04 6.108019e+06 5.659434e+06 5.879740e+06 4.323633e+04 5.755399e+06 5.935715e+06 6.554060e+06 44588.79 5.575514e+06 6.696479e+06 6.486995e+06 42385.89 5.564220e+06 5.256635e+06 6.092497e+06 5.408285e+04 5.538813e+06 6.006445e+06 6.224030e+06 8.980282e+04 5.040232e+06 6.660005e+06 7.476470e+06 78589.915 5.444552e+06 5.464863e+06 5.374700e+06 6.965145e+04 5.816786e+06 5.234470e+06 7.434909e+06 70695.50 5.634119e+06 6.298002e+06 4.999922e+06 7.653096e+04 6.485468e+06 5.673507e+06 6.178692e+06 6.310787e+04 5.898476e+06 6.076126e+06 6.439724e+06 2.875178e+04 5.687538e+06 5.295779e+06 6.373466e+06 5.020983e+06 5.539756e+06 2.078451e+06 4.256063e+06 2.704571e+06 4.264599e+06 4.077800e+06 4.063317e+06 4.559501e+06 3.917285e+06 4.744690e+06 7.330861e+06 6.900312e+06 5.418796e+06 6.332344e+06 8.250176e+06 7.308118e+06 7.710993e+06 9.482327e+06 4.792357e+06 6.085173e+06 6.934773e+06 8.097176e+06 6.582605e+06 8.196904e+06 8.236043e+06 5.852720e+06 6.935793e+06 8.005078e+06 7.767348e+06 1.972687e+06 7.464533e+06 5.910320e+06 5.992288e+06 4.441169e+06 8.207644e+06 4.543558e+06 6.968847e+06 4.668894e+06 3.435467e+06 5.857496e+06 6.403507e+06 9.215605e+06 7.299644e+06 5.694236e+06 5.346215e+06 8.064425e+06 5.620317e+06 9.976499e+06 3.242673e+06 6.154388e+06 5.153012e+06 5.230593e+06 8.265029e+06 2.726786e+06 6.198716e+06 6.247587e+06 6.718470e+06 4.777149e+06 6.841001e+06 3.970253e+06 2.972106e+06 5.038696e+06 9.474082e+06 8.995942e+06 4.863105e+06 4.682346e+06 3.099227e+06 5.113736e+06 4.189070e+06 3.350364e+06 6.695270e+06 2.494646e+06 3.346149e+06 2.883135e+06 4.797105e+06 3.805719e+06 3.742868e+06 7.989846e+06 3.302900e+06 4.758997e+06 4.821413e+06 5.566658e+06 2.081422e+06 3.774002e+06 6.562366e+06 6.181257e+06 6.324505e+06 6.612949e+06 7.479145e+06 5.649083e+06 8.134105e+06 2.295127e+06 1.077921e+07 1.023271e+07 2.095843e+06 3.855387e+06 4.852482e+06 5.592587e+06 6.206382e+06 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7.724032e+06 4.821278e+06 4.731143e+06 5.447322e+06 5.180621e+06 5.701060e+06 7.870151e+06 5.822232e+06 4.807260e+06 6.931844e+06 6.335562e+06 9.042504e+06 6.024806e+06 5.156236e+06 3.284770e+06 7.593454e+06 6.614781e+06 9.075094e+06 8.082996e+06 6.982978e+06 7.268127e+06 8.623452e+06 5.238734e+06 7.386229e+06 1.059578e+07 6.998722e+06 3.943640e+06 7.858891e+06 4.481126e+06 1.342773e+07 2.651835e+06 2.509223e+06 3.029477e+06 3.038881e+06 7.208983e+06 8.355921e+06 8.669645e+06 C41 H65 N9 O2 S_1.922 8.359814e+04 8.703813e+05 9.500991e+05 7.634350e+05 4.835988e+04 6.061076e+05 8.081786e+05 9.130514e+05 46804.49 7.191527e+05 1.094076e+06 8.923667e+05 44908.60 7.061570e+05 7.236819e+05 9.232180e+05 6.170403e+04 6.939126e+05 7.260576e+05 7.887944e+05 1.028942e+05 7.489286e+05 9.129567e+05 1.169771e+06 85965.304 7.426584e+05 7.495287e+05 6.098583e+05 9.954696e+04 8.675398e+05 7.687544e+05 9.008984e+05 77653.92 8.060743e+05 8.475196e+05 7.728951e+05 7.744734e+04 8.637074e+05 8.315296e+05 9.127029e+05 6.293470e+04 7.319782e+05 8.213464e+05 9.276248e+05 2.948673e+04 7.445186e+05 7.432563e+05 8.747512e+05 6.405041e+05 6.427341e+05 3.126323e+05 5.336280e+05 3.789307e+05 5.633264e+05 5.051586e+05 6.282246e+05 5.722296e+05 4.902308e+05 3.630700e+05 9.948149e+05 9.187531e+05 6.083469e+05 6.719654e+05 6.965170e+05 5.987872e+05 7.975324e+05 9.119621e+05 1.343295e+05 5.444132e+05 5.106155e+05 8.228969e+05 6.127853e+05 7.250490e+05 9.470610e+05 7.010974e+05 1.001827e+06 9.180709e+05 1.095800e+06 9.377638e+04 6.289857e+05 7.128654e+05 9.377879e+05 4.948042e+05 9.219523e+05 5.092659e+05 7.871118e+05 4.392516e+05 2.383367e+05 6.094840e+05 8.488102e+05 1.045564e+06 8.031138e+05 1.099101e+06 6.747705e+05 9.597562e+05 7.230761e+05 9.352498e+05 5.510836e+05 6.850930e+05 6.297574e+05 4.154243e+05 1.026257e+06 5.451185e+05 8.350422e+05 5.703417e+05 7.778242e+05 3.905634e+05 9.263586e+05 3.964902e+05 6.620954e+05 7.977962e+05 1.149501e+06 8.803521e+05 9.472767e+05 8.722836e+05 4.814647e+05 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1.017858e+06 1.961076e+06 6.858744e+05 1.238123e+06 1.723758e+06 5.979973e+05 9.678601e+05 1.159169e+06 1.443812e+06 5.996858e+05 6.286740e+05 9.170504e+05 6.912511e+05 9.289035e+05 4.924491e+05 1.157991e+06 8.319525e+05 7.163130e+05 9.289990e+05 5.019113e+05 8.462875e+05 8.386728e+05 1.144620e+06 1.400036e+06 1.113107e+06 1.414794e+06 1.071018e+06 8.914727e+05 7.992639e+05 6.762063e+05 8.757755e+05 1.427885e+06 1.299732e+06 1.627993e+06 1.075440e+06 1.194415e+06 7.517962e+05 1.265693e+06 1.316058e+06 6.206090e+05 8.928046e+05 1.433543e+06 6.076191e+05 7.084856e+05 5.900464e+05 6.246382e+05 6.804213e+05 1.071443e+06 1.387988e+06 2.000114e+06 1.641984e+06 1.160777e+06 1.888444e+06 2.203887e+06 1.272626e+06 1.266545e+06 2.254928e+06 1.332330e+06 4.637040e+05 1.565354e+06 7.141295e+05 3.025604e+06 3.410698e+05 3.641817e+05 3.652031e+05 5.119969e+05 1.641897e+06 1.667020e+06 1.725639e+06 C12 H24 O7_1.922 2.453073e+05 4.082646e+06 3.755728e+06 3.516962e+06 1.432856e+05 2.745370e+06 3.762215e+06 4.544214e+06 140149.56 3.191170e+06 4.018408e+06 4.132216e+06 188212.51 3.203436e+06 3.402731e+06 3.574018e+06 4.506019e+05 3.517243e+06 3.741369e+06 3.859525e+06 2.962859e+05 3.132745e+06 3.579661e+06 4.806096e+06 249663.922 3.232381e+06 3.673940e+06 3.181069e+06 2.553787e+05 3.817517e+06 3.415085e+06 4.309989e+06 230268.69 3.698430e+06 3.612884e+06 2.851867e+06 2.640160e+05 3.740710e+06 3.978607e+06 3.743382e+06 1.927154e+05 3.314704e+06 4.163125e+06 4.449243e+06 9.160800e+04 2.782360e+06 3.611450e+06 3.669096e+06 1.858395e+06 2.659904e+06 7.778719e+05 2.317333e+06 1.197462e+06 3.342562e+06 1.667871e+06 2.608771e+06 2.206359e+06 2.205066e+06 1.692332e+06 2.326873e+06 2.422097e+06 1.874185e+06 1.224046e+06 2.566958e+06 1.493708e+06 1.672674e+07 1.572418e+06 7.831331e+05 2.266068e+06 1.283162e+06 2.089135e+06 1.186429e+06 1.207876e+06 1.237344e+06 9.166521e+06 3.021303e+06 9.014042e+06 8.037795e+06 1.747533e+06 1.513545e+07 4.363912e+06 2.855397e+06 4.441454e+06 6.493763e+06 4.124808e+06 1.191104e+07 6.861768e+06 1.758804e+06 7.311652e+06 8.077818e+06 5.653657e+06 1.135949e+07 1.750650e+06 1.029378e+06 2.108778e+06 1.757885e+06 2.166879e+06 6.995881e+05 6.217327e+05 1.719040e+06 8.618565e+05 1.472374e+06 6.933800e+05 1.692543e+06 1.920199e+06 1.543754e+06 1.205421e+06 1.375251e+06 1.835234e+06 1.271727e+06 3.337685e+06 2.030055e+06 2.022547e+06 9.730451e+05 1.121442e+06 6.425614e+05 2.878452e+06 1.807491e+06 1.131075e+06 2.177091e+06 6.167945e+05 1.094532e+06 8.185299e+05 9.467922e+05 5.919477e+05 1.174713e+06 2.350313e+06 9.086741e+05 1.334306e+06 1.309007e+06 2.852442e+06 1.505654e+06 2.762053e+06 3.968667e+06 2.138412e+06 1.859965e+06 2.600014e+06 2.723330e+06 1.509731e+06 2.935388e+06 1.345493e+06 2.552924e+06 2.818577e+06 2.668273e+06 1.276319e+06 2.094396e+06 2.867992e+06 1.110461e+06 1.967975e+06 4.168260e+06 3.826822e+06 7.445055e+06 5.418018e+06 2.201116e+06 1.678388e+06 1.060830e+06 2.204675e+06 2.095866e+06 2.654971e+06 1.512303e+06 1.185221e+06 1.779886e+06 2.081034e+06 3.611956e+06 8.070825e+06 4.329551e+06 2.065838e+06 4.179410e+06 2.872035e+06 3.253134e+06 7.391521e+06 2.329003e+06 2.509528e+06 2.760098e+06 5.697541e+06 4.683834e+06 1.457221e+06 1.797818e+06 1.689759e+06 1.800198e+06 4.812816e+06 1.122572e+07 2.839290e+06 1.132356e+07 1.961885e+06 2.948625e+06 4.360965e+06 1.684137e+06 4.529679e+06 6.222155e+06 1.495604e+07 3.595393e+06 3.098347e+06 1.447472e+06 1.093058e+07 2.050118e+06 7.436580e+06 1.481720e+07 6.798173e+06 1.596021e+07 6.652222e+06 1.812992e+07 2.240215e+06 8.570282e+06 9.192803e+06 2.973271e+06 5.855084e+06 1.880256e+06 9.466487e+06 7.616351e+06 1.711755e+06 2.721967e+06 6.891084e+06 9.100839e+06 1.124180e+06 8.340142e+06 1.976266e+07 4.532618e+06 4.470664e+06 5.056783e+06 6.726345e+06 4.923532e+06 1.186518e+06 3.633917e+06 2.793313e+06 3.960197e+06 2.430639e+06 2.108919e+06 3.494573e+06 1.597458e+06 2.051328e+06 6.825129e+06 4.750113e+06 1.281558e+06 3.072399e+06 4.827109e+06 1.030432e+07 3.253649e+06 2.625007e+06 3.002555e+06 3.725680e+07 1.982790e+06 2.391103e+06 3.888740e+06 3.856359e+06 4.645862e+06 1.779981e+06 1.925063e+06 4.882479e+06 4.001117e+06 5.500812e+06 2.776555e+06 2.028735e+06 2.875128e+06 7.246251e+06 4.171208e+06 5.300403e+06 2.805167e+06 3.595515e+06 1.374816e+06 2.679321e+06 2.239209e+06 C10 H32 N9 O P_1.923 9.722560e+04 1.017466e+06 1.339179e+06 1.652126e+06 2.177857e+04 1.714427e+06 1.134732e+06 1.523954e+06 31808.69 1.387480e+06 1.191395e+06 1.585454e+06 35001.35 1.272712e+06 1.589546e+06 1.102474e+06 2.880388e+05 1.410987e+06 1.297152e+06 1.599851e+06 8.208946e+04 1.271158e+06 1.608223e+06 1.246232e+06 72273.186 1.316951e+06 1.298334e+06 1.530396e+06 5.781593e+04 1.450070e+06 1.496282e+06 1.461196e+06 60530.28 1.167938e+06 1.051220e+06 1.393205e+06 5.647549e+04 1.449813e+06 1.440350e+06 1.673691e+06 3.528872e+04 1.091716e+06 1.876987e+06 1.544891e+06 4.578350e+04 7.439244e+05 1.360846e+06 1.478402e+06 1.065719e+06 1.212391e+06 7.118185e+05 9.942839e+05 5.770060e+05 9.055729e+05 8.261122e+05 8.656729e+05 1.132638e+06 7.139128e+05 1.234527e+06 2.078389e+06 1.945885e+06 1.456069e+06 1.503727e+06 1.572961e+06 1.801749e+06 1.862210e+06 1.842287e+06 9.628752e+05 1.288405e+06 1.582429e+06 1.671730e+06 1.626164e+06 1.715284e+06 2.341526e+06 1.615623e+06 1.339967e+06 1.630997e+06 1.781993e+06 4.366900e+05 1.792787e+06 1.338534e+06 1.327105e+06 1.062348e+06 1.971177e+06 1.297347e+06 1.919431e+06 1.536935e+06 7.771733e+05 1.429709e+06 1.928412e+06 2.245866e+06 1.497014e+06 1.299867e+06 1.171067e+06 1.650989e+06 1.297926e+06 2.402322e+06 7.491900e+05 1.314987e+06 1.432950e+06 1.194924e+06 2.082019e+06 5.705182e+05 1.598090e+06 1.955624e+06 1.769119e+06 1.373103e+06 2.264308e+06 7.443330e+05 7.763010e+05 1.349075e+06 2.567841e+06 1.607361e+06 9.332473e+05 1.067861e+06 8.407471e+05 1.547801e+06 9.964546e+05 8.661337e+05 1.861969e+06 8.231518e+05 9.668253e+05 1.142958e+06 1.287139e+06 1.101424e+06 7.894584e+05 1.437354e+06 9.036407e+05 1.088506e+06 1.167199e+06 1.179440e+06 4.683869e+05 1.163382e+06 1.584836e+06 1.623504e+06 1.153843e+06 1.039718e+06 1.900120e+06 1.186542e+06 2.083734e+06 5.500695e+05 2.201637e+06 2.559000e+06 4.316333e+05 8.946718e+05 1.252919e+06 1.462006e+06 1.424511e+06 1.734748e+06 3.178118e+06 1.827864e+06 2.902991e+06 2.047430e+06 9.528877e+05 1.060030e+06 8.833366e+05 1.940836e+06 2.170399e+06 2.961943e+06 1.190535e+06 1.858876e+06 1.197055e+06 5.162565e+05 7.056222e+05 1.492168e+06 8.848327e+05 7.017980e+05 7.987295e+05 8.138703e+05 7.586256e+05 8.060932e+05 8.628245e+05 1.490138e+06 9.958251e+05 1.482741e+06 1.224820e+06 1.394702e+06 1.482463e+06 2.296172e+06 1.837631e+06 5.371666e+06 1.025572e+06 9.173566e+05 3.780699e+06 1.000217e+06 9.059161e+05 9.228049e+05 9.907317e+05 3.198588e+06 9.574145e+05 4.354027e+06 1.255065e+06 5.896813e+05 1.275302e+06 6.584134e+06 4.834591e+05 3.852071e+06 5.064108e+06 9.074611e+05 3.529424e+06 4.345724e+06 5.418509e+06 7.209844e+05 8.763802e+05 1.091084e+06 7.739612e+05 9.820557e+05 5.274217e+05 1.704714e+06 2.441904e+06 8.307074e+05 8.665041e+05 9.833506e+05 1.203359e+06 8.626868e+05 1.369454e+06 6.256009e+06 1.887007e+06 1.581141e+06 7.955990e+05 1.522865e+06 8.164561e+05 3.965443e+05 1.052772e+06 1.203698e+06 1.690789e+06 1.763540e+06 1.204965e+06 1.094930e+06 1.047008e+06 1.259622e+06 1.503253e+06 1.041468e+06 7.466960e+05 1.648140e+06 1.552499e+06 1.842250e+06 1.145429e+06 9.622669e+05 7.947646e+05 1.823811e+06 1.268858e+06 2.041076e+06 1.650638e+06 1.432534e+06 1.883267e+06 2.107750e+06 1.542578e+06 2.121604e+06 2.956461e+06 1.712876e+06 9.661344e+05 1.789021e+06 9.334057e+05 3.618992e+06 4.172065e+05 5.238453e+05 9.084022e+05 6.745983e+05 1.634138e+06 2.396598e+06 1.809571e+06 C8 H6 N6 O5 P2 S_1.923 4.725631e+04 1.004099e+06 9.560175e+05 8.860977e+05 2.763175e+04 5.149829e+05 8.319961e+05 1.071130e+06 27732.04 8.362745e+05 9.975535e+05 9.451571e+05 27040.04 7.540994e+05 9.061780e+05 8.327682e+05 3.734218e+04 7.177975e+05 8.483309e+05 9.472543e+05 6.354683e+04 8.250470e+05 8.850840e+05 1.052792e+06 39425.007 7.998805e+05 8.827273e+05 8.667455e+05 4.514079e+04 8.514087e+05 7.404934e+05 1.070254e+06 46534.11 7.381203e+05 9.185506e+05 8.246200e+05 4.741457e+04 8.756724e+05 9.626392e+05 8.881700e+05 3.244939e+04 7.126100e+05 8.390995e+05 1.200608e+06 1.826754e+04 7.845449e+05 8.372121e+05 7.902316e+05 1.646084e+06 2.025907e+06 3.241465e+05 1.076750e+06 3.922281e+05 1.886705e+06 8.782748e+04 1.259407e+05 4.761280e+05 8.879939e+04 7.502837e+05 1.302060e+06 5.622152e+05 6.557825e+04 7.771427e+05 3.880705e+05 2.664347e+05 4.008863e+05 7.861179e+05 9.920660e+04 4.165895e+05 8.996239e+05 1.538606e+05 6.721657e+04 8.182523e+05 3.836058e+05 3.628732e+05 5.750109e+04 5.006276e+05 2.302788e+05 4.636727e+04 3.399812e+05 8.611376e+04 5.289155e+05 3.048225e+05 2.453765e+05 1.022063e+05 2.982288e+05 2.455652e+05 4.056767e+04 2.343804e+05 1.085761e+05 4.580147e+05 4.233934e+05 8.761520e+05 6.710862e+04 8.633995e+04 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9.166718e+05 2.883435e+05 1.900301e+05 5.132982e+05 1.451022e+05 2.948077e+05 9.298853e+04 8.976249e+04 8.435349e+04 6.494396e+05 1.207658e+06 1.314530e+06 1.383789e+06 C22 H48 N9 P S_1.924 5.858609e+04 1.106124e+06 1.093544e+06 1.064717e+06 3.587932e+04 8.712268e+05 1.144228e+06 1.217628e+06 39038.41 1.009172e+06 1.055420e+06 1.201394e+06 37976.81 9.726328e+05 9.729449e+05 1.008560e+06 1.400139e+05 1.127869e+06 8.775021e+05 1.221078e+06 7.664838e+04 1.059400e+06 1.078671e+06 1.284114e+06 67767.982 9.393003e+05 1.027210e+06 9.823171e+05 6.099708e+04 1.165800e+06 9.345356e+05 1.287362e+06 66348.05 9.093953e+05 1.134574e+06 8.339187e+05 6.726054e+04 1.013445e+06 1.274532e+06 1.023472e+06 5.010604e+04 1.135000e+06 1.034514e+06 1.279943e+06 2.292182e+04 9.147079e+05 9.008469e+05 1.161571e+06 5.504635e+05 7.443464e+05 5.076956e+05 1.109450e+06 6.509458e+05 6.093902e+05 9.296525e+05 7.019963e+05 9.363395e+05 8.566732e+05 1.025938e+06 1.007974e+06 1.654042e+06 1.318695e+06 1.132876e+06 1.232956e+06 1.120626e+06 1.063954e+06 1.520205e+06 7.752302e+05 1.154309e+06 1.356826e+06 1.590911e+06 1.335527e+06 1.730873e+06 1.665790e+06 8.222075e+05 1.127004e+06 1.037744e+06 1.174350e+06 5.101452e+06 1.185879e+06 8.995566e+05 9.943624e+05 4.694934e+05 1.241549e+06 5.978019e+05 9.456032e+05 6.805072e+05 4.014241e+05 7.840128e+05 1.091362e+06 1.734947e+06 1.107480e+06 1.225085e+06 8.797209e+05 1.289482e+06 8.798666e+05 1.792784e+06 3.916040e+05 8.111364e+05 9.979459e+05 7.751342e+05 1.416972e+06 3.013212e+05 1.096662e+06 1.244179e+06 1.278862e+06 8.010095e+05 1.357001e+06 4.865741e+05 4.913453e+05 7.067108e+05 1.719978e+06 1.333870e+06 6.487175e+05 6.869025e+05 2.687279e+05 8.778459e+05 5.433394e+05 4.361449e+05 1.021119e+06 2.731283e+05 3.318689e+05 2.667327e+05 7.679696e+05 3.860015e+05 5.545743e+05 1.465613e+06 3.301603e+05 5.633358e+05 8.390260e+05 9.398914e+05 4.306016e+06 5.534843e+05 9.446917e+05 8.803933e+05 8.961196e+05 7.892193e+05 1.334603e+06 7.536059e+05 1.082185e+06 4.438452e+05 1.701843e+06 1.471115e+06 3.898476e+05 8.062033e+05 1.020108e+06 1.037677e+06 1.353348e+06 1.550964e+06 1.671403e+06 1.393721e+06 1.561509e+06 1.312318e+06 8.999296e+05 5.863240e+05 6.269456e+05 2.011518e+06 1.222268e+06 1.682215e+06 8.359677e+05 1.133673e+06 9.281848e+05 5.544102e+05 4.569129e+05 1.111837e+06 4.369419e+05 4.503734e+05 3.708800e+05 5.672396e+05 6.015265e+05 5.848971e+05 3.975190e+05 8.349462e+05 5.063362e+05 8.393040e+05 9.669968e+05 1.248237e+06 1.176172e+06 1.498251e+06 1.316963e+06 3.300232e+06 6.668503e+05 7.013055e+05 2.807421e+06 8.008261e+05 9.994654e+05 7.362067e+05 7.234623e+05 2.671773e+06 5.520015e+05 2.640209e+06 1.501043e+06 4.994575e+05 8.187159e+05 3.230868e+06 3.740318e+05 2.318883e+06 3.580030e+06 4.820170e+05 1.778175e+06 3.238008e+06 3.334717e+06 6.419855e+05 6.361461e+05 9.559399e+05 6.808983e+05 8.721246e+05 3.774574e+05 1.396778e+06 1.732882e+06 5.034244e+05 8.133606e+05 6.752576e+05 9.325751e+05 5.709899e+05 1.008547e+06 3.309317e+06 1.137722e+06 1.158760e+06 7.876166e+05 1.220097e+06 6.804672e+05 3.313947e+05 5.919549e+05 9.014750e+05 1.208737e+06 1.120374e+06 7.758765e+05 1.063672e+06 9.482915e+05 8.242489e+05 1.483271e+06 1.200426e+06 6.778236e+05 1.071876e+06 1.174074e+06 1.561887e+06 1.238414e+06 7.631367e+05 6.950300e+05 2.522189e+06 7.879520e+05 1.082066e+06 1.237782e+06 9.632418e+05 1.076982e+06 1.205584e+06 7.687199e+05 1.039282e+06 1.458374e+06 8.931485e+05 8.882615e+05 1.094511e+06 7.422361e+05 1.864893e+06 2.431754e+05 5.001828e+05 8.479650e+05 5.221311e+05 1.044676e+06 1.095630e+06 1.351209e+06 C11 H22 N6 O4_1.924 3.068541e+04 6.460095e+05 5.974825e+05 7.975210e+05 1.838716e+04 4.661606e+05 6.218368e+05 7.832124e+05 21393.34 6.019581e+05 8.769854e+05 6.359247e+05 23943.21 4.555308e+05 5.427589e+05 7.522747e+05 3.381689e+04 4.617704e+05 7.598014e+05 7.922584e+05 5.613539e+04 3.755574e+05 7.633669e+05 9.434442e+05 36195.916 3.935770e+05 7.288979e+05 5.413006e+05 3.369809e+04 5.126031e+05 6.780266e+05 8.169312e+05 44957.75 4.510133e+05 8.675715e+05 7.666662e+05 5.207268e+04 4.235473e+05 6.887293e+05 6.473354e+05 3.954341e+04 4.475031e+05 8.079411e+05 7.859057e+05 1.910112e+04 4.441798e+05 5.620980e+05 7.494840e+05 4.046034e+05 6.351822e+05 3.454741e+05 5.268466e+05 3.220868e+05 4.825178e+05 3.662614e+05 3.472715e+05 4.701882e+05 3.458780e+05 5.447019e+05 5.708932e+05 9.270444e+05 6.904362e+05 6.259663e+05 7.747841e+05 9.130372e+05 8.967913e+05 1.075439e+06 5.255057e+05 6.711387e+05 7.136272e+05 1.105154e+06 7.206971e+05 8.322255e+05 1.125859e+06 7.568561e+05 7.657800e+05 7.783397e+05 7.504749e+05 1.463999e+05 9.503365e+05 7.192326e+05 6.114110e+05 5.533257e+05 8.077134e+05 6.477393e+05 9.698709e+05 5.314372e+05 3.838305e+05 7.154644e+05 9.552495e+05 1.224946e+06 1.032368e+06 6.588066e+05 6.824573e+05 1.057739e+06 5.936329e+05 1.418955e+06 3.453481e+05 7.485860e+05 6.132595e+05 4.756102e+05 8.171543e+05 2.160558e+05 8.474544e+05 8.375814e+05 9.440454e+05 6.513035e+05 8.578133e+05 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3.854519e+05 2.721485e+07 5.737360e+06 7.452090e+05 5.525180e+05 1.010924e+07 1.336034e+07 4.279916e+07 3.658498e+07 2.844353e+08 4.385110e+07 1.437256e+08 2.510500e+08 1.248621e+08 3.222657e+08 2.411436e+08 4.062258e+06 6.095860e+08 7.964469e+07 9.670943e+07 2.741891e+06 5.910385e+04 1.010966e+05 1.090165e+08 9.440221e+08 3.695861e+05 7.995323e+04 1.534522e+07 2.238748e+05 5.640479e+06 1.491876e+06 C29 H57 N5 O3 S2_1.926 6.592634e+04 1.910428e+06 1.453203e+06 1.452056e+06 3.890379e+04 1.536114e+06 1.730255e+06 1.764957e+06 42075.86 1.537488e+06 1.692546e+06 1.891298e+06 41298.10 1.501182e+06 1.671605e+06 1.406538e+06 5.555045e+04 1.443487e+06 1.833065e+06 1.611077e+06 9.278531e+04 1.394267e+06 1.616871e+06 2.114315e+06 74646.514 1.514874e+06 1.603665e+06 1.366953e+06 6.168417e+04 1.706343e+06 1.702355e+06 1.795917e+06 65187.53 1.548633e+06 1.560906e+06 1.380435e+06 7.037283e+04 1.747423e+06 1.657836e+06 1.811300e+06 5.636639e+04 1.546227e+06 1.779100e+06 1.725233e+06 2.622094e+04 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1.645981e+06 2.500940e+06 2.757874e+06 1.681846e+06 1.416930e+06 1.611219e+06 1.632545e+06 1.735733e+06 1.014979e+06 2.505718e+06 2.623393e+06 1.421733e+06 9.704760e+05 1.271671e+06 1.308970e+06 1.732430e+06 2.296640e+06 1.740114e+06 2.485195e+06 2.882234e+06 2.120233e+06 1.905591e+06 1.402028e+06 1.171454e+06 1.681088e+06 3.090446e+06 2.743862e+06 1.774840e+06 2.134584e+06 2.613815e+06 1.311196e+06 2.121980e+06 2.436991e+06 1.468917e+06 1.956659e+06 1.886584e+06 1.338462e+06 1.580055e+06 1.425330e+06 1.848130e+06 1.280067e+06 1.934535e+06 2.831284e+06 2.364354e+06 2.903813e+06 2.689267e+06 2.500235e+06 4.474388e+06 2.359860e+06 3.457037e+06 4.907540e+06 3.328979e+06 8.872296e+05 3.396790e+06 1.581616e+06 6.799461e+06 7.444510e+05 7.719242e+05 8.652926e+05 1.114431e+06 3.398997e+06 3.533693e+06 3.739441e+06 C18 H33 N P2_1.927 4.108054e+04 7.918990e+05 7.660945e+05 8.313203e+05 2.567889e+04 8.422010e+05 5.890509e+05 8.295141e+05 37615.55 7.865684e+05 7.241585e+05 9.207750e+05 39907.54 6.847970e+05 7.745097e+05 9.204681e+05 8.495328e+04 7.380980e+05 7.449365e+05 8.611634e+05 1.039356e+05 6.970000e+05 7.880306e+05 7.327339e+05 92461.577 7.193193e+05 7.198991e+05 6.959519e+05 6.223950e+04 8.717360e+05 1.013368e+06 9.059474e+05 61911.46 6.526571e+05 6.006191e+05 6.428068e+05 6.476934e+04 9.131348e+05 7.063251e+05 8.246114e+05 4.735711e+04 7.329818e+05 9.282194e+05 7.995351e+05 2.239986e+04 8.430620e+05 7.006592e+05 7.087724e+05 2.965258e+05 5.083547e+05 1.103662e+05 3.775952e+05 1.761625e+05 5.224083e+05 2.574476e+05 4.554080e+05 5.342751e+05 3.878565e+05 3.088395e+05 6.200672e+05 3.882271e+05 3.746232e+05 2.082660e+05 5.652047e+05 3.497056e+05 3.382210e+06 3.719093e+05 7.474409e+04 3.713158e+05 1.886828e+05 2.923229e+05 1.701273e+05 1.352846e+05 3.856357e+05 2.037179e+06 6.551773e+05 1.727902e+06 1.989283e+06 5.830407e+05 3.193229e+06 8.738833e+05 5.378659e+05 9.936187e+05 1.183972e+06 9.215407e+05 3.046382e+06 2.074631e+06 2.482016e+05 1.984622e+06 1.987722e+06 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6.023240e+05 6.569944e+05 4.505890e+05 3.560463e+05 8.883132e+05 1.004885e+06 1.122135e+06 5.533971e+05 4.533059e+05 5.051455e+05 1.383094e+06 7.583341e+05 8.976656e+05 6.631105e+05 6.565985e+05 3.724185e+05 6.215979e+05 4.664525e+05 81.04451_1.927 1.190415e+05 1.001699e+05 1.556945e+05 1.602611e+05 2.543418e+04 5.953737e+04 1.644972e+05 2.216387e+05 30972.91 8.201477e+04 1.404002e+05 1.221181e+05 33320.60 1.394739e+05 1.611068e+05 1.384055e+05 1.510629e+05 1.119258e+05 1.688265e+05 1.288484e+05 6.459273e+04 1.567818e+05 1.806722e+05 1.686573e+05 61990.778 9.080791e+04 1.326766e+05 1.624989e+05 5.624948e+04 1.469047e+05 1.140726e+05 1.845777e+05 60889.70 1.212664e+05 1.609787e+05 1.099666e+05 6.427893e+04 1.522371e+05 1.419871e+05 1.686987e+05 5.157538e+04 1.590667e+05 1.116948e+05 1.284113e+05 2.463037e+04 1.766668e+05 1.403192e+05 1.406384e+05 1.136009e+05 2.756052e+05 8.881076e+04 1.550496e+05 3.563398e+05 9.702103e+04 1.192477e+05 3.946888e+05 1.394657e+05 1.907923e+05 1.159284e+05 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3.705737e+05 37633.76 3.503967e+05 3.441472e+05 2.826947e+05 39092.71 2.637332e+05 2.500894e+05 3.296832e+05 5.283081e+04 2.411963e+05 3.176112e+05 3.274111e+05 8.569204e+04 3.245408e+05 2.811287e+05 3.492932e+05 76144.135 3.476347e+05 1.975294e+05 2.778816e+05 6.523671e+04 3.221153e+05 3.214511e+05 5.209445e+05 74314.82 1.818277e+05 2.774424e+05 2.633936e+05 9.322586e+04 2.316024e+05 2.311940e+05 3.178538e+05 6.557073e+04 3.636074e+05 4.234225e+05 3.208188e+05 3.152360e+04 2.412018e+05 2.550323e+05 3.115821e+05 1.233814e+05 1.369145e+05 2.041832e+05 1.320075e+05 1.367693e+05 1.471448e+05 1.976008e+05 3.448956e+05 1.853888e+05 9.763390e+04 1.386731e+05 1.641556e+05 1.348992e+05 1.232929e+05 1.204210e+05 1.411115e+05 1.449393e+05 1.903606e+06 1.273669e+05 1.100147e+05 1.211337e+05 1.814037e+05 8.952881e+04 1.230625e+05 2.132195e+05 1.233385e+05 9.693464e+05 1.369123e+05 9.437798e+05 7.666954e+05 7.965497e+05 1.712976e+06 3.231040e+05 1.881230e+05 4.547744e+05 5.137597e+05 3.321963e+05 1.626384e+06 8.222396e+05 9.056451e+04 7.514557e+05 7.288586e+05 4.408256e+05 1.035185e+06 2.042432e+05 7.455111e+04 2.224061e+05 1.037663e+05 1.471054e+05 9.787226e+04 1.315821e+05 8.781760e+04 1.082830e+05 1.624913e+05 1.347854e+05 1.966580e+05 1.720938e+05 1.423261e+05 1.238911e+05 2.401056e+05 8.246313e+04 1.121857e+05 2.445716e+05 1.117309e+05 1.673853e+05 1.360530e+05 1.269459e+05 9.750621e+04 1.355088e+05 1.128521e+05 1.067900e+05 1.498489e+05 1.011899e+05 1.120838e+05 1.135886e+05 1.090379e+05 8.840846e+04 1.373797e+05 1.555325e+05 1.578465e+05 1.048722e+05 1.099692e+05 1.492708e+05 9.275909e+05 1.709312e+05 1.221821e+05 1.519340e+05 1.429826e+05 1.500042e+05 2.347212e+05 1.044493e+05 1.358272e+05 1.833187e+05 2.194649e+05 1.716930e+05 1.162990e+05 1.110094e+05 1.188102e+05 1.331236e+05 1.070740e+05 8.942765e+04 2.153311e+05 8.737594e+04 4.653220e+05 2.095106e+05 2.766354e+05 1.719613e+05 8.711188e+04 1.741143e+05 9.374285e+04 1.344200e+05 1.310191e+05 1.674995e+05 1.607131e+05 9.428389e+04 1.382299e+05 9.214726e+05 2.660373e+05 1.455591e+05 1.315268e+05 1.190686e+05 2.941597e+05 5.175754e+05 1.358729e+05 1.227057e+05 1.042525e+05 3.231556e+05 3.250110e+05 1.167354e+05 1.956777e+05 1.246279e+05 1.191807e+05 6.179750e+05 1.252811e+06 1.297395e+05 1.402614e+06 1.162239e+05 1.933315e+05 1.254271e+05 1.731859e+05 4.357199e+05 4.375684e+05 1.839034e+06 2.657787e+05 1.424972e+05 1.974201e+05 1.079731e+06 1.046299e+05 7.912256e+05 2.720897e+06 5.448478e+05 9.829146e+05 9.503518e+05 1.753169e+06 1.948815e+05 4.966453e+05 7.870690e+05 1.312237e+05 3.557346e+05 1.037628e+05 1.022567e+06 5.576337e+05 2.000047e+05 1.743241e+05 7.274210e+05 7.005868e+05 2.979236e+05 5.548649e+05 3.175431e+06 4.116260e+05 2.020521e+05 4.353945e+05 4.007190e+05 2.542669e+05 1.888986e+05 1.210654e+05 1.808913e+05 1.793272e+05 1.814504e+05 1.200733e+05 3.231733e+05 1.931383e+05 2.839971e+05 5.554049e+05 2.684149e+05 1.144194e+05 1.969509e+05 5.799376e+05 5.932207e+05 2.148394e+05 9.785906e+04 1.772294e+05 7.916120e+06 1.825023e+05 1.406255e+05 3.093806e+05 2.657175e+05 6.665442e+05 1.126257e+05 1.777816e+05 4.167408e+05 3.141031e+05 5.919847e+05 3.011222e+05 1.333363e+05 2.285291e+05 5.978007e+05 3.552575e+05 5.870026e+05 2.222727e+05 2.656788e+05 1.426994e+05 1.293069e+05 3.494547e+05 C24 H36 O3_1.93 9.550518e+05 1.297651e+06 1.488051e+06 1.233572e+06 3.738208e+04 1.232592e+06 5.207144e+05 4.943307e+05 57370.85 1.104631e+06 1.505637e+06 1.761842e+06 48592.95 1.276315e+06 1.515811e+06 5.461815e+05 5.759827e+05 1.537132e+06 6.779712e+05 7.318627e+05 1.597221e+05 1.970179e+06 6.987423e+05 5.111392e+05 114473.892 1.948792e+06 1.157723e+06 1.581936e+06 5.662580e+04 1.426764e+06 5.015868e+05 2.317819e+06 113651.82 6.111263e+05 9.768461e+05 7.039099e+05 1.660856e+05 7.553475e+05 7.694133e+05 3.034643e+06 1.227356e+05 8.137150e+05 7.422389e+05 1.445013e+06 7.847888e+04 8.970308e+05 1.003429e+06 1.288017e+06 7.576348e+05 1.628932e+06 5.407591e+06 6.184588e+05 2.654375e+05 6.195591e+06 6.630226e+05 2.247965e+06 1.297740e+06 1.724746e+06 2.373371e+05 5.760134e+05 5.813921e+05 4.897546e+05 2.036105e+05 5.813811e+05 5.186043e+05 8.875652e+05 1.292182e+06 4.056599e+05 2.471704e+06 4.798404e+06 5.830750e+05 2.486203e+06 1.402384e+06 5.540922e+05 3.089713e+05 4.031125e+05 6.064442e+05 1.825382e+06 4.918574e+05 4.872431e+05 8.185031e+05 1.951827e+06 1.033262e+06 1.784328e+05 2.394199e+05 2.832367e+05 1.247844e+06 7.100499e+05 1.108517e+06 1.740173e+06 2.191208e+05 2.048459e+05 9.493170e+05 3.409110e+05 8.598221e+05 4.181589e+05 2.611968e+05 6.498718e+05 5.882214e+05 2.076374e+05 1.710954e+05 6.114275e+05 4.027910e+05 8.765071e+05 5.688366e+06 5.744790e+05 2.157034e+05 3.861434e+06 1.473904e+05 1.772499e+05 3.104532e+05 3.948720e+05 2.885487e+05 1.911436e+06 3.894937e+05 4.068543e+05 4.282238e+05 2.279164e+05 1.272300e+05 2.988068e+05 2.377940e+05 4.279461e+05 4.807468e+06 6.912878e+05 8.474606e+05 2.164465e+06 1.596852e+06 1.365243e+06 1.848680e+05 1.007832e+06 1.736235e+05 8.144257e+05 1.153949e+06 4.144966e+05 4.343992e+05 3.602656e+05 6.921600e+05 1.161719e+06 3.092195e+05 2.429261e+06 9.575442e+06 1.960121e+05 1.155092e+06 3.117892e+05 3.423082e+05 5.983643e+05 3.267506e+05 5.741248e+05 3.445314e+05 5.331436e+05 3.080651e+05 4.630487e+05 1.271355e+06 1.882134e+06 1.016397e+06 1.217205e+06 5.038564e+06 2.500090e+05 5.306830e+06 1.155766e+06 3.751565e+06 1.158111e+06 1.798169e+06 1.300722e+06 3.638616e+06 7.782848e+05 1.390467e+06 3.281557e+06 9.322082e+05 1.133695e+06 3.605812e+06 3.697654e+06 5.623798e+05 1.995703e+05 2.637810e+06 1.137776e+06 2.678430e+06 9.861084e+05 2.620203e+06 1.733327e+06 5.294212e+05 7.040867e+05 1.899797e+06 3.045889e+06 1.400299e+06 1.047736e+06 9.300608e+05 7.114519e+05 3.613897e+05 2.406590e+05 6.611230e+06 3.119443e+05 4.663970e+06 5.566635e+05 9.072493e+06 3.494879e+06 1.025532e+07 4.471753e+06 1.146937e+06 5.164793e+06 8.696273e+06 2.179500e+06 3.816168e+05 1.593649e+05 1.501586e+06 2.879969e+05 4.168459e+05 9.191435e+05 2.956544e+06 1.159148e+06 1.498490e+06 3.117333e+05 1.237962e+06 1.688450e+06 2.666997e+06 6.416301e+05 1.910194e+07 5.316535e+05 1.171233e+06 8.214265e+05 3.499719e+05 8.083089e+05 5.337269e+05 6.421355e+05 1.436198e+06 2.355511e+05 3.624674e+06 7.671149e+05 1.641464e+06 1.765167e+05 1.758678e+06 3.744973e+05 1.809450e+06 1.938682e+06 3.153188e+05 2.252452e+06 3.321940e+06 2.320465e+05 9.792833e+05 8.422200e+05 2.513016e+06 4.605948e+05 3.500720e+05 9.479773e+05 1.396138e+06 4.426361e+05 2.703881e+05 2.468987e+05 8.914464e+05 2.653983e+05 2.027665e+05 1.767525e+05 1.846145e+06 1.533753e+06 2.358404e+05 2.633133e+05 6.544781e+05 7.956100e+06 9.602367e+06 3.165647e+05 1.872619e+05 1.859898e+06 Nicotinuricacid_1.931 3.426983e+06 5.936685e+06 5.367869e+06 5.870420e+06 7.340024e+04 3.872245e+06 6.132463e+06 6.350833e+06 72094.88 4.882119e+06 5.894945e+06 6.098107e+06 67059.72 4.823858e+06 5.252398e+06 5.476505e+06 7.160947e+04 5.417548e+06 5.325966e+06 5.812466e+06 1.432629e+05 4.737687e+06 5.929726e+06 6.864501e+06 125537.419 4.828071e+06 5.171539e+06 5.187137e+06 8.087199e+04 5.192583e+06 5.477585e+06 6.579618e+06 112211.11 5.049800e+06 5.631156e+06 5.158267e+06 1.226939e+05 4.983087e+06 5.989432e+06 5.705206e+06 9.976378e+04 4.779417e+06 5.840624e+06 7.366953e+06 4.656001e+04 3.937957e+06 5.460691e+06 5.379297e+06 4.900908e+06 8.048514e+06 4.505443e+06 8.492702e+06 5.446997e+06 5.071665e+06 9.604820e+06 1.150481e+07 5.871130e+06 7.270361e+06 1.118120e+07 6.341011e+06 9.816192e+06 1.007390e+07 1.207438e+07 1.387479e+07 1.020995e+07 6.127593e+06 5.741524e+06 5.735728e+06 7.974909e+06 6.110686e+06 7.511434e+06 8.788223e+06 9.708065e+06 1.027399e+07 7.485660e+06 4.367919e+06 5.805948e+06 5.185149e+06 1.966833e+06 4.974560e+06 5.462730e+06 9.950013e+06 6.216690e+06 6.898006e+06 4.599290e+06 5.439099e+06 3.042896e+06 4.209326e+06 4.374399e+06 3.412375e+06 1.069307e+07 5.197750e+06 9.295834e+06 4.666055e+06 6.820366e+06 7.309884e+06 1.009769e+07 3.180712e+06 3.236074e+06 5.473298e+06 5.165844e+06 8.092799e+06 3.157367e+06 2.805801e+06 5.387280e+06 7.501973e+06 4.836686e+06 8.887769e+06 3.497443e+06 6.659846e+06 6.469009e+06 1.338423e+07 9.355506e+06 5.980949e+06 5.516322e+06 3.908146e+06 1.094808e+07 4.410497e+06 3.939481e+06 5.496298e+06 3.034576e+06 4.452782e+06 2.567371e+06 5.868335e+05 4.827887e+06 4.409261e+06 1.145175e+07 4.394720e+06 3.718369e+06 7.922199e+06 8.168473e+06 7.847704e+05 3.734485e+06 4.961663e+06 3.997038e+06 3.658859e+06 6.547002e+06 5.849936e+06 3.829205e+06 8.853945e+06 4.788229e+06 3.477332e+06 9.161098e+06 4.811729e+06 3.585823e+06 3.838375e+06 3.217375e+06 6.965608e+06 1.237640e+06 9.504284e+06 7.814410e+06 1.092660e+07 6.089198e+06 5.937799e+06 3.417167e+06 4.534188e+06 1.838471e+07 1.466310e+07 2.582680e+07 4.138205e+06 4.634925e+06 9.758675e+06 4.230992e+06 7.154369e+06 9.101378e+06 5.303978e+06 8.665155e+06 7.545342e+06 7.157410e+06 8.217422e+06 5.412766e+06 8.385598e+06 6.040032e+06 7.565821e+06 5.222691e+06 7.338125e+06 6.206621e+06 4.586991e+06 1.332828e+07 7.368754e+06 1.932479e+06 1.793516e+06 4.128565e+06 5.977146e+06 2.213905e+06 3.123399e+06 3.504140e+06 4.951037e+06 9.259297e+06 4.616034e+06 5.144890e+06 2.336970e+06 8.766802e+06 6.262225e+06 2.043578e+06 5.270034e+06 6.627650e+06 3.057975e+06 4.784206e+06 1.016610e+07 1.083016e+07 1.023324e+07 6.712898e+06 3.359765e+06 3.682479e+06 2.723340e+06 6.604454e+06 3.942880e+06 1.080114e+07 3.833519e+06 3.686265e+06 3.828782e+06 4.779777e+06 3.444001e+06 3.846078e+06 5.405812e+06 1.487453e+07 1.145460e+07 7.449071e+06 6.605023e+06 7.186247e+06 3.123034e+06 4.719647e+06 5.758547e+06 4.557551e+06 1.055480e+07 9.928981e+06 2.673285e+06 8.078746e+06 3.225672e+06 6.521740e+06 2.211841e+06 2.318974e+06 5.253412e+06 7.623067e+06 4.069306e+06 5.229104e+06 3.322056e+06 8.495626e+06 5.353546e+06 1.407114e+07 3.881134e+06 9.434430e+06 7.013336e+06 5.060293e+06 9.054647e+06 1.322343e+07 6.309051e+06 9.126647e+06 1.501997e+07 6.262166e+06 5.563080e+06 6.207095e+06 7.380504e+06 8.077869e+06 4.085060e+06 3.517328e+06 3.967818e+06 2.482660e+06 6.093435e+05 7.258374e+06 7.840954e+06 C9 H15 N O2_1.932 5.299805e+05 1.114583e+06 1.063550e+06 1.181568e+06 4.196033e+04 7.052641e+05 9.125196e+05 9.563775e+05 149050.23 6.566570e+05 7.307637e+05 6.178288e+05 109075.50 1.479784e+06 1.488382e+06 1.520868e+06 7.054026e+05 4.434303e+05 6.231529e+05 7.219464e+05 8.311247e+04 7.882474e+05 8.823016e+05 1.006363e+06 51421.876 1.082764e+06 1.282122e+06 1.128765e+06 3.196547e+04 7.596665e+05 8.119814e+05 1.089902e+06 73946.32 8.876618e+05 9.440470e+05 8.978290e+05 1.193862e+05 9.491262e+05 1.037796e+06 1.042884e+06 9.338661e+04 8.242316e+05 9.891254e+05 1.228551e+06 1.794461e+05 8.251957e+05 1.048206e+06 8.309857e+05 3.304907e+05 1.993097e+05 3.774316e+05 9.658224e+04 2.044004e+05 4.110941e+05 2.983907e+05 2.777436e+05 5.280938e+05 1.704046e+05 7.810425e+05 3.050644e+05 3.600275e+05 2.962488e+05 1.087168e+05 2.179216e+05 1.977307e+05 6.997134e+05 1.043154e+05 2.786191e+05 1.040069e+05 2.054409e+05 3.884330e+05 1.094340e+05 3.824213e+05 3.494221e+05 1.555385e+05 1.948668e+05 3.634671e+05 1.683880e+05 9.971354e+05 1.897852e+05 2.567563e+05 2.270167e+05 4.146187e+05 6.966420e+04 8.394338e+05 2.628049e+05 2.508917e+05 1.614335e+05 1.327855e+05 1.346841e+05 2.462166e+05 3.516367e+05 3.036925e+05 3.157883e+06 2.997194e+05 1.482070e+05 5.523355e+05 3.418340e+05 1.390860e+05 1.848145e+05 2.726237e+05 1.552301e+05 4.925475e+05 8.071080e+04 5.399579e+05 3.801508e+05 1.529449e+05 3.887739e+05 4.931167e+05 2.941044e+05 7.514496e+04 3.532525e+05 1.823968e+05 2.022238e+05 3.467823e+05 1.614147e+05 8.030195e+05 9.659559e+04 2.841506e+05 6.690856e+04 2.022829e+05 6.411045e+05 3.311562e+05 5.060885e+05 2.535657e+05 6.304282e+05 2.281042e+05 1.040787e+05 2.587022e+05 8.712351e+05 5.895606e+05 1.354878e+08 1.647108e+05 2.860240e+05 1.101100e+05 2.085488e+05 6.961531e+05 2.818371e+05 1.949437e+05 1.279729e+05 3.327046e+05 2.159890e+05 1.904800e+05 4.329849e+05 3.780174e+05 3.428294e+05 3.558196e+05 4.366456e+05 3.830280e+05 5.985985e+05 2.676886e+05 4.705446e+05 2.713673e+05 6.380989e+05 4.932224e+05 4.467367e+05 5.028432e+05 6.356283e+05 6.058689e+05 1.428012e+05 8.167051e+05 4.027408e+05 2.806589e+05 5.948004e+06 2.740018e+05 3.196388e+05 8.642881e+05 5.697552e+05 6.475192e+05 1.229507e+05 1.871837e+05 1.108721e+06 1.740002e+06 3.019343e+05 5.715951e+05 3.203816e+05 5.572486e+05 1.886839e+05 1.928215e+05 2.679142e+05 6.581982e+05 2.170760e+05 1.962618e+05 1.772028e+06 4.221621e+05 3.573353e+05 2.010916e+05 3.375870e+05 3.555768e+05 1.751936e+05 3.216292e+05 6.687223e+05 8.242848e+04 9.995468e+04 7.400819e+05 1.650750e+06 5.246528e+05 3.224964e+05 1.599917e+05 1.212045e+05 1.567230e+05 3.105597e+05 1.426628e+05 1.155211e+05 2.321317e+05 2.340784e+05 2.157823e+05 2.016515e+05 2.134373e+05 1.786998e+05 1.159204e+05 1.870319e+05 1.600832e+05 2.201498e+05 6.656399e+05 1.264186e+05 7.735769e+05 2.803259e+05 1.838601e+05 2.016681e+05 7.341481e+06 2.422598e+05 4.089441e+05 2.585811e+05 8.489242e+04 2.538693e+05 3.084644e+05 4.225614e+05 1.430353e+05 3.154676e+05 1.061186e+05 1.089695e+05 1.239457e+05 1.745680e+05 2.497097e+05 1.550407e+05 1.039136e+05 7.534893e+04 1.408615e+05 1.362695e+05 3.630343e+05 6.147589e+05 8.321102e+04 1.716189e+05 1.234349e+05 4.939993e+05 1.940539e+05 1.763061e+05 2.246980e+05 1.357978e+05 6.888267e+05 1.543346e+05 2.731577e+05 2.353839e+05 1.508668e+05 5.353877e+05 3.893147e+05 2.736923e+05 9.579554e+04 2.419768e+05 1.868539e+05 7.368556e+04 C19 H40 N9 P_1.932 6.584778e+05 4.466454e+05 4.196666e+05 3.710738e+05 2.100320e+04 1.851211e+05 2.720662e+05 4.669088e+05 27354.24 3.910323e+05 3.317367e+05 4.083883e+05 26334.05 2.501819e+05 4.453562e+05 3.393176e+05 3.103366e+04 2.465321e+05 4.607640e+05 3.496798e+05 5.826370e+04 2.582835e+05 3.901078e+05 5.185953e+05 48100.073 3.028783e+05 2.809117e+05 3.397648e+05 3.105058e+04 3.878616e+05 3.089305e+05 5.379375e+05 45193.38 2.620067e+05 3.312344e+05 2.735265e+05 5.235883e+04 4.338597e+05 3.214605e+05 3.774634e+05 4.037919e+04 2.805627e+05 4.858895e+05 4.667069e+05 1.803352e+04 2.478014e+05 2.521825e+05 4.193765e+05 5.249111e+04 9.795844e+05 1.049910e+06 9.728564e+04 1.155973e+05 2.635233e+06 4.347122e+05 1.021686e+05 7.754076e+05 1.094098e+06 2.673119e+05 3.007566e+05 1.882919e+05 1.285335e+05 1.199622e+05 1.403133e+05 3.598741e+05 1.472945e+05 8.196742e+05 5.925850e+04 1.022760e+06 2.558988e+06 3.792512e+05 2.430349e+05 3.434815e+05 3.359442e+05 2.183688e+05 2.239700e+05 1.995450e+05 6.100103e+04 3.524261e+05 1.839705e+05 7.261252e+05 3.367710e+05 4.523425e+05 1.323005e+05 5.033565e+04 6.871363e+04 2.533885e+05 5.362159e+05 4.646005e+05 1.172789e+06 7.419314e+04 1.026311e+05 7.171784e+05 1.344361e+05 2.948556e+05 1.197269e+05 2.292865e+05 1.635370e+05 1.599158e+05 1.214554e+05 6.898297e+04 4.612111e+05 2.699229e+05 3.907141e+05 3.031934e+06 3.694666e+05 6.220445e+04 2.542029e+06 1.138016e+05 1.641507e+05 1.718859e+05 4.223594e+05 1.580354e+05 7.042781e+05 1.747844e+05 2.937829e+05 1.933336e+05 1.131597e+05 9.091512e+04 1.603914e+05 7.526553e+04 9.327060e+04 1.800415e+06 5.185557e+05 4.399875e+05 1.045877e+06 9.271009e+05 1.623683e+05 1.444850e+05 1.599994e+05 6.086608e+04 3.516917e+05 1.239660e+05 2.063144e+05 3.211862e+05 1.177975e+05 6.906981e+04 6.180481e+05 2.519022e+05 2.148919e+05 3.138149e+06 9.424965e+04 1.398856e+06 9.616713e+04 2.893569e+05 4.530852e+05 1.800002e+05 3.849522e+05 2.346450e+05 4.235511e+05 4.022064e+05 1.964285e+05 9.808481e+05 1.518855e+05 6.484403e+05 1.064867e+05 1.866388e+05 1.921876e+05 2.327631e+05 9.723382e+04 7.059694e+05 5.622116e+05 8.523149e+05 2.152436e+05 1.375675e+05 1.716742e+05 7.746280e+04 4.215910e+05 2.984787e+05 4.523703e+05 1.696433e+06 1.222837e+06 1.315187e+05 1.324319e+05 2.039795e+05 1.497861e+05 1.736976e+06 5.771676e+05 5.475999e+05 2.398127e+05 6.506463e+05 1.153544e+05 9.168626e+05 5.189577e+05 5.734169e+05 3.510920e+05 1.012169e+05 1.211703e+05 4.574871e+05 1.096490e+05 5.171170e+05 3.018033e+05 1.420648e+06 2.295894e+05 8.607488e+05 1.742537e+06 4.882890e+05 5.581107e+05 1.162675e+05 7.703367e+05 4.470737e+06 1.595469e+06 8.003926e+04 8.580590e+04 5.907927e+04 1.288991e+05 8.791148e+04 2.650281e+05 3.067504e+05 2.489012e+05 9.940023e+04 7.822916e+04 2.950590e+05 4.417509e+05 8.328889e+04 2.339511e+05 8.633888e+05 1.806792e+05 1.478325e+05 2.412850e+05 7.629339e+04 6.495000e+04 5.362626e+04 1.503990e+05 7.772190e+04 2.095657e+05 1.140350e+05 6.812383e+04 8.220726e+04 7.975494e+04 3.863116e+05 1.039421e+05 9.551129e+04 4.837858e+05 7.697594e+04 8.654486e+04 1.380745e+06 1.182763e+05 6.174522e+04 7.397848e+04 1.569468e+05 2.435096e+05 8.159743e+04 8.646883e+05 1.649928e+05 1.175145e+05 2.031280e+05 1.378310e+05 4.206071e+05 2.650501e+05 1.157825e+05 1.029440e+05 3.196620e+05 1.617576e+05 2.721199e+05 9.738298e+04 1.055356e+05 3.360789e+06 3.974451e+06 2.170134e+05 1.769805e+05 1.024487e+05 Northienamycin_1.932 6.427034e+04 4.829368e+06 4.348967e+06 4.716748e+06 3.782718e+04 3.207489e+06 5.039128e+06 5.119984e+06 36931.78 3.934097e+06 4.696852e+06 5.006253e+06 34378.30 4.018415e+06 4.281917e+06 4.404300e+06 3.689302e+04 4.324542e+06 4.397543e+06 4.714511e+06 7.375130e+04 3.799097e+06 4.873251e+06 5.570195e+06 64227.238 3.879219e+06 4.159704e+06 4.277385e+06 4.035001e+04 4.251651e+06 4.422968e+06 5.383103e+06 56781.55 4.072531e+06 4.576978e+06 4.160695e+06 6.241534e+04 4.049048e+06 4.861134e+06 4.640170e+06 5.092506e+04 3.884612e+06 4.818788e+06 5.888517e+06 2.388135e+04 3.195110e+06 4.453090e+06 4.380286e+06 3.567208e+06 7.082966e+06 4.380668e+06 6.478309e+06 4.215517e+06 3.406429e+06 6.930871e+06 8.684188e+06 4.808944e+06 5.343661e+06 7.264939e+06 5.890453e+06 7.577912e+06 6.544754e+06 9.806542e+06 1.333348e+07 9.070932e+06 5.732843e+06 5.029798e+06 4.976284e+06 6.429720e+06 5.470413e+06 6.899254e+06 7.341165e+06 8.683061e+06 1.013525e+07 6.029865e+06 3.126845e+06 4.546546e+06 4.718381e+06 6.561604e+04 4.030511e+06 3.865537e+06 7.626157e+06 5.583720e+06 5.977181e+06 3.885281e+06 4.551201e+06 1.870587e+06 1.950175e+06 3.365968e+06 2.946677e+06 9.424424e+06 3.686199e+06 8.177534e+06 3.473094e+06 6.342526e+06 6.361034e+06 8.132697e+06 2.237101e+06 2.664688e+06 4.482463e+06 3.788319e+06 5.221949e+06 2.138023e+06 2.200600e+06 4.586256e+06 6.348213e+06 3.847796e+06 7.795483e+06 2.021076e+06 4.944923e+06 5.686233e+06 1.246254e+07 6.570864e+06 4.700220e+06 4.985145e+06 3.022124e+06 9.957178e+06 2.716599e+06 2.840628e+06 4.982196e+06 2.434048e+06 3.799109e+06 2.202385e+06 1.285710e+05 4.205141e+06 4.184275e+06 1.084893e+07 3.356923e+06 2.707698e+06 4.415342e+06 6.014054e+06 7.209203e+04 3.432661e+06 3.438550e+06 3.110445e+06 3.562661e+06 5.342357e+06 4.797626e+06 3.276250e+06 7.443475e+06 3.281661e+06 1.405075e+06 6.196274e+06 2.880064e+06 2.865015e+06 2.709949e+06 2.330362e+06 4.970255e+06 8.772538e+04 8.863174e+06 7.627682e+06 9.795474e+06 3.744572e+06 5.163728e+06 2.805946e+06 3.649392e+06 1.701590e+07 1.426695e+07 2.511247e+07 3.153871e+06 4.312145e+06 7.968776e+06 3.591030e+06 5.474597e+06 7.728175e+06 4.885314e+06 7.088773e+06 5.948472e+06 6.782560e+06 7.550121e+06 4.407721e+06 7.853913e+06 4.652790e+06 6.508862e+06 3.957380e+06 5.999377e+06 5.108566e+06 4.109794e+06 1.194276e+07 5.603280e+06 1.798606e+06 5.014378e+05 2.926206e+06 4.900927e+06 1.097004e+06 2.886804e+06 2.798445e+06 3.065350e+06 7.561505e+06 3.254315e+06 4.512199e+06 1.161496e+06 8.344706e+06 5.178258e+06 1.563179e+06 4.068143e+06 2.403438e+06 1.940311e+06 3.343019e+06 8.138823e+06 9.769045e+06 9.089825e+06 3.828013e+06 2.638094e+06 2.932510e+06 1.998431e+06 5.643444e+06 3.500500e+06 9.738298e+06 3.290510e+06 2.822406e+06 3.301890e+06 2.655320e+06 3.103972e+06 1.861563e+06 3.814042e+06 1.444323e+07 1.084219e+07 6.728926e+06 4.518974e+06 6.140834e+06 2.186258e+06 3.003132e+06 4.108387e+06 3.752805e+06 9.926347e+06 8.215320e+06 1.707722e+06 7.549315e+06 2.344472e+06 4.511409e+06 1.628974e+06 1.798364e+06 4.155386e+06 6.044466e+06 3.504141e+06 3.777924e+06 9.605531e+05 8.280095e+06 4.260842e+06 9.671437e+06 3.084982e+06 8.849784e+06 5.041493e+06 3.663103e+06 8.654257e+06 1.117963e+07 5.307028e+06 5.368417e+06 1.387197e+07 5.233661e+06 3.161824e+06 5.608026e+06 5.716817e+06 6.516860e+06 3.556815e+06 2.870657e+06 3.158911e+06 3.786584e+05 1.093502e+05 5.690227e+06 6.133314e+06 C16 H8 N3 O8 P3 S_1.935 7.631673e+04 4.523386e+06 4.132400e+06 4.830938e+06 4.154113e+04 2.472599e+06 4.825700e+06 5.066511e+06 32309.41 4.094652e+06 4.323126e+06 4.001934e+06 24568.76 4.075967e+06 4.824482e+06 4.392337e+06 2.674717e+04 3.830400e+06 3.564340e+06 3.664835e+06 5.241388e+04 6.062207e+06 4.222780e+06 4.456558e+06 46435.770 3.018488e+06 4.738249e+06 5.305007e+06 2.527096e+04 3.004010e+06 3.248134e+06 5.096178e+06 29835.48 5.251823e+06 3.645203e+06 3.547278e+06 3.167640e+04 5.667977e+06 3.618120e+06 3.562125e+06 3.305198e+04 4.746325e+06 3.865906e+06 5.624142e+06 1.955953e+04 3.954637e+06 4.873171e+06 2.889986e+06 4.290993e+06 3.732975e+06 4.391221e+06 1.889497e+06 3.467856e+06 4.307396e+06 1.240072e+06 4.597351e+06 1.815489e+06 1.085904e+06 1.622046e+06 3.267759e+06 1.564987e+06 2.106740e+06 3.590235e+06 2.771345e+06 2.468201e+06 3.862911e+06 2.946174e+06 1.110852e+06 1.484468e+06 3.049487e+06 3.148861e+06 1.730738e+06 4.260134e+06 3.362955e+06 1.462139e+06 3.742025e+06 2.871306e+06 2.001962e+06 4.139051e+04 2.660977e+06 2.055120e+06 2.350753e+06 1.210423e+06 1.616139e+06 1.266521e+06 2.577738e+06 4.087639e+06 5.927708e+05 1.551249e+06 1.068989e+06 1.234910e+06 3.418254e+06 3.748062e+06 1.238598e+06 9.684212e+05 3.030395e+06 2.173938e+06 4.238599e+06 5.472048e+06 2.998859e+06 1.179061e+06 3.076198e+06 3.679698e+06 4.198122e+06 1.397771e+06 1.111278e+06 1.269409e+06 9.312966e+05 9.354666e+05 1.641168e+06 1.880474e+06 7.074496e+05 1.515906e+06 2.979136e+06 4.070334e+06 2.582409e+06 1.588839e+06 5.302984e+06 1.227689e+06 7.524209e+05 2.398317e+06 1.633382e+06 1.646889e+06 2.235660e+06 1.657875e+06 1.870112e+06 9.190024e+05 1.179410e+05 2.485551e+06 2.763751e+06 1.898823e+06 3.842736e+04 1.660589e+06 1.248302e+06 1.734879e+06 2.152015e+06 2.329297e+06 1.836861e+06 2.033842e+06 1.402737e+06 1.049212e+06 1.809496e+06 2.062559e+06 1.152881e+06 2.767482e+06 1.383128e+06 3.968302e+06 1.873968e+06 2.330719e+06 9.791737e+05 5.581103e+05 6.824320e+05 9.956853e+05 7.063870e+05 1.289957e+06 1.212205e+06 4.847818e+05 3.089455e+05 7.081089e+05 8.893814e+05 7.010207e+05 7.743732e+05 2.085288e+06 1.420324e+06 2.726167e+06 3.085753e+06 4.824087e+06 5.582865e+06 2.540631e+06 3.727070e+06 4.443634e+06 4.384244e+06 3.050495e+06 1.312005e+06 5.595125e+06 3.013658e+06 9.677920e+05 2.265450e+06 6.229623e+05 4.431142e+06 3.288034e+06 1.101206e+07 7.652686e+06 1.148232e+06 8.180972e+06 5.181738e+06 7.236192e+06 4.842048e+06 1.404955e+05 3.976306e+06 1.639245e+05 9.861717e+06 4.729090e+06 3.956457e+06 3.057302e+06 7.168200e+06 1.132964e+06 1.598080e+06 1.692899e+06 7.936697e+04 1.996883e+05 9.540489e+05 2.037716e+06 6.592170e+06 1.005977e+07 8.688599e+06 6.230631e+06 6.949804e+06 8.251199e+06 9.903781e+06 4.564582e+06 5.538061e+06 5.111228e+06 5.372987e+06 1.395496e+07 3.948475e+06 6.214074e+05 3.776483e+06 9.195838e+06 9.664283e+06 7.236059e+06 8.102133e+06 7.181282e+06 7.208292e+06 8.820708e+06 5.502602e+06 3.555684e+06 6.262533e+06 7.980725e+06 8.790593e+06 8.229193e+06 6.101636e+06 5.215939e+05 9.992141e+06 7.619020e+06 3.677461e+06 1.127116e+07 4.341704e+06 3.801208e+06 3.731565e+06 2.549519e+06 5.084921e+06 6.311200e+06 3.718445e+06 7.127275e+06 5.065676e+06 2.830384e+06 9.717765e+05 1.495521e+06 3.647868e+06 3.820441e+06 1.891001e+06 5.964035e+06 2.338831e+06 2.970086e+06 1.725802e+06 1.664788e+06 1.419681e+06 3.519356e+06 5.180590e+06 2.169331e+06 4.041626e+06 C14 H28 O8_1.938 1.703952e+05 2.316875e+06 2.020136e+06 2.220587e+06 1.021816e+05 1.544833e+06 2.377589e+06 2.170846e+06 105821.83 2.033086e+06 2.408606e+06 2.182646e+06 140349.84 1.891823e+06 2.152255e+06 2.304608e+06 1.376111e+05 1.366164e+06 2.387255e+06 2.193051e+06 2.248190e+05 1.847720e+06 2.102893e+06 2.593084e+06 183483.069 2.161274e+06 1.705628e+06 1.923615e+06 1.119813e+05 2.142193e+06 2.294134e+06 2.481424e+06 160361.50 2.070821e+06 1.938485e+06 1.781149e+06 1.846846e+05 1.932129e+06 2.330604e+06 2.113038e+06 1.565524e+05 1.883402e+06 2.383792e+06 2.414354e+06 6.317047e+04 1.981904e+06 1.790519e+06 2.214580e+06 9.467944e+05 1.382570e+06 5.989883e+05 1.212976e+06 6.235601e+05 1.602316e+06 1.265468e+06 7.926768e+05 1.880900e+06 1.057175e+06 8.648842e+05 1.408615e+06 1.181935e+06 1.491315e+06 4.970043e+05 1.111022e+06 6.450340e+05 8.954380e+06 9.545172e+05 5.364631e+05 1.168762e+06 5.868884e+05 6.419441e+05 7.330023e+05 7.428881e+05 6.583452e+05 4.753246e+06 1.705834e+06 5.167934e+06 4.514889e+06 1.028976e+06 8.149648e+06 2.498732e+06 1.528487e+06 2.598055e+06 3.274114e+06 2.292716e+06 7.152094e+06 3.393992e+06 1.014794e+06 4.364215e+06 4.568615e+06 2.282995e+06 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1.558053e+06 1.506437e+06 3.930080e+06 1.277911e+06 1.273729e+06 1.536239e+06 2.574028e+06 1.856624e+06 6.489336e+05 6.676825e+05 9.101585e+05 6.984459e+05 2.763056e+06 4.582544e+06 1.489426e+06 6.994806e+06 9.046612e+05 1.578613e+06 2.356827e+06 8.450536e+05 2.866493e+06 2.681822e+06 8.151814e+06 1.784094e+06 1.120191e+06 9.822405e+05 6.813606e+06 1.125396e+06 4.279275e+06 9.482947e+06 3.811425e+06 9.339853e+06 3.737349e+06 8.982319e+06 9.926258e+05 3.767334e+06 4.018479e+06 1.548256e+06 2.424449e+06 8.620531e+05 6.543583e+06 2.463643e+06 9.583690e+05 1.361440e+06 3.808141e+06 4.363849e+06 6.931760e+05 3.476404e+06 1.764896e+07 2.208596e+06 2.500684e+06 2.400495e+06 3.683594e+06 2.577382e+06 6.758628e+05 1.646735e+06 1.340928e+06 2.142177e+06 1.518575e+06 1.312908e+06 1.950492e+06 6.605395e+05 8.852419e+05 3.391345e+06 2.296641e+06 6.838187e+05 1.459880e+06 2.867832e+06 5.291686e+06 1.201606e+06 1.186486e+06 1.449285e+06 2.634330e+07 1.091761e+06 1.324674e+06 2.047745e+06 1.941227e+06 2.453166e+06 9.789752e+05 9.347361e+05 2.698609e+06 2.362939e+06 3.030719e+06 1.984379e+06 1.154676e+06 1.590582e+06 4.042159e+06 2.401830e+06 2.925607e+06 1.832726e+06 1.982220e+06 7.715177e+05 1.472462e+06 2.065297e+06 1722018_1.938 4.187964e+05 3.927562e+07 3.408979e+07 3.793098e+07 2.189965e+05 3.349350e+07 3.681120e+07 4.026650e+07 241560.15 3.552834e+07 4.032347e+07 3.689134e+07 264794.27 3.182373e+07 3.667852e+07 4.321848e+07 2.717762e+05 3.706461e+07 4.176399e+07 1.800419e+07 3.585472e+05 3.420965e+07 4.123115e+07 4.190141e+07 149876.759 3.845142e+07 3.613881e+07 3.707074e+07 2.568651e+05 3.587783e+07 3.644074e+07 4.290410e+07 85694.21 3.307568e+07 4.053084e+07 3.905933e+07 2.809381e+05 2.183176e+07 3.844097e+07 3.883740e+07 2.971808e+05 3.555130e+07 3.978534e+07 4.126869e+07 3.398486e+04 3.473350e+07 3.783077e+07 3.371070e+07 3.164807e+07 3.878917e+07 1.787516e+07 3.541126e+07 2.551325e+07 3.221592e+07 2.762571e+07 4.917515e+07 3.942504e+07 4.169863e+07 3.922838e+07 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4.126775e+07 3.995161e+07 4.990202e+07 6.981489e+07 4.709729e+07 5.716094e+07 4.282446e+07 4.817970e+07 3.765472e+07 3.009738e+07 1.817253e+07 5.447529e+07 5.517274e+07 5.066811e+07 4.217100e+07 5.114788e+07 4.050028e+07 5.039804e+07 4.936225e+07 2.133395e+07 4.801702e+07 4.184967e+07 4.426355e+07 4.705438e+07 4.051750e+07 4.132958e+07 3.431976e+07 4.436132e+07 3.982762e+07 4.452636e+07 4.184371e+07 4.278764e+07 4.679878e+07 4.040043e+07 4.071257e+07 4.349830e+07 5.399231e+07 4.021661e+07 3.089110e+07 4.497182e+07 3.420072e+07 5.280875e+07 2.933565e+07 3.116530e+07 3.131854e+07 2.867971e+07 4.608349e+07 4.479389e+07 4.770368e+07 C10 H2 Cl N8 O2 P3_1.938 4.792431e+04 2.813088e+05 2.059793e+05 2.813586e+05 2.848920e+04 2.478898e+05 2.721205e+05 2.907038e+05 29948.84 2.807968e+05 3.084153e+05 2.821077e+05 29199.47 2.006806e+05 2.294454e+05 2.089830e+05 3.691052e+04 2.858796e+05 3.381376e+05 2.782576e+05 7.331242e+04 1.816717e+05 2.678135e+05 2.712817e+05 60268.800 3.509123e+05 2.038979e+05 1.857278e+05 3.547843e+04 3.032244e+05 2.949879e+05 3.297928e+05 46627.38 2.087651e+05 2.855727e+05 2.016352e+05 4.819268e+04 2.516612e+05 2.621751e+05 3.177067e+05 4.073032e+04 2.460163e+05 2.800668e+05 3.311011e+05 2.154364e+04 1.947243e+05 2.685903e+05 2.400199e+05 5.793803e+05 1.047340e+06 1.507349e+05 1.289372e+05 7.578478e+04 8.268517e+05 7.754250e+04 1.192891e+05 1.576929e+05 9.824558e+04 1.785738e+05 5.536248e+05 9.063716e+04 9.102352e+04 1.186255e+05 1.237443e+05 8.437312e+04 9.981108e+04 1.603906e+05 8.508781e+04 7.958841e+04 1.858898e+05 6.713279e+04 1.049897e+05 1.299849e+05 1.366292e+05 1.762184e+05 1.120579e+05 1.967186e+05 1.332854e+05 6.687680e+04 7.268050e+04 7.735749e+04 1.219255e+05 8.233629e+04 1.806322e+05 6.745288e+04 8.028227e+04 7.679702e+04 8.688269e+04 8.061581e+04 9.020370e+04 1.041725e+05 7.315087e+04 2.195852e+05 7.639427e+04 1.001222e+05 8.636703e+04 2.338731e+05 6.309859e+04 1.754661e+05 7.766817e+04 7.838573e+04 1.866134e+05 7.477975e+04 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7.132280e+04 8.982240e+04 2.127816e+05 5.692826e+05 5.672405e+05 C31 H41 N2 O10 P_1.939 1.839539e+05 1.676121e+06 1.328357e+06 1.387837e+06 7.740110e+04 1.025521e+06 2.197048e+06 2.429139e+06 55068.52 1.026137e+06 1.716196e+06 1.954027e+06 52569.17 9.626548e+05 1.752742e+06 1.875747e+06 6.825998e+04 1.007222e+06 1.407351e+06 1.873004e+06 1.290540e+05 9.311842e+05 1.710995e+06 3.036141e+06 101999.751 9.423260e+05 1.376355e+06 1.604646e+06 7.145364e+04 1.027364e+06 1.583368e+06 2.524259e+06 99101.72 9.935634e+05 1.680730e+06 1.792067e+06 1.790951e+05 1.042793e+06 1.630366e+06 2.188082e+06 8.967015e+04 9.658644e+05 1.687426e+06 2.546850e+06 3.809036e+04 8.406721e+05 1.288615e+06 1.771555e+06 2.097134e+05 1.965126e+05 1.889226e+05 5.384310e+05 1.625890e+05 2.796241e+05 9.587758e+05 3.583989e+05 1.570504e+05 2.927990e+05 2.744549e+05 2.868330e+05 3.046069e+06 1.329615e+06 8.766981e+05 2.021836e+05 1.195202e+06 2.386322e+05 2.171101e+05 1.200232e+06 2.287592e+05 3.116049e+05 2.276706e+06 8.650898e+05 2.185466e+05 4.744155e+05 1.929538e+05 2.206030e+05 5.042214e+05 2.802854e+05 1.999918e+06 2.775448e+05 2.908539e+05 2.210899e+05 3.194377e+05 4.482423e+05 1.306312e+06 2.184321e+05 1.293325e+05 1.327923e+05 1.442619e+05 7.691074e+05 5.704764e+05 3.416038e+05 1.827715e+05 1.866456e+05 1.729752e+05 3.050675e+05 2.441839e+05 1.173230e+06 4.125242e+05 6.834732e+05 1.886581e+05 1.812771e+05 8.502367e+05 1.585352e+05 4.477174e+05 1.719702e+05 1.826505e+05 2.258727e+05 2.228760e+07 2.250519e+05 2.168507e+05 4.461565e+05 1.592993e+05 3.362646e+05 3.637164e+05 2.366369e+05 2.280233e+05 1.496781e+05 2.441372e+05 2.556657e+06 1.693300e+05 1.752598e+05 1.454043e+05 1.682662e+05 1.232581e+05 1.753026e+05 1.832466e+05 1.851590e+05 3.498703e+05 1.659169e+06 4.255072e+05 1.290534e+05 1.191077e+05 5.068405e+05 5.843880e+05 2.736756e+05 2.547982e+05 1.581545e+05 1.600793e+05 1.196919e+06 1.548732e+05 1.913763e+05 2.571515e+05 2.726335e+05 2.179776e+05 3.022452e+05 1.712251e+05 1.977956e+05 1.439441e+05 2.091148e+05 1.724459e+05 2.787742e+05 1.631731e+05 6.311607e+05 2.032004e+05 2.118048e+05 5.786122e+05 8.973097e+05 1.232205e+06 4.816176e+05 2.347261e+05 3.246464e+05 2.798701e+05 1.570110e+05 2.116673e+05 1.316154e+06 6.582647e+05 3.203695e+05 1.550663e+05 1.726117e+05 9.269122e+05 2.081489e+05 1.864633e+05 1.911383e+05 2.042457e+05 3.174634e+05 5.452307e+05 3.620453e+05 3.216896e+05 2.026274e+05 2.488157e+05 1.778934e+05 1.999692e+05 3.214134e+05 1.753887e+05 2.698587e+05 3.330212e+05 2.083615e+05 1.068752e+06 1.936856e+05 3.141200e+05 1.983451e+05 2.195385e+05 2.364970e+05 1.027042e+06 5.865151e+05 1.986794e+05 4.840352e+05 6.538110e+05 3.267558e+05 6.614987e+05 2.294570e+05 1.959928e+05 7.458447e+05 2.015183e+05 4.825660e+05 4.866164e+05 1.739652e+05 7.602423e+05 3.373105e+05 7.555271e+05 1.749795e+05 1.406411e+05 2.478374e+05 2.003230e+05 5.148914e+05 2.422219e+05 4.876052e+05 1.169066e+06 1.586427e+06 3.006210e+05 2.149110e+05 4.039800e+05 1.531110e+05 1.875950e+05 8.551954e+05 3.539702e+05 1.687258e+05 2.002252e+05 2.252624e+05 5.256106e+05 2.758302e+05 2.186022e+05 1.775347e+05 7.909230e+05 2.097763e+05 3.306987e+05 1.931551e+05 4.091199e+05 4.369825e+05 7.953177e+05 2.183412e+06 2.047908e+05 7.538570e+05 3.779836e+05 1.288328e+06 9.951104e+05 1.922657e+06 2.308101e+05 2.443664e+05 1.100662e+06 1.324687e+06 7.821595e+05 4.874185e+05 1.784494e+06 3.111567e+06 9.487259e+05 3.412934e+06 1.449234e+05 1.826737e+05 7.138298e+05 1.902303e+06 C14 H9 N3 O4 S_1.939 3.383851e+06 7.787153e+05 5.834613e+05 6.437389e+05 4.623099e+04 5.420585e+05 1.024468e+06 6.685127e+05 26187.20 6.686234e+05 9.786088e+05 7.545817e+05 23257.82 6.120551e+05 7.034365e+05 7.904540e+05 2.691948e+04 6.201416e+05 5.916923e+05 7.111024e+05 5.054257e+04 8.947887e+05 7.451762e+05 7.533289e+05 41784.526 6.875579e+05 7.407683e+05 7.321298e+05 2.382118e+04 7.102114e+05 5.915276e+05 7.216032e+05 28891.93 9.461939e+05 6.493844e+05 5.453386e+05 2.922069e+04 9.611583e+05 7.132638e+05 6.049082e+05 2.657826e+04 7.667375e+05 5.896106e+05 9.296220e+05 1.325414e+04 9.054117e+05 6.766012e+05 5.549361e+05 1.427972e+06 9.313818e+05 6.334678e+05 3.839786e+05 1.284934e+06 2.382471e+06 3.464565e+05 3.066502e+06 2.016789e+06 2.025847e+06 1.710969e+06 9.861019e+05 5.718131e+05 4.265932e+05 1.075505e+06 6.779144e+05 1.202073e+06 4.033809e+05 2.261551e+05 6.573865e+05 9.584809e+05 2.773020e+05 2.403593e+05 2.863398e+05 1.208423e+06 4.307058e+05 1.073969e+06 5.946717e+05 5.607979e+05 3.282345e+06 1.707381e+05 2.349898e+05 7.549078e+05 1.105951e+05 4.759906e+05 1.223674e+06 1.143743e+06 4.388853e+05 1.819897e+05 3.973053e+05 2.043910e+06 3.581977e+05 5.044703e+05 5.012346e+05 4.774682e+05 6.765498e+05 4.695862e+05 5.524738e+05 7.703988e+05 2.629420e+05 5.800660e+04 2.320495e+05 1.062174e+06 5.969731e+05 5.561506e+05 1.321702e+06 5.950502e+05 2.429235e+05 2.835214e+05 4.406950e+05 8.558949e+04 2.650410e+05 1.047036e+06 9.430209e+05 4.544338e+05 3.371105e+05 2.666282e+05 1.581654e+06 2.060239e+05 3.957867e+06 2.761485e+05 2.222759e+05 2.232737e+05 3.824056e+05 1.769128e+06 2.679483e+06 2.685214e+06 7.039111e+05 1.810241e+06 2.697037e+05 9.713526e+04 7.491144e+05 3.004906e+05 5.616113e+05 5.685126e+05 1.262252e+06 6.414151e+05 7.463001e+05 1.478674e+06 1.725916e+06 9.975726e+05 1.552970e+05 2.981049e+05 3.450327e+06 9.216688e+05 6.122490e+05 5.150822e+05 6.265787e+05 8.257742e+05 2.673580e+05 2.910276e+05 1.687143e+05 1.838860e+06 1.322781e+06 2.654371e+05 1.045090e+06 1.282804e+06 1.057494e+06 5.374916e+05 1.728431e+06 2.030117e+05 1.870352e+06 5.313304e+05 4.283525e+05 2.072296e+06 2.464385e+06 2.874588e+05 1.393840e+06 6.097555e+05 4.009062e+05 4.634217e+05 1.642497e+05 1.862837e+05 1.360241e+06 6.059080e+05 5.321098e+06 6.725832e+05 7.626719e+05 5.986402e+05 3.852004e+06 9.186345e+05 2.863229e+05 1.559789e+05 1.757056e+05 9.811299e+05 8.889626e+04 3.078338e+05 7.138873e+04 2.077171e+05 7.063452e+05 4.673036e+06 2.974545e+05 5.337375e+05 1.729764e+05 6.066873e+04 1.627166e+05 1.049998e+05 1.135301e+06 1.636839e+05 9.029164e+05 9.036459e+05 3.223986e+05 1.644423e+05 2.008659e+05 1.038890e+06 7.433778e+05 5.775943e+05 1.779312e+05 2.495159e+05 4.308644e+05 2.383639e+05 3.303533e+05 1.277346e+06 1.444236e+06 1.022964e+06 3.299108e+05 9.051033e+04 2.370672e+05 1.743390e+05 2.287428e+05 8.590203e+04 2.151258e+05 9.867693e+04 7.611091e+04 1.354354e+06 3.367394e+05 1.306419e+05 2.492720e+05 2.787667e+05 7.624241e+05 6.145543e+05 4.864801e+05 9.895865e+04 1.845159e+05 2.134571e+06 1.789246e+05 6.177777e+04 5.578084e+05 4.630997e+05 3.108792e+05 1.370770e+06 5.735572e+05 7.692355e+05 8.032699e+04 1.124631e+05 1.864110e+06 4.013215e+05 9.381046e+05 3.083105e+05 6.823278e+05 9.223808e+05 2.334097e+05 3.225452e+05 7.987034e+05 1.116183e+05 4.117898e+06 5.441112e+05 8.287439e+05 4.768040e+05 3.513391e+05 7.643701e+05 3.336063e+05 5.736657e+05 2.384238e+06 C H4 N4 O3_1.939 1.633334e+05 2.254985e+06 2.609890e+06 2.688790e+06 9.398688e+04 1.726419e+06 2.930193e+06 2.578003e+06 83902.75 2.400902e+06 2.325700e+06 2.414173e+06 66380.89 2.672078e+06 2.212477e+06 2.522975e+06 7.215791e+04 2.164092e+06 3.042698e+06 2.215804e+06 1.430730e+05 2.257949e+06 2.382429e+06 2.875741e+06 121191.357 2.012010e+06 2.625224e+06 2.644873e+06 6.917879e+04 2.114637e+06 2.451324e+06 2.205625e+06 89777.08 2.808431e+06 2.470256e+06 1.901570e+06 9.086292e+04 2.705447e+06 3.013612e+06 2.188250e+06 8.883924e+04 2.020440e+06 2.982722e+06 2.727768e+06 4.408644e+04 1.893768e+06 2.418562e+06 2.499168e+06 2.300580e+06 3.758440e+06 1.407914e+06 2.381275e+06 1.689653e+06 1.856574e+06 2.525165e+06 2.568548e+06 2.240242e+06 2.038984e+06 2.086639e+06 2.878722e+06 2.436002e+06 2.594823e+06 2.113847e+06 3.715280e+06 1.705140e+06 1.404548e+06 2.151221e+06 2.701589e+06 3.039086e+06 2.365453e+06 2.772241e+06 3.126882e+06 3.186551e+06 4.123033e+06 2.817720e+06 1.892574e+06 2.386178e+06 2.734147e+06 6.100503e+05 2.150806e+06 2.169332e+06 2.945420e+06 2.227794e+06 2.715366e+06 2.007041e+06 1.893940e+06 1.901825e+06 2.904239e+06 2.336778e+06 2.594715e+06 3.004563e+06 2.125595e+06 3.005053e+06 2.036376e+06 2.765499e+06 2.565638e+06 3.120302e+06 1.755051e+06 2.007740e+06 2.320749e+06 2.323114e+06 2.513746e+06 1.750673e+06 1.298580e+06 2.388452e+06 2.568816e+06 2.578373e+06 2.932048e+06 1.513296e+06 2.308608e+06 2.413177e+06 3.957484e+06 2.332669e+06 1.813198e+06 2.392602e+06 2.277299e+06 3.038350e+06 1.852670e+06 1.681773e+06 2.115859e+06 1.947454e+06 2.429036e+06 1.968880e+06 1.283500e+06 2.513021e+06 2.155078e+06 3.332015e+06 2.281181e+06 2.140271e+06 2.016544e+06 2.261996e+06 2.814559e+05 2.144108e+06 1.968558e+06 2.039832e+06 2.334516e+06 2.869164e+06 3.227872e+06 2.490388e+06 2.731909e+06 1.971271e+06 1.596275e+06 2.883291e+06 1.926006e+06 2.046577e+06 2.141666e+06 2.038792e+06 2.276911e+06 1.798224e+06 4.384236e+06 2.604110e+06 2.937898e+06 2.249344e+06 2.014932e+06 2.086296e+06 2.853741e+06 5.849122e+06 4.389823e+06 6.228327e+06 1.801427e+06 2.404686e+06 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7.540719e+04 3.287940e+06 3.591166e+06 3.944054e+06 4.352654e+04 2.102137e+06 4.310516e+06 3.372153e+06 39207.67 3.306614e+06 3.504495e+06 3.453877e+06 30819.38 3.384181e+06 3.240320e+06 3.343415e+06 3.313930e+04 3.411479e+06 3.571557e+06 3.611292e+06 6.649877e+04 3.508860e+06 3.149468e+06 3.784523e+06 61524.306 2.744464e+06 3.940913e+06 3.530759e+06 3.815129e+04 3.433433e+06 2.577155e+06 3.302303e+06 50554.29 3.919719e+06 3.567384e+06 3.431682e+06 4.965881e+04 3.312480e+06 3.394000e+06 3.690666e+06 4.818640e+04 3.293851e+06 3.976159e+06 3.673447e+06 2.136893e+04 2.076363e+06 3.469969e+06 3.802279e+06 3.760524e+06 2.854457e+06 2.126622e+06 2.821607e+06 2.653685e+06 3.463029e+06 3.496747e+06 2.231239e+06 3.143475e+06 2.636042e+06 2.610143e+06 2.058103e+06 2.610749e+06 2.418212e+06 3.573180e+06 4.036800e+06 3.131598e+06 2.992385e+06 3.088777e+06 3.859661e+06 3.348491e+06 3.357749e+06 3.748159e+06 3.798530e+06 4.120262e+06 3.615661e+06 2.852472e+06 3.673977e+06 3.506498e+06 2.399413e+06 1.713402e+06 3.111915e+06 3.515142e+06 3.113419e+06 3.694528e+06 3.151090e+06 3.431953e+06 3.309231e+06 2.151080e+06 4.240042e+06 3.786802e+06 4.492247e+06 3.363442e+06 3.724474e+06 3.470406e+06 3.462442e+06 3.924331e+06 2.911970e+06 3.898883e+06 2.957103e+06 2.644999e+06 3.380595e+06 3.345883e+06 3.155657e+06 2.722278e+06 2.434247e+06 1.119523e+06 3.978701e+06 3.615469e+06 2.986407e+06 3.276329e+06 3.035288e+06 3.456693e+06 4.641173e+06 3.684129e+06 2.213634e+06 3.052652e+06 4.018147e+06 2.818341e+06 2.807192e+06 3.321029e+06 3.395480e+06 3.156568e+06 2.994917e+06 3.382282e+06 3.526725e+06 3.431940e+06 3.572225e+06 3.196950e+06 2.227888e+06 3.101477e+06 3.017282e+06 3.216320e+06 3.679661e+05 4.130013e+06 3.056479e+06 3.463068e+06 3.239863e+06 4.391535e+06 3.694632e+06 3.694468e+06 3.261762e+06 2.547583e+06 3.673877e+06 3.947400e+06 2.986335e+06 3.402043e+06 3.409355e+06 3.431178e+06 3.878778e+06 4.433838e+06 4.207499e+06 3.705345e+06 4.670060e+06 3.998794e+06 3.329776e+06 3.296721e+06 4.001406e+06 3.478699e+06 4.016343e+06 4.902237e+06 3.622513e+06 4.150300e+06 2.988595e+06 2.559694e+06 2.908026e+06 3.426816e+06 3.238712e+06 3.180262e+06 2.870911e+06 3.062334e+06 3.618645e+06 3.573573e+06 3.063117e+06 3.264816e+06 3.319770e+06 3.656887e+06 3.339657e+06 3.909895e+06 3.034518e+06 3.679501e+06 3.209734e+06 5.174526e+06 3.259616e+06 3.887319e+06 3.795392e+06 2.504017e+06 3.231307e+06 4.078946e+06 3.990760e+06 3.295184e+06 2.438157e+06 4.590301e+06 2.842828e+06 3.212873e+06 3.422361e+06 3.799117e+06 3.163847e+06 3.846023e+06 4.080728e+06 3.825229e+06 3.092588e+06 3.401964e+06 4.573230e+06 4.061524e+06 3.460471e+06 4.300523e+06 2.523515e+06 3.280355e+06 4.061436e+06 5.001819e+06 3.096780e+06 3.566143e+06 3.982179e+06 4.187375e+06 3.110463e+06 4.018810e+06 3.110539e+06 3.405039e+06 4.393283e+06 2.904573e+06 3.358397e+06 4.145685e+06 3.409960e+06 3.298774e+06 4.323100e+06 3.097246e+06 3.691565e+06 3.966070e+06 3.749072e+06 3.527490e+06 3.188552e+06 3.527587e+06 2.915807e+06 2.077225e+06 3.184474e+06 4.975642e+06 3.468011e+06 4.398606e+06 3.864151e+06 3.997719e+06 4.297796e+06 4.106121e+06 3.104744e+06 3.412858e+06 3.776642e+06 3.401961e+06 3.583378e+06 3.468763e+06 3.106028e+06 3.482598e+06 4.211302e+06 2.299527e+06 3.395617e+06 3.618605e+06 3.472962e+06 3.550059e+06 2.993824e+06 3.559342e+06 2.877886e+06 3.564318e+06 3.064720e+06 3.924014e+06 2.914494e+06 C7 H15 N O4 P2_1.941 6.750597e+04 7.386502e+05 7.829946e+05 8.652959e+05 4.010151e+04 9.402221e+05 9.793239e+05 7.814985e+05 41324.97 8.369235e+05 7.700776e+05 7.929218e+05 33014.02 8.758733e+05 1.090148e+06 6.531506e+05 3.633819e+04 8.216859e+05 8.164869e+05 1.096098e+06 7.333881e+04 8.461532e+05 6.331817e+05 8.939699e+05 61667.803 7.463007e+05 8.548927e+05 8.598187e+05 3.027750e+04 7.338071e+05 9.401465e+05 8.645970e+05 36682.21 9.511518e+05 8.705370e+05 8.525434e+05 4.162767e+04 6.814771e+05 7.644136e+05 1.324431e+06 4.391488e+04 6.135629e+05 7.974205e+05 6.523556e+05 1.826876e+04 8.258216e+05 7.913841e+05 9.868741e+05 1.081389e+06 9.537429e+05 8.972072e+05 7.612216e+05 5.180121e+05 5.990609e+05 6.707898e+05 6.143073e+05 5.105573e+05 6.786579e+05 5.665379e+05 7.254544e+05 5.317335e+05 7.264671e+05 7.410821e+05 9.322706e+05 6.908001e+05 6.312259e+05 6.858743e+05 6.661881e+05 9.080738e+05 7.279374e+05 6.518930e+05 1.087108e+06 6.886938e+05 8.587867e+05 6.916133e+05 8.447288e+05 9.910374e+05 6.943900e+05 5.080816e+05 6.433667e+05 6.658543e+05 8.540144e+05 9.120540e+05 7.147190e+05 8.365809e+05 6.948478e+05 8.191383e+05 9.282112e+05 5.837071e+05 1.022664e+06 5.841101e+05 7.719040e+05 7.102175e+05 8.888384e+05 8.694387e+05 6.620070e+05 8.370941e+05 6.343777e+05 8.281571e+05 7.861507e+05 1.086292e+06 6.467400e+05 7.663573e+05 5.861313e+05 7.890110e+05 5.253692e+05 5.598991e+05 6.076129e+05 7.469309e+05 5.896094e+05 8.316653e+05 6.677913e+05 6.953172e+05 7.425569e+05 6.892994e+05 7.666656e+05 6.900328e+05 6.986904e+05 7.077300e+05 7.291688e+05 1.027314e+06 1.214904e+06 1.114125e+06 1.012450e+06 7.276164e+05 8.364924e+05 6.762722e+05 1.108527e+06 7.033263e+05 8.341235e+05 7.682462e+05 1.775504e+05 9.165127e+05 6.332470e+05 7.597906e+05 8.221476e+05 6.844932e+05 6.992596e+05 6.265091e+05 7.627522e+05 9.316672e+05 1.082861e+06 7.762837e+05 8.423009e+05 6.631611e+05 5.658749e+05 8.269852e+05 8.052901e+05 1.104928e+06 8.893266e+05 7.240411e+05 6.771308e+05 1.156638e+06 7.759434e+05 7.750628e+05 8.440972e+05 5.930752e+05 5.743335e+05 7.258826e+05 7.478049e+05 8.238104e+05 5.005869e+05 9.757628e+05 7.253627e+05 6.587462e+05 9.145364e+05 8.339519e+05 9.463335e+05 8.819126e+05 8.815187e+05 7.496069e+05 8.648670e+05 6.548000e+05 7.186980e+05 8.816333e+05 7.202133e+05 7.499640e+05 8.967339e+05 5.637159e+05 9.330023e+05 9.700782e+05 1.104183e+06 1.313006e+06 9.060427e+05 7.136397e+05 8.790986e+05 9.572682e+05 8.044228e+05 6.439515e+05 7.907029e+05 1.222822e+06 5.221955e+05 8.535335e+05 1.137574e+06 1.295349e+06 7.678066e+05 1.144643e+06 8.865555e+05 1.069453e+06 9.003898e+05 5.476929e+05 1.127704e+06 1.078209e+06 7.476534e+05 9.287645e+05 9.243673e+05 8.096583e+05 1.035554e+06 1.176764e+06 1.056146e+06 9.113413e+05 8.230198e+05 1.086870e+06 9.303347e+05 9.184759e+05 1.091110e+06 8.794985e+05 1.100178e+06 1.033237e+06 1.141070e+06 8.241985e+05 6.772341e+05 1.087389e+06 7.869530e+05 1.062989e+06 8.327548e+05 1.260276e+06 7.855955e+05 1.123245e+06 9.567651e+05 9.206807e+05 7.845196e+05 7.826107e+05 9.972663e+05 9.313558e+05 9.756255e+05 9.831020e+05 4.498361e+05 9.245120e+05 7.672044e+05 9.115823e+05 6.661840e+05 7.504192e+05 1.058134e+06 6.732624e+05 1.194733e+06 5.636816e+05 5.653979e+05 7.383761e+05 7.851532e+05 6.443324e+05 6.461635e+05 8.599670e+05 6.169062e+05 7.311948e+05 7.917215e+05 8.523046e+05 6.707182e+05 1.091293e+06 1.224820e+06 6.173583e+05 7.447761e+05 Indole-3-carboxilic acid-O-sulphate (2)_1.941 8.756558e+04 2.227164e+07 2.488735e+07 2.547087e+07 4.863285e+04 2.433244e+07 2.986360e+07 2.777848e+07 34752.21 2.323347e+07 2.616016e+07 2.542569e+07 30367.35 2.712525e+07 2.470896e+07 2.674471e+07 1.543542e+05 2.157255e+07 2.516245e+07 2.159050e+07 5.402887e+04 3.314165e+07 2.574509e+07 2.669671e+07 51310.898 2.242917e+07 2.449238e+07 2.896076e+07 2.714182e+04 2.066544e+07 2.368138e+07 2.643982e+07 29008.78 3.183639e+07 2.279630e+07 2.123780e+07 2.761774e+04 2.748904e+07 4.743001e+05 2.134789e+07 2.730318e+04 3.292268e+07 2.240401e+07 3.390289e+07 1.626725e+04 2.855128e+07 3.757463e+06 3.623229e+07 1.063560e+06 3.761994e+07 7.950647e+06 7.004389e+06 5.484250e+05 4.244307e+05 3.347363e+07 5.079526e+05 3.219241e+07 3.584961e+07 3.145316e+05 3.139543e+07 8.911281e+06 7.623055e+06 1.978843e+06 4.991174e+04 1.184488e+06 5.873964e+06 3.557864e+07 3.680518e+07 3.439372e+07 3.257939e+07 2.555357e+07 3.243124e+07 8.686203e+04 3.954897e+07 1.386306e+06 3.092906e+07 3.939865e+07 3.610245e+07 5.972364e+04 4.004064e+05 2.688144e+07 2.927567e+07 2.657541e+06 3.816266e+07 3.534866e+07 3.879163e+07 2.889752e+07 5.121862e+07 5.175115e+07 5.080895e+07 1.099534e+07 2.826751e+07 9.388680e+06 3.844871e+07 1.389098e+07 2.937276e+07 7.628315e+05 3.272134e+04 1.634489e+07 2.435116e+07 3.469343e+07 2.392450e+07 2.097685e+07 4.475075e+04 2.327326e+06 7.925086e+06 3.650379e+07 4.207046e+07 4.671983e+07 3.455180e+07 3.161604e+07 5.025896e+06 4.544012e+05 2.167332e+05 2.090202e+07 4.164920e+07 3.579923e+07 1.753371e+05 3.774838e+04 2.683353e+07 2.641161e+07 6.645118e+06 9.113890e+05 1.028290e+07 6.899012e+05 7.106809e+05 5.100226e+07 2.476144e+05 2.711462e+07 2.730078e+07 3.106038e+07 3.366299e+04 5.606218e+04 2.756811e+07 3.631327e+07 3.173939e+07 1.413540e+05 3.067233e+07 2.926808e+07 4.600593e+07 2.432366e+07 1.905522e+07 3.643707e+07 3.643556e+07 3.069697e+07 2.477480e+07 1.598705e+07 3.000898e+07 1.392105e+07 4.147754e+07 3.581290e+07 1.487904e+06 5.936188e+07 3.882591e+07 4.340236e+07 4.651635e+07 2.276122e+07 6.591174e+07 2.637599e+07 2.816564e+07 4.248516e+07 3.091158e+07 1.154739e+07 2.687113e+07 3.315444e+07 2.493596e+07 2.144801e+07 2.517122e+07 3.115194e+07 2.299104e+07 1.977224e+07 3.476993e+07 3.020743e+07 3.118474e+07 5.626021e+07 2.491106e+07 1.425497e+07 2.969496e+07 4.723343e+07 1.730994e+07 2.455871e+07 1.224202e+07 2.057473e+07 3.321877e+07 2.976423e+06 6.739806e+06 1.747577e+07 6.657744e+06 1.432928e+06 1.207406e+07 4.714066e+07 2.715357e+05 7.414304e+06 1.550206e+07 6.170727e+06 1.225437e+07 4.188963e+07 1.174397e+07 2.057840e+07 2.224545e+07 5.347278e+07 4.176938e+07 7.833995e+05 1.339924e+07 1.071520e+07 5.259893e+06 3.956211e+05 2.192642e+07 2.876349e+07 1.106814e+07 1.227226e+07 1.145212e+07 2.815475e+07 1.154827e+07 1.547398e+07 9.609196e+06 1.480812e+07 1.056746e+06 5.227053e+06 1.241548e+07 1.748526e+07 6.876233e+06 1.955975e+07 5.760060e+06 8.544156e+06 1.777512e+07 2.043598e+07 3.242929e+05 1.652455e+07 1.179699e+07 1.369249e+07 4.969052e+05 7.256922e+06 1.217484e+07 4.043841e+05 1.228813e+07 1.779590e+07 8.483925e+05 2.272307e+07 3.706547e+07 3.876957e+07 2.535158e+07 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1.239910e+06 5.676649e+05 4.696531e+05 1.194473e+06 5.782845e+05 9.618161e+05 3.754033e+06 C10 H32 N9 O2 P_1.942 4.430262e+04 9.513323e+06 8.116022e+06 8.677025e+06 2.888673e+04 7.063688e+06 9.154483e+06 9.706724e+06 22843.10 7.532434e+06 1.008281e+07 9.419700e+06 22514.18 7.305487e+06 7.614127e+06 9.744021e+06 4.368384e+05 7.966592e+06 8.415944e+06 8.979751e+06 5.518614e+04 7.832535e+06 9.896616e+06 7.347526e+06 48895.233 9.126099e+06 8.760251e+06 8.160682e+06 2.914430e+04 8.473966e+06 8.593577e+06 9.879249e+06 39330.11 8.790350e+06 8.387973e+06 7.189026e+06 3.826159e+04 8.000086e+06 9.474743e+06 8.727023e+06 3.799319e+04 8.312689e+06 9.046279e+06 1.027248e+07 1.629870e+04 7.547009e+06 8.317300e+06 8.335879e+06 7.462317e+06 7.596039e+06 3.494848e+06 6.669424e+06 4.560966e+06 6.361023e+06 4.984762e+06 1.287686e+06 7.084384e+06 6.577132e+06 1.821447e+06 9.587687e+06 1.124797e+07 7.024857e+06 8.593139e+06 8.894475e+06 1.038468e+07 1.030834e+07 1.337939e+07 7.523404e+06 9.707836e+06 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3.626397e+04 1.223362e+06 1.839539e+06 1.693760e+06 36759.56 1.567430e+06 1.925679e+06 1.632109e+06 75204.84 1.489563e+06 1.617008e+06 1.770028e+06 5.977416e+04 9.795631e+05 1.887318e+06 1.730941e+06 7.388134e+04 1.430450e+06 1.645397e+06 1.987878e+06 61324.747 1.709270e+06 1.122280e+06 1.586433e+06 3.799016e+04 1.725174e+06 1.771730e+06 2.023804e+06 55512.50 1.432121e+06 1.330814e+06 1.458377e+06 6.080813e+04 1.668429e+06 1.706141e+06 1.588759e+06 5.305327e+04 1.548147e+06 1.811492e+06 1.862316e+06 2.042728e+04 1.467718e+06 1.350513e+06 1.776095e+06 7.194417e+05 1.010877e+06 1.346713e+05 9.149568e+05 4.316095e+05 1.266690e+06 4.519097e+05 4.695450e+05 1.573379e+06 7.715874e+05 6.823132e+05 1.037162e+06 8.592979e+05 6.707805e+05 2.644707e+05 8.415535e+05 4.254797e+05 6.523694e+06 7.567273e+05 3.193340e+05 8.974053e+05 3.416420e+05 4.724187e+05 5.136566e+05 5.443530e+05 4.144026e+05 3.540112e+06 1.270076e+06 3.848179e+06 3.368608e+06 7.467409e+05 5.849160e+06 1.804007e+06 1.033790e+06 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1.084067e+05 1.139682e+05 7.106673e+04 4.895676e+04 8.663891e+04 4.518747e+05 1.324626e+05 7.097091e+04 1.097441e+05 3.752628e+05 7.187940e+04 5.405459e+05 9.627937e+04 8.419997e+04 8.991685e+04 6.824223e+04 3.923101e+05 1.684013e+05 1.018829e+05 1.216035e+05 4.837025e+05 1.108460e+05 2.817287e+05 6.374916e+05 2.979720e+05 7.861239e+05 1.469299e+05 6.098323e+05 4.385432e+05 6.915378e+04 6.758377e+04 1.067399e+05 1.118709e+05 4.664573e+05 7.340721e+04 1.408735e+05 1.137583e+05 3.036228e+05 1.579378e+05 1.291851e+05 6.113984e+04 3.425940e+05 2.138893e+05 7.508474e+04 1.405921e+05 8.632266e+04 5.153767e+04 6.414495e+04 2.659034e+05 1.043574e+05 1.765470e+05 8.118842e+04 4.227614e+04 4.355562e+05 6.705466e+04 1.212949e+05 6.977059e+04 1.066339e+06 C12 H9 N7 O2_1.943 8.123709e+04 3.624426e+06 3.527385e+06 3.741508e+06 4.725288e+04 1.666102e+06 4.073390e+06 3.374430e+06 37788.92 3.072367e+06 3.461685e+06 3.273153e+06 34613.89 3.352811e+06 3.275426e+06 3.420423e+06 3.735751e+04 3.089976e+06 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4.721872e+04 3.268881e+05 7.732264e+04 7.547675e+04 1.073988e+05 1.501786e+05 2.901541e+05 9.150842e+04 2.095433e+05 1.322677e+05 1.258083e+06 2.365444e+05 1.383101e+05 8.525594e+04 8.385982e+04 6.845200e+05 1.469458e+05 7.209079e+04 2.557217e+05 1.724772e+05 Isoprene (1)_1.945 4.228103e+04 6.568059e+07 7.217072e+07 8.363006e+07 5.498500e+04 4.971602e+07 6.734078e+07 7.323066e+07 27594.74 6.595857e+07 7.414432e+07 6.987197e+07 37060.58 6.400063e+07 6.841401e+07 7.075763e+07 8.946530e+05 6.464792e+07 6.975097e+07 7.027801e+07 5.146693e+04 6.216563e+07 7.029105e+07 7.742196e+07 44307.460 6.024770e+07 6.866949e+07 7.314754e+07 2.746012e+04 6.445446e+07 7.052310e+07 9.035049e+07 41979.92 7.120991e+07 1.431867e+07 8.279047e+07 4.047929e+04 7.289427e+07 7.469692e+07 7.048065e+07 3.771765e+04 6.128675e+07 7.312866e+07 8.006542e+07 1.517418e+04 5.962359e+07 6.937134e+07 6.526398e+07 6.034507e+07 7.116507e+07 3.951126e+07 6.397327e+07 5.315502e+07 6.312598e+07 5.299104e+07 5.471777e+07 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6.890830e+07 6.529025e+07 5.807691e+07 7.575863e+07 8.239894e+07 7.673924e+07 1.117439e+08 8.110430e+07 9.108157e+07 7.624599e+07 8.214359e+07 6.819245e+07 5.442382e+07 7.298535e+07 8.057515e+07 1.021453e+08 9.205270e+07 7.396813e+07 8.000527e+07 6.928156e+07 8.298834e+07 9.696914e+07 7.405002e+07 7.630883e+07 7.369912e+07 7.374928e+07 8.411785e+07 7.886938e+07 7.318879e+07 5.955446e+07 7.158054e+07 7.447766e+07 8.110441e+07 1.855181e+07 6.898020e+07 8.037907e+07 7.829843e+07 8.063824e+07 6.993150e+07 9.183851e+07 8.110395e+07 6.099458e+07 7.631287e+07 6.242084e+07 1.027595e+08 5.225003e+07 5.447779e+07 5.339573e+07 5.025592e+07 8.031251e+07 8.516297e+07 7.992028e+07 C15 H31 N4 O P S_1.945 3.540895e+04 5.110981e+05 4.268711e+05 4.833697e+05 2.107153e+04 3.577557e+05 7.308709e+05 5.259448e+05 20472.82 3.914432e+05 5.926540e+05 4.702353e+05 25026.74 3.477466e+05 5.180303e+05 5.146572e+05 3.293789e+04 3.792845e+05 6.233510e+05 5.469759e+05 6.938287e+04 2.463244e+05 5.504608e+05 6.807717e+05 58158.770 3.401526e+05 5.701256e+05 4.805965e+05 3.676959e+04 3.567855e+05 5.545347e+05 6.858156e+05 53138.82 2.592551e+05 5.771910e+05 4.909455e+05 5.894433e+04 3.764733e+05 5.626266e+05 5.647584e+05 5.616387e+04 3.000707e+05 5.876643e+05 6.268429e+05 2.175424e+04 3.072511e+05 5.294044e+05 4.804409e+05 3.885973e+05 5.110494e+05 2.650211e+05 2.469974e+05 2.252889e+05 3.818147e+05 3.313225e+05 3.632785e+05 3.592240e+05 3.141063e+05 4.952040e+05 5.263017e+05 7.512612e+05 4.543624e+05 5.510601e+05 7.013029e+05 7.447183e+05 6.481764e+05 7.541668e+05 6.180158e+05 6.226593e+05 5.846536e+05 7.105212e+05 7.924015e+05 7.929180e+05 1.026777e+06 5.548004e+05 6.696425e+05 6.160363e+05 6.087173e+05 2.473361e+05 6.232289e+05 5.031929e+05 5.303857e+05 4.722581e+05 5.959044e+05 4.307426e+05 5.256545e+05 3.954052e+05 2.853804e+05 5.533291e+05 7.858879e+05 9.242240e+05 5.546179e+05 5.993513e+05 5.270507e+05 8.895213e+05 6.094878e+05 1.004909e+06 2.808550e+05 5.221630e+05 4.174455e+05 3.606607e+05 5.374317e+05 2.346272e+05 7.718770e+05 7.766130e+05 6.438335e+05 4.648882e+05 7.133632e+05 2.581679e+05 3.593819e+05 4.405941e+05 1.362899e+06 6.725481e+05 3.535819e+05 5.014846e+05 2.405495e+05 4.933914e+05 4.105812e+05 3.708155e+05 7.141573e+05 1.995909e+05 3.043030e+05 2.629337e+05 4.233231e+05 3.553304e+05 3.199387e+05 9.360791e+05 5.087729e+05 6.002381e+05 6.140302e+05 5.774202e+05 1.751361e+05 4.916936e+05 4.876430e+05 4.383425e+05 4.230852e+05 6.781104e+05 7.653322e+05 4.535753e+05 7.359388e+05 1.835601e+05 9.142443e+05 7.770440e+05 1.810832e+05 3.171876e+05 4.812661e+05 6.009181e+05 6.094621e+05 8.913678e+05 1.066542e+06 5.569789e+05 9.939807e+05 7.251496e+05 5.309846e+05 3.378476e+05 3.893762e+05 1.151940e+06 8.540525e+05 1.376856e+06 3.555326e+05 5.987000e+05 5.329384e+05 2.228712e+05 2.109823e+05 6.368858e+05 2.554454e+05 2.687557e+05 3.293312e+05 2.802467e+05 2.725015e+05 4.119204e+05 3.201021e+05 3.865477e+05 1.480900e+05 6.033327e+05 5.745885e+05 5.939472e+05 4.841355e+05 6.815045e+05 7.703902e+05 2.212994e+06 3.206105e+05 3.298886e+05 1.539670e+06 3.566341e+05 3.903122e+05 3.374885e+05 5.000775e+05 1.350168e+06 3.046661e+05 1.461420e+06 5.279604e+05 2.081794e+05 4.075429e+05 1.998934e+06 3.045830e+05 1.583462e+06 1.520339e+06 3.022972e+05 1.709417e+06 2.222476e+06 1.789426e+06 2.859589e+05 3.491242e+05 3.257260e+05 2.604967e+05 3.637277e+05 1.988910e+05 8.159608e+05 5.422456e+05 3.190862e+05 4.849477e+05 3.098393e+05 4.724277e+05 3.451923e+05 6.116521e+05 2.159155e+06 8.777030e+05 5.460972e+05 3.806738e+05 5.943519e+05 5.462297e+05 2.035048e+05 3.556228e+05 4.629012e+05 7.671103e+05 6.315255e+05 4.131264e+05 5.518913e+05 3.760433e+05 5.453075e+05 7.827123e+05 4.676312e+05 3.769755e+05 5.732872e+05 6.085541e+05 8.010667e+05 4.858424e+05 4.545176e+05 2.934356e+05 8.855361e+05 5.144466e+05 7.971835e+05 5.487202e+05 4.969113e+05 5.493831e+05 8.562852e+05 6.772605e+05 5.559566e+05 8.618611e+05 7.166918e+05 3.800971e+05 6.708838e+05 3.553914e+05 9.607069e+05 1.600556e+05 2.075096e+05 3.654809e+05 2.439895e+05 5.211691e+05 6.651076e+05 7.405266e+05 244.12839_1.945 2.460445e+04 8.224603e+05 8.154955e+05 1.036866e+06 1.469133e+04 5.700088e+05 1.005937e+06 9.641481e+05 13788.31 5.937152e+05 1.296316e+06 9.686777e+05 16023.24 5.677988e+05 6.995424e+05 9.068980e+05 4.569220e+04 6.471368e+05 1.006817e+06 9.706353e+05 5.450763e+04 6.460824e+05 9.456350e+05 9.230248e+05 47237.000 6.909057e+05 1.027338e+06 8.744100e+05 2.715028e+04 5.720465e+05 1.015697e+06 1.111646e+06 36892.38 5.978682e+05 1.095285e+06 8.338767e+05 4.139794e+04 6.000213e+05 8.575812e+05 9.140087e+05 4.499828e+04 5.525470e+05 1.128296e+06 1.111653e+06 1.723330e+04 5.397171e+05 9.641204e+05 7.850030e+05 8.540337e+05 7.086290e+05 2.348936e+05 6.492010e+05 4.529847e+05 9.388820e+05 5.084778e+05 6.184489e+05 6.316276e+05 6.435419e+05 6.831173e+05 9.075847e+05 1.069187e+06 9.507747e+05 8.006645e+05 8.389986e+05 1.377475e+06 1.043511e+06 1.194985e+06 1.401023e+06 1.104290e+06 1.014159e+06 1.138511e+06 1.266589e+06 1.055106e+06 1.416318e+06 8.670260e+05 1.201533e+06 1.394840e+06 1.070008e+06 1.509323e+06 9.536042e+05 8.776882e+05 8.868628e+05 1.296495e+06 9.232631e+05 1.107496e+06 1.084339e+06 7.999255e+05 7.314697e+05 1.127038e+06 1.356156e+06 1.324264e+06 9.285395e+05 9.666108e+05 8.921105e+05 1.389430e+06 1.161171e+06 2.213559e+06 7.426231e+05 1.088456e+06 7.410633e+05 8.022526e+05 1.028414e+06 5.259313e+05 1.446683e+06 1.720078e+06 1.427673e+06 9.445575e+05 1.177724e+06 7.751622e+05 6.391695e+05 8.949224e+05 1.976286e+06 1.203866e+06 6.283802e+05 8.135581e+05 6.335781e+05 4.928041e+05 6.377246e+05 6.601291e+05 1.261829e+06 6.834428e+05 8.177426e+05 7.992061e+05 6.975943e+05 6.703446e+05 7.022050e+05 1.507483e+06 8.663002e+05 8.436462e+05 8.590431e+05 1.147372e+06 6.110375e+04 1.088151e+06 8.630949e+05 6.379198e+05 9.826631e+05 1.265107e+06 1.289241e+06 9.931665e+05 1.550558e+06 3.808064e+05 1.556295e+06 1.132922e+06 5.227909e+05 7.209791e+05 8.015681e+05 1.262015e+06 1.361710e+06 1.286354e+06 2.055578e+06 9.561464e+05 1.711472e+06 1.691854e+06 9.899841e+05 5.499400e+05 6.963867e+05 1.717086e+06 1.295605e+06 2.182224e+06 5.784564e+05 1.073598e+06 9.654387e+05 4.568269e+05 5.061066e+05 8.504143e+05 4.360658e+05 7.320541e+05 5.769682e+05 5.875487e+05 5.956837e+05 7.960554e+05 6.794449e+05 9.966971e+05 5.906137e+05 1.026520e+06 9.926529e+05 7.874270e+05 1.039435e+06 1.360152e+06 1.106437e+06 2.323931e+06 5.622837e+05 6.622278e+05 1.394104e+06 3.798963e+05 5.325722e+05 6.495379e+05 8.204095e+05 1.516832e+06 6.036506e+05 1.904675e+06 1.062578e+06 4.099751e+05 7.704613e+05 2.103381e+06 3.826857e+05 1.852195e+06 2.320301e+06 6.077747e+05 1.966087e+06 2.300699e+06 2.270232e+06 5.718335e+05 7.372902e+05 5.667300e+05 3.369357e+05 8.572312e+05 3.196979e+05 1.247547e+06 7.283689e+05 6.211480e+05 1.086088e+06 5.930005e+05 7.014776e+05 4.306733e+05 1.175593e+06 1.813844e+06 1.342126e+06 7.894287e+05 6.102932e+05 1.141180e+06 7.235985e+05 2.761142e+05 5.873408e+05 7.950747e+05 1.063475e+06 8.985922e+05 5.956314e+05 7.710596e+05 6.673497e+05 8.184297e+05 1.292911e+06 7.743148e+05 7.882892e+05 9.867099e+05 1.068076e+06 1.029851e+06 8.604878e+05 8.283283e+05 4.881739e+05 8.978501e+05 8.024486e+05 9.685961e+05 1.069545e+06 7.345483e+05 7.987616e+05 1.251313e+06 1.284758e+06 1.053723e+06 1.014072e+06 1.054068e+06 6.314111e+05 1.077727e+06 5.268629e+05 1.310357e+06 3.430587e+05 3.804197e+05 8.728272e+05 3.594281e+05 6.502391e+05 1.123115e+06 1.101171e+06 247.46252_1.945 7.986875e+04 4.265704e+06 4.589904e+06 5.484127e+06 4.401964e+04 3.125798e+06 5.818193e+06 5.130673e+06 29820.83 4.689147e+06 4.932623e+06 4.809355e+06 27132.00 4.288525e+06 5.054700e+06 4.781900e+06 2.613440e+04 3.935483e+06 4.787003e+06 3.578828e+06 5.461249e+04 6.630411e+06 4.807068e+06 4.598756e+06 46740.740 4.226255e+06 4.905810e+06 5.582718e+06 2.518022e+04 3.065971e+06 4.777189e+06 4.907650e+06 28907.00 5.903639e+06 3.458661e+06 4.415202e+06 2.869283e+04 6.032768e+06 5.113832e+06 3.339148e+06 3.137912e+04 4.720012e+06 5.516459e+06 4.833769e+06 1.598170e+04 4.926508e+06 4.034250e+06 4.902977e+06 2.097542e+06 3.644073e+06 3.315918e+06 1.309658e+06 3.616267e+06 3.937269e+06 1.441287e+06 1.259192e+06 1.927170e+06 1.125586e+06 1.628910e+06 3.538319e+06 1.605344e+06 1.594322e+06 3.913725e+06 4.823144e+05 2.280271e+06 4.178892e+06 3.370310e+06 9.748136e+05 1.538829e+06 3.276390e+06 3.315195e+06 1.891370e+06 2.817991e+06 3.416125e+06 1.629636e+06 3.833576e+06 2.427567e+06 2.102830e+06 5.493531e+04 1.836819e+06 2.240333e+06 2.495421e+06 1.142459e+06 1.705889e+06 1.296021e+06 3.308104e+06 1.377989e+06 6.380069e+05 1.579465e+06 8.871184e+05 1.193902e+06 3.612949e+06 2.855369e+06 1.267026e+06 8.039090e+05 3.131769e+06 1.960259e+06 3.307628e+06 5.692917e+06 3.722821e+06 7.919850e+05 2.690143e+06 3.753367e+06 3.014012e+06 1.532690e+06 1.239751e+06 1.241537e+06 1.040812e+06 1.148765e+06 1.360713e+06 1.873874e+06 7.070675e+05 1.651165e+06 2.505116e+06 4.542637e+06 2.544106e+06 1.823368e+06 4.613568e+06 1.440699e+06 6.997443e+05 2.167662e+06 1.333195e+06 2.135013e+06 2.257315e+06 1.165017e+06 1.266439e+06 9.522152e+05 2.489164e+06 2.481038e+06 2.829664e+06 2.629712e+06 4.041576e+04 1.205875e+06 1.619717e+06 1.990860e+06 2.202013e+06 1.701456e+06 1.820252e+06 2.041172e+06 1.546927e+06 1.096944e+06 2.070973e+06 2.367139e+06 1.495599e+06 2.960924e+06 1.244601e+06 2.888388e+06 1.782424e+06 2.294713e+06 9.077583e+05 5.981194e+05 6.655338e+05 1.012293e+06 8.781007e+05 1.356333e+06 1.622741e+06 4.599446e+05 3.210658e+05 7.109774e+05 9.539996e+05 6.762218e+05 7.267667e+05 2.076869e+06 6.088355e+06 2.654566e+06 3.556221e+06 4.554532e+06 6.166526e+06 3.006005e+06 5.246944e+06 4.461586e+06 4.695460e+06 4.526812e+06 3.534813e+06 6.117068e+06 3.206984e+06 1.230132e+06 2.400898e+06 6.549283e+05 4.819005e+06 2.742235e+06 5.455803e+06 8.046207e+06 1.058522e+06 7.747945e+06 1.055466e+07 7.259520e+06 1.311362e+07 1.015749e+05 8.799964e+06 7.392532e+04 9.086357e+06 3.393070e+06 9.503424e+06 2.534550e+06 7.781889e+06 5.618599e+05 1.839386e+06 5.143188e+06 1.082523e+05 1.055782e+05 1.046944e+06 1.331337e+06 7.724168e+06 1.200126e+07 1.059579e+07 5.578352e+06 8.645388e+06 9.447084e+06 8.879698e+06 1.110429e+07 1.216198e+07 5.374976e+06 9.548303e+06 2.147210e+07 8.004056e+06 4.929033e+05 3.531243e+06 1.084808e+07 1.012761e+07 7.115849e+06 9.524609e+06 7.228549e+06 6.085982e+06 8.099479e+06 7.643987e+06 8.188838e+06 3.921468e+06 6.582138e+06 9.173147e+06 1.102395e+07 4.630284e+06 8.946222e+06 1.010042e+07 6.500751e+06 1.032533e+07 1.187148e+07 9.088717e+06 4.364282e+06 4.288469e+06 2.688404e+06 6.603452e+06 7.220369e+06 3.919776e+06 8.095039e+06 3.770470e+06 2.704364e+06 1.559525e+06 1.653933e+06 4.519548e+06 4.044685e+06 2.159880e+06 6.218627e+06 2.245182e+06 2.717788e+06 2.395705e+06 1.921064e+06 1.246700e+06 4.039309e+06 1.130419e+07 2.287336e+06 4.103982e+06 N-Methylcaprolactam_1.945 2.040881e+05 1.458581e+07 1.244671e+07 1.241618e+07 1.332696e+05 1.265744e+07 1.420315e+07 1.507717e+07 133256.84 1.361466e+07 1.417148e+07 1.359727e+07 150274.53 1.065617e+07 1.295919e+07 1.575375e+07 1.056320e+05 1.298281e+07 1.470694e+07 1.483850e+07 1.903599e+05 1.093325e+07 1.670362e+07 2.928071e+06 66065.997 1.657077e+07 1.509010e+07 1.419863e+07 1.367724e+05 1.362090e+07 1.348750e+07 1.641824e+07 125925.35 1.101096e+07 1.426679e+07 1.300554e+07 1.270253e+05 1.290971e+07 1.274823e+07 1.276047e+07 3.168931e+04 1.330084e+07 1.554141e+07 1.735268e+07 8.453724e+04 7.902696e+06 1.546627e+07 1.237833e+07 1.213817e+07 1.496373e+07 9.488025e+06 1.123673e+07 8.810645e+06 1.105042e+07 1.056256e+07 2.176616e+07 1.737752e+07 1.446742e+07 1.095158e+07 1.325461e+07 1.507549e+07 1.365810e+07 1.501263e+07 1.583315e+07 1.120381e+07 2.897877e+06 1.366159e+07 1.032770e+07 1.527498e+07 1.442263e+07 1.485825e+07 1.592406e+07 1.766097e+07 1.929031e+07 1.403376e+07 1.588874e+07 1.152811e+07 1.721717e+07 4.778728e+06 1.482749e+07 1.063082e+07 1.239077e+07 1.269319e+07 1.595339e+07 1.233906e+07 1.323131e+07 6.243766e+06 1.123892e+07 1.258398e+07 1.745044e+07 1.294320e+07 1.263202e+07 1.623494e+07 1.076347e+07 1.585359e+07 1.439957e+07 1.700474e+07 1.163127e+07 1.304723e+07 1.147766e+07 1.281625e+07 1.442800e+07 1.067088e+07 1.040544e+07 1.389281e+07 1.383985e+07 1.118949e+07 1.360314e+07 1.273208e+07 9.214171e+06 1.227921e+07 1.708978e+07 1.157544e+07 1.212175e+07 1.384896e+07 1.132338e+07 1.571672e+07 8.905015e+06 9.615181e+06 1.164085e+07 8.992658e+06 1.186363e+07 1.254129e+07 1.186017e+07 1.048331e+07 9.842742e+06 1.379001e+07 1.159754e+07 1.190656e+07 1.124091e+07 1.490863e+07 1.972252e+06 1.422825e+07 1.106984e+07 1.267744e+07 1.257738e+07 1.935086e+07 1.419474e+07 1.313862e+07 1.497705e+07 9.023298e+06 2.011805e+07 1.558562e+07 1.125116e+07 1.061859e+07 1.267247e+07 1.167611e+07 1.129799e+07 1.436057e+07 1.728569e+07 1.396691e+07 1.553241e+07 2.077896e+07 1.377019e+07 1.488066e+07 1.157307e+07 1.501876e+07 1.617753e+07 2.242962e+07 1.128422e+07 1.018533e+07 1.269511e+07 1.418176e+07 1.243100e+07 1.380160e+07 9.763351e+06 1.108922e+07 1.118514e+07 1.191969e+07 1.120673e+07 1.222557e+07 1.534452e+07 9.908082e+06 1.528974e+07 1.508455e+07 1.138699e+07 9.866909e+06 1.385698e+07 1.406083e+07 1.420055e+07 2.217314e+07 1.499920e+07 1.486094e+07 1.633055e+07 1.641139e+07 1.387957e+07 1.471242e+07 1.666908e+07 1.785298e+07 1.444825e+07 2.134190e+07 1.783983e+07 1.227898e+07 2.060658e+07 2.681660e+07 1.462186e+07 2.183573e+07 2.603802e+07 1.627049e+07 2.252356e+07 1.554671e+07 2.965420e+07 1.547960e+07 1.574928e+07 1.510536e+07 1.344422e+07 1.831510e+07 1.270519e+07 2.911954e+07 1.816763e+07 1.328644e+07 1.899904e+07 1.632464e+07 1.653488e+07 1.776271e+07 1.991971e+07 2.805442e+07 2.001558e+07 1.845875e+07 1.374016e+07 1.798151e+07 1.436156e+07 1.379637e+07 1.476850e+07 2.218160e+07 1.994563e+07 1.855473e+07 1.692265e+07 1.901681e+07 1.519106e+07 2.304344e+07 2.022278e+07 1.491560e+07 1.790241e+07 1.843727e+07 1.528228e+07 1.791945e+07 1.419671e+07 1.587894e+07 1.396666e+07 2.069484e+07 1.549485e+07 2.034336e+07 1.573997e+07 1.622636e+07 1.944899e+07 1.679698e+07 1.526939e+07 1.636667e+07 1.685540e+07 1.426584e+07 1.079203e+07 1.773703e+07 1.237086e+07 2.018349e+07 1.069094e+07 1.248872e+07 1.087814e+07 1.081035e+07 1.685443e+07 1.786025e+07 1.903572e+07 C13 H7 N9 O11 P2 S_1.946 1.201459e+04 4.216345e+05 2.947327e+05 2.698598e+05 7.838239e+03 3.015521e+05 3.373569e+05 2.883429e+05 12589.85 2.987383e+05 3.550419e+05 2.511231e+05 18454.05 3.059766e+05 3.971245e+05 3.877726e+05 2.374862e+04 2.543245e+05 3.019538e+05 2.565401e+05 5.277086e+04 4.191429e+05 3.251136e+05 2.558622e+05 53955.360 3.807731e+05 2.610338e+05 2.675742e+05 3.014645e+04 4.199414e+05 4.132664e+05 2.402286e+05 40470.50 3.775570e+05 2.065805e+05 2.689129e+05 3.183027e+04 3.155453e+05 3.645089e+05 2.680837e+05 2.582940e+04 3.558440e+05 3.960037e+05 3.353102e+05 1.179272e+04 3.503829e+05 2.875750e+05 2.356804e+05 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1.354802e+05 6.687494e+04 1.273185e+05 1.224146e+05 2.582586e+05 1.216979e+05 5.169577e+04 4.281737e+04 2.674271e+05 1.008228e+05 1.483636e+05 6.010266e+04 1.257722e+05 1.736824e+05 2.406932e+05 7.225464e+04 1.724635e+05 1.354915e+05 1.050314e+05 1.591453e+05 7.149159e+04 1.335020e+05 1.561584e+05 5.277529e+04 8.486252e+04 5.649637e+04 1.562881e+05 2.432103e+05 8.212613e+04 1.303234e+05 1.044433e+05 1.423811e+05 7.746943e+04 9.723050e+04 1.035637e+05 9.925885e+04 1.034592e+05 1.577404e+05 3.080437e+05 5.525197e+05 3.707538e+05 2.653352e+05 4.137065e+05 2.976170e+05 2.962728e+05 2.510384e+05 3.596737e+05 2.963424e+05 1.129134e+05 1.797754e+05 1.885695e+05 1.581523e+05 2.217444e+05 1.954989e+05 2.988927e+05 2.271049e+05 4.205372e+05 6.007282e+05 6.726523e+04 9.954015e+05 7.134282e+05 4.307634e+05 7.280711e+05 3.963390e+04 4.859017e+05 9.196015e+04 9.476305e+05 1.025180e+06 9.321560e+05 2.854870e+05 5.532364e+05 6.037195e+04 1.530693e+05 3.465198e+05 1.056478e+05 6.656756e+04 1.870461e+05 4.030562e+05 5.250796e+05 5.552954e+05 1.443840e+06 6.831218e+05 1.691661e+05 4.805048e+05 6.952418e+05 1.208239e+06 7.333266e+05 3.338834e+05 9.736655e+05 8.498660e+05 5.353920e+05 7.758072e+04 3.058415e+05 1.333266e+06 5.454297e+05 5.925986e+05 6.571867e+05 3.084830e+05 3.418961e+05 1.046841e+06 3.880658e+05 6.037461e+05 7.155769e+05 5.541509e+05 5.752282e+05 9.080509e+05 6.466828e+05 6.167698e+05 7.657946e+05 4.996144e+05 7.662154e+05 5.395260e+05 6.075478e+05 2.592864e+05 2.170406e+05 9.276432e+04 4.661195e+05 6.439089e+05 3.668761e+05 4.872690e+05 5.891687e+05 4.132877e+05 1.635732e+05 1.026478e+05 5.825648e+05 3.500058e+05 1.575774e+05 4.364851e+05 1.162557e+05 2.468979e+05 2.191359e+05 1.025954e+05 1.639473e+05 2.903098e+05 5.724678e+05 5.282134e+05 4.863749e+05 C7 H4 O_1.946 1.284630e+07 4.234322e+06 3.986799e+06 4.413411e+06 3.420936e+04 2.737381e+06 4.337719e+06 4.767778e+06 27671.72 3.748423e+06 4.167357e+06 4.486916e+06 32896.09 3.444464e+06 4.095529e+06 3.933304e+06 3.424035e+04 3.731134e+06 3.998401e+06 4.236530e+06 5.887554e+04 3.509762e+06 4.252615e+06 4.632857e+06 49674.865 4.025856e+06 3.881250e+06 3.911662e+06 3.740640e+04 3.642424e+06 3.761794e+06 4.851446e+06 45554.06 3.866842e+06 3.936341e+06 3.677197e+06 4.347550e+04 4.331954e+06 3.861188e+06 3.526630e+06 4.040449e+04 3.627364e+06 4.514660e+06 5.564764e+06 2.184174e+04 3.541718e+06 3.915782e+06 3.339437e+06 1.276095e+07 4.889281e+06 3.414064e+06 1.907850e+06 9.066209e+06 1.537224e+07 1.749449e+06 2.653623e+07 1.178738e+07 1.137358e+07 1.481479e+07 4.927311e+06 4.250334e+06 3.185141e+06 5.151460e+06 5.269615e+06 1.090737e+07 3.107962e+06 1.392624e+06 3.168319e+06 4.826207e+06 1.295340e+06 1.000013e+06 1.787114e+06 7.348306e+06 1.978618e+06 6.397287e+06 3.881369e+06 2.767996e+06 1.723924e+07 1.233303e+06 1.222576e+06 4.175219e+06 3.824281e+05 2.615130e+06 7.242495e+06 5.845647e+06 2.370300e+06 9.068625e+05 1.747181e+06 9.764451e+06 1.547216e+06 4.171814e+06 2.445929e+06 2.100990e+06 3.201002e+06 2.479771e+06 2.723679e+06 4.164832e+06 1.697624e+06 5.072104e+05 1.252322e+06 6.226205e+06 4.180379e+06 2.273059e+06 1.057500e+07 2.673735e+06 1.271274e+06 1.625206e+06 2.617574e+06 4.758195e+05 1.314749e+06 6.433682e+06 4.313905e+06 2.588167e+06 2.149342e+06 1.290786e+06 4.658725e+06 1.037812e+06 2.831346e+07 1.075467e+06 1.153308e+06 1.054928e+06 1.982556e+06 8.744237e+06 1.869679e+07 1.493605e+07 4.111583e+06 9.664253e+06 9.049162e+05 4.230670e+05 3.403476e+06 1.854998e+06 3.694424e+06 3.603628e+06 7.269861e+06 2.788449e+06 4.058271e+06 8.335264e+06 8.964172e+06 4.370404e+06 7.914153e+05 1.387829e+06 2.030912e+07 4.789403e+06 2.939468e+06 1.975663e+06 3.265675e+06 5.685273e+06 1.646269e+06 1.335021e+06 1.172199e+06 1.040390e+07 9.871154e+06 1.351270e+06 6.411387e+06 7.562256e+06 3.531811e+06 2.984978e+06 9.866249e+06 1.153105e+06 1.345299e+07 3.303383e+06 3.836001e+06 1.185921e+07 1.833031e+07 1.726526e+06 9.303199e+06 2.846148e+06 2.441339e+06 2.364029e+06 8.910012e+05 1.201782e+06 7.107827e+06 3.971689e+06 3.669582e+07 5.092904e+06 5.307545e+06 4.396095e+06 2.895702e+07 5.786405e+06 1.294119e+06 3.618206e+05 1.472598e+06 4.571743e+06 4.473164e+05 2.368528e+06 7.710667e+05 1.091085e+06 4.007678e+06 4.070821e+07 1.955515e+06 4.195569e+06 2.383733e+06 1.426357e+05 6.548612e+05 3.818191e+05 7.877405e+06 1.408821e+06 7.494716e+06 5.386158e+06 2.259923e+06 1.165426e+06 1.450914e+06 8.176945e+06 4.373335e+06 4.030793e+06 1.882429e+06 1.816556e+06 1.259319e+06 1.429882e+06 1.704352e+06 9.698236e+06 8.118329e+06 4.840455e+06 2.850205e+06 5.078449e+05 1.563440e+06 1.294672e+06 1.321015e+06 1.026671e+06 1.510411e+06 1.132122e+06 4.925635e+05 7.212827e+06 2.317467e+06 1.025296e+06 1.424711e+06 1.290887e+06 7.114726e+06 3.914432e+06 3.753341e+06 2.068285e+05 1.482353e+06 1.854844e+07 1.610947e+06 5.170446e+05 4.336560e+06 2.221236e+06 2.723271e+06 7.486753e+06 2.390661e+06 4.051262e+06 4.966525e+05 1.458860e+06 9.928479e+06 2.433932e+06 5.715911e+06 2.207620e+06 4.002963e+06 6.051404e+06 1.844332e+06 4.895902e+06 4.717239e+06 9.396224e+05 2.477206e+07 3.704101e+06 4.401588e+06 1.953289e+06 1.807671e+06 4.131467e+06 3.173159e+06 4.093119e+06 1.877846e+07 C8 H7 N_1.946 1.743740e+06 6.590186e+05 5.600563e+05 7.633987e+05 3.436106e+04 6.365625e+05 9.005137e+05 6.155288e+05 52639.23 5.568205e+05 8.857040e+05 7.089355e+05 27691.69 6.394068e+05 7.499634e+05 5.881200e+05 6.703026e+04 6.509629e+05 6.377858e+05 6.434531e+05 6.135650e+04 6.550594e+05 8.511574e+05 7.672652e+05 50044.848 6.635700e+05 6.509810e+05 7.044422e+05 3.890915e+04 5.779794e+05 6.088725e+05 8.564010e+05 40440.63 6.851908e+05 6.463308e+05 6.309266e+05 4.335046e+04 8.643651e+05 5.636465e+05 6.992887e+05 4.592494e+04 5.310382e+05 8.126553e+05 8.045194e+05 3.220367e+04 7.723823e+05 4.423963e+05 7.566414e+05 1.947497e+06 9.136972e+05 5.659970e+05 5.680665e+05 1.247295e+06 2.169020e+06 3.470496e+05 3.843916e+06 1.630195e+06 1.888211e+06 2.151451e+06 8.941294e+05 7.504495e+05 5.312626e+05 8.072920e+05 8.979726e+05 1.801848e+06 6.282529e+05 1.915477e+05 5.216366e+05 7.480813e+05 9.016662e+04 9.831964e+04 2.155903e+05 1.203708e+06 3.320883e+05 9.269598e+05 6.463321e+05 5.571682e+05 2.463063e+06 5.561628e+05 2.775665e+05 8.163481e+05 1.589212e+05 5.011397e+05 1.248775e+06 9.000336e+05 4.703842e+05 2.522413e+05 4.671349e+05 1.300644e+06 3.192278e+05 4.827815e+05 5.105001e+05 3.322145e+05 4.418389e+05 5.738685e+05 5.271031e+05 9.937903e+05 2.878154e+05 1.110930e+05 1.373834e+05 8.480906e+05 6.160422e+05 3.308381e+05 1.446078e+06 5.183211e+05 3.564984e+05 3.659523e+05 4.857908e+05 1.587536e+05 1.882167e+05 9.028948e+05 7.919860e+05 5.397727e+05 5.181809e+05 2.337819e+05 7.912066e+05 1.541874e+05 4.382345e+06 3.191117e+05 2.078466e+05 2.806690e+05 4.035665e+05 1.659198e+06 2.346459e+06 3.628466e+06 5.466579e+05 1.242311e+06 1.599843e+05 7.709259e+04 5.307847e+05 4.276346e+05 9.580114e+05 7.040780e+05 9.832298e+05 4.708138e+05 6.877605e+05 1.485312e+06 1.458461e+06 6.903250e+05 2.535843e+05 3.105178e+05 2.949136e+06 8.860798e+05 5.007671e+05 2.321751e+05 6.860761e+05 1.024301e+06 4.211159e+05 1.717417e+05 4.560087e+05 1.674195e+06 1.477749e+06 3.545021e+05 9.704753e+05 1.116356e+06 4.358245e+05 5.937881e+05 1.397839e+06 2.494137e+05 2.140490e+06 4.973976e+05 7.555002e+05 1.989954e+06 3.402780e+06 3.491793e+05 1.360739e+06 6.134397e+05 5.175151e+05 5.362637e+05 1.931116e+05 3.039604e+05 1.147283e+06 7.244570e+05 5.114849e+06 1.189330e+06 5.999233e+05 7.139589e+05 4.593607e+06 1.035306e+06 9.546703e+04 2.612851e+05 2.941121e+05 8.078810e+05 2.399085e+05 4.453797e+05 1.343604e+05 2.245474e+05 1.032570e+06 7.443411e+06 3.660130e+05 9.085096e+05 3.600482e+05 1.088070e+05 1.023707e+05 3.063570e+05 1.201579e+06 6.231943e+05 1.086455e+06 7.803076e+05 7.004951e+05 6.859752e+05 4.140143e+05 9.298790e+05 6.879588e+05 7.139190e+05 3.778835e+05 3.153539e+05 2.447764e+05 3.524245e+05 3.763296e+05 1.278937e+06 1.174760e+06 6.156584e+05 5.296241e+05 1.293817e+05 3.961207e+05 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2.084077e+05 1.028085e+05 7.549391e+05 3.012656e+05 1.000977e+05 4.108263e+05 5.142391e+05 8.564973e+05 2.151358e+05 2.289683e+05 2.441188e+05 3.180102e+06 1.616344e+05 1.734770e+05 4.390435e+05 5.296874e+05 4.433683e+05 2.552622e+05 1.178358e+05 5.434964e+05 2.852615e+05 6.766490e+05 5.187768e+05 2.928026e+05 3.080114e+05 8.606483e+05 3.136122e+05 4.238039e+05 3.944164e+05 4.395082e+05 2.106633e+05 1.473390e+05 4.056388e+05 C9 H16 O7_1.947 1.144351e+05 1.797494e+06 1.547956e+06 1.371004e+06 6.625457e+04 1.035984e+06 1.576178e+06 1.579296e+06 50402.92 9.751329e+05 2.184871e+06 1.501662e+06 44625.28 9.419481e+05 1.740470e+06 1.429177e+06 4.461788e+04 1.717407e+06 1.211389e+06 1.307429e+06 9.917923e+04 1.327959e+06 1.426725e+06 2.258152e+06 91042.404 1.414041e+06 1.141170e+06 1.136108e+06 5.841570e+04 1.412579e+06 1.202131e+06 2.193702e+06 74683.43 1.698164e+06 1.274186e+06 1.201812e+06 8.899381e+04 1.459002e+06 1.455158e+06 1.312979e+06 8.917964e+04 1.327361e+06 1.743326e+06 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2.695244e+06 1.809267e+06 2.720817e+06 3.461924e+06 1.812076e+06 5.200514e+05 6.453634e+05 1.811594e+06 2.443879e+06 5.781213e+05 2.558922e+06 5.923309e+05 1.389325e+06 7.407371e+05 3.365987e+05 2.518768e+05 8.187428e+05 4.184175e+06 1.596629e+06 1.903340e+06 C15 H32 O7_1.947 1.790355e+05 1.383132e+07 1.210833e+07 1.327811e+07 1.090173e+05 1.072138e+07 1.366498e+07 1.412346e+07 94935.48 1.148004e+07 1.490349e+07 1.405460e+07 96942.01 1.105501e+07 1.156880e+07 1.425301e+07 6.487973e+05 1.200138e+07 1.238264e+07 1.348191e+07 2.235506e+05 1.147739e+07 1.475208e+07 1.235915e+07 211042.370 1.270753e+07 1.311454e+07 1.180917e+07 1.278768e+05 1.258350e+07 1.260959e+07 1.541498e+07 170623.90 1.276891e+07 1.217343e+07 1.116279e+07 1.780682e+05 1.233014e+07 1.432378e+07 1.252391e+07 1.652846e+05 1.168377e+07 1.404231e+07 1.554698e+07 7.000103e+04 1.137487e+07 1.209912e+07 1.250740e+07 1.062031e+07 1.140299e+07 4.771229e+06 9.334497e+06 6.208288e+06 9.739649e+06 7.470394e+06 8.093079e+06 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8.205748e+06 1.281616e+07 9.863480e+06 1.471555e+07 9.804040e+06 1.534805e+07 3.989844e+07 1.847391e+07 1.648014e+07 1.050785e+07 1.627129e+07 9.818704e+06 5.672488e+06 8.988876e+06 1.367001e+07 1.695224e+07 1.538238e+07 1.067378e+07 1.336636e+07 9.814010e+06 1.345561e+07 2.058350e+07 1.429339e+07 1.000202e+07 1.619284e+07 1.474937e+07 1.848644e+07 1.192252e+07 1.017945e+07 7.603870e+06 2.012046e+07 1.378480e+07 1.624537e+07 1.824021e+07 1.307806e+07 1.631160e+07 2.073760e+07 1.273789e+07 1.597623e+07 2.133981e+07 1.363507e+07 9.393181e+06 1.391568e+07 9.688849e+06 2.460258e+07 4.897184e+06 5.529655e+06 9.056227e+06 7.547358e+06 1.447576e+07 1.523830e+07 1.774881e+07 C5 H12 O2_1.947 4.593199e+05 7.213222e+08 6.774589e+08 7.125291e+08 1.172455e+05 5.245296e+08 6.821394e+08 7.380035e+08 102264.88 6.462750e+08 7.290746e+08 6.698172e+08 131003.85 6.392918e+08 6.641498e+08 6.899740e+08 1.005325e+05 6.548943e+08 6.904825e+08 6.835394e+08 2.109290e+05 6.080697e+08 6.810380e+08 7.446809e+08 183291.670 6.232415e+08 6.544946e+08 7.393920e+08 1.291611e+05 6.192974e+08 6.823852e+08 8.332622e+08 175673.95 6.554528e+08 3.957068e+08 7.415621e+08 1.717033e+05 6.877755e+08 7.306346e+08 6.644616e+08 1.590043e+05 6.279915e+08 7.386888e+08 8.118825e+08 8.405866e+04 4.884053e+08 6.841496e+08 6.821139e+08 6.165854e+08 6.797313e+08 4.464250e+08 6.359801e+08 4.846401e+08 5.902651e+08 5.149317e+08 5.734871e+08 6.435454e+08 6.049977e+08 7.082619e+08 7.279843e+08 7.467699e+08 7.014432e+08 6.812157e+08 7.967691e+08 7.927312e+08 5.999317e+08 6.665427e+08 6.712666e+08 6.521422e+08 6.755845e+08 8.215226e+08 7.183291e+08 7.786733e+08 8.653978e+08 6.013034e+08 6.966367e+08 6.158611e+08 6.579159e+08 2.385712e+08 6.677304e+08 5.938016e+08 6.026274e+08 6.248844e+08 6.426389e+08 5.915150e+08 6.019787e+08 4.340203e+08 5.021754e+08 5.939919e+08 6.238232e+08 6.777770e+08 6.368152e+08 7.166678e+08 5.633697e+08 7.665316e+08 6.320741e+08 8.729806e+08 5.196050e+08 6.071473e+08 5.454043e+08 5.363113e+08 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7.389741e+08 7.221750e+08 1.279049e+09 6.142996e+08 6.039196e+08 1.006033e+09 6.252226e+08 7.980566e+08 6.853833e+08 6.883599e+08 1.071623e+09 6.493014e+08 1.015476e+09 7.627578e+08 6.602457e+08 8.933435e+08 1.537590e+09 6.452462e+08 1.149085e+09 9.924597e+08 6.818435e+08 1.080456e+09 1.061646e+09 1.217027e+09 6.803256e+08 7.208741e+08 7.010534e+08 5.984108e+08 7.813441e+08 5.924578e+08 9.840862e+08 8.313163e+08 6.593165e+08 6.624928e+08 5.858396e+08 7.350701e+08 7.414361e+08 7.610545e+08 1.309989e+09 8.565479e+08 9.370318e+08 6.250987e+08 8.363044e+08 6.640988e+08 5.369432e+08 7.683001e+08 8.305752e+08 9.404153e+08 9.887028e+08 7.558626e+08 7.798702e+08 7.439234e+08 8.154622e+08 1.010722e+09 6.941039e+08 7.311279e+08 7.643174e+08 7.266734e+08 8.948704e+08 7.329872e+08 7.260909e+08 6.077275e+08 7.274429e+08 7.406428e+08 8.053810e+08 7.872538e+08 7.060456e+08 8.429674e+08 7.798893e+08 7.827305e+08 7.129463e+08 9.542368e+08 7.538245e+08 5.817295e+08 7.665893e+08 6.062763e+08 1.054320e+09 5.012669e+08 5.573550e+08 5.511570e+08 5.153190e+08 7.746231e+08 7.764909e+08 8.071811e+08 C12 H36 N9 O2 P_1.947 2.529721e+04 8.725290e+05 6.695831e+05 8.341507e+05 1.590906e+04 9.602930e+05 8.011969e+05 8.175273e+05 19267.66 6.016261e+05 8.590114e+05 9.158842e+05 21149.02 8.383447e+05 9.837236e+05 8.844303e+05 9.511322e+04 6.294828e+05 4.990388e+05 8.273536e+05 5.137899e+04 1.004538e+06 8.320037e+05 9.230378e+05 49523.933 7.404657e+05 7.418998e+05 8.676156e+05 2.972059e+04 8.244476e+05 8.814700e+05 9.583094e+05 41550.06 6.768864e+05 7.237613e+05 7.227394e+05 3.847552e+04 6.952426e+05 8.537460e+05 1.008332e+06 3.062781e+04 6.454632e+05 1.023391e+06 9.061475e+05 1.422879e+04 8.014092e+05 6.989811e+05 6.923979e+05 6.565448e+05 8.833217e+05 2.798245e+05 6.441410e+05 2.772272e+05 4.195749e+05 6.405626e+05 5.940165e+05 7.892846e+05 5.445211e+05 8.775966e+05 1.446051e+06 1.168917e+06 9.665509e+05 8.314454e+05 1.111974e+06 1.045736e+06 1.223860e+06 1.087520e+06 7.621979e+05 9.892949e+05 9.286069e+05 1.089166e+06 9.970976e+05 1.510935e+06 1.720216e+06 1.020396e+06 6.097156e+05 1.125111e+06 9.922450e+05 3.973210e+05 9.889263e+05 6.796036e+05 9.982479e+05 8.506455e+05 9.820180e+05 8.046660e+05 1.002914e+06 7.481135e+05 4.406977e+05 1.098039e+06 1.205020e+06 1.503386e+06 7.652017e+05 8.018188e+05 6.099728e+05 1.615136e+06 8.540047e+05 1.844642e+06 4.568140e+05 7.470306e+05 7.298994e+05 7.585562e+05 1.451400e+06 2.956467e+05 7.317419e+05 2.113436e+06 1.144894e+06 1.020136e+06 1.705157e+06 4.933501e+05 4.359175e+05 6.904703e+05 2.067652e+06 8.436947e+05 6.994745e+05 5.270390e+05 4.386567e+05 9.376460e+05 4.574574e+05 5.323332e+05 1.499212e+06 3.486065e+05 5.286065e+05 2.855454e+05 5.350783e+05 6.336371e+05 4.015427e+05 1.157797e+06 7.850010e+05 6.474304e+05 7.230178e+05 7.437925e+05 3.101028e+05 8.827642e+05 7.466380e+05 9.204274e+05 8.374189e+05 1.045992e+06 1.417609e+06 8.855987e+05 1.236962e+06 3.413174e+05 1.353124e+06 1.499371e+06 3.088612e+05 4.576823e+05 7.810386e+05 9.541952e+05 8.927806e+05 9.077783e+05 2.319557e+06 1.285966e+06 2.252133e+06 1.374146e+06 8.668758e+05 5.825525e+05 5.431550e+05 1.650118e+06 1.659091e+06 2.969804e+06 7.442988e+05 1.063107e+06 1.215430e+06 3.820922e+05 3.883048e+05 1.101906e+06 5.060601e+05 4.070836e+05 5.345396e+05 5.644387e+05 4.142319e+05 3.737757e+05 6.342807e+05 6.344421e+05 6.574885e+05 9.643004e+05 5.927413e+05 1.110153e+06 7.470389e+05 1.586641e+06 9.091025e+05 3.483364e+06 4.677581e+05 5.822043e+05 2.281459e+06 3.952382e+05 4.551014e+05 4.942038e+05 6.463685e+05 2.480299e+06 4.595887e+05 4.157135e+06 6.477617e+05 3.169812e+05 7.502164e+05 3.461662e+06 2.981893e+05 2.927317e+06 4.035210e+06 4.475122e+05 3.662753e+06 3.030396e+06 3.664633e+06 5.291476e+05 4.295840e+05 5.659937e+05 3.716160e+05 3.860746e+05 2.757175e+05 1.109661e+06 7.763259e+05 5.248624e+05 5.266182e+05 4.267554e+05 7.449085e+05 4.101294e+05 8.579769e+05 5.727790e+06 9.147402e+05 1.078229e+06 4.329619e+05 6.554099e+05 5.690795e+05 1.079362e+05 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3.840707e+08 3.825113e+08 4.436756e+05 3.300475e+08 3.847805e+08 4.240146e+08 490510.176 3.404442e+08 3.647943e+08 4.020635e+08 3.294317e+05 3.402770e+08 3.694012e+08 4.388195e+08 355636.54 3.376820e+08 3.512436e+08 3.858518e+08 1.734770e+05 3.639897e+08 3.878457e+08 3.538225e+08 3.738123e+05 3.310739e+08 3.876325e+08 4.311475e+08 2.681473e+05 3.846484e+08 3.638603e+08 3.470940e+08 3.228851e+08 3.745210e+08 2.138921e+08 3.348549e+08 2.521794e+08 2.973453e+08 2.917824e+08 3.016295e+08 3.447118e+08 3.310891e+08 3.591415e+08 4.011010e+08 3.858039e+08 3.531200e+08 3.714974e+08 4.220012e+08 4.131301e+08 3.116795e+08 3.676018e+08 3.390441e+08 3.604049e+08 3.760816e+08 4.522358e+08 4.016598e+08 4.224457e+08 4.724258e+08 3.337773e+08 3.835170e+08 3.402260e+08 3.705170e+08 1.325509e+08 3.590699e+08 3.218894e+08 3.376287e+08 3.205183e+08 3.535603e+08 3.248801e+08 3.157345e+08 2.398744e+08 2.677286e+08 3.388804e+08 3.473688e+08 3.583797e+08 3.510565e+08 3.963770e+08 3.093267e+08 3.997238e+08 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3.258945e+08 3.045642e+08 3.995387e+08 3.415157e+08 3.482197e+08 3.782554e+08 3.978086e+08 4.105864e+08 6.708123e+08 3.260280e+08 3.349631e+08 5.424519e+08 3.448833e+08 4.250651e+08 3.750000e+08 3.709532e+08 6.077845e+08 3.473052e+08 5.592819e+08 4.231354e+08 3.390389e+08 4.549142e+08 8.276238e+08 3.522728e+08 6.032055e+08 5.661745e+08 3.735447e+08 6.092415e+08 5.732068e+08 6.827109e+08 3.588888e+08 4.055665e+08 3.871831e+08 3.386635e+08 4.354624e+08 3.246579e+08 5.404429e+08 4.494887e+08 3.322296e+08 3.685411e+08 3.280148e+08 4.025027e+08 4.156811e+08 4.348056e+08 6.557099e+08 4.379594e+08 4.953391e+08 1.515856e+08 4.545978e+08 3.681437e+08 2.969379e+08 3.964794e+08 4.614189e+08 5.261347e+08 4.837146e+08 3.979495e+08 4.359417e+08 4.009712e+08 4.457838e+08 5.236915e+08 3.591528e+08 4.079598e+08 4.150887e+08 3.730939e+08 4.843144e+08 3.762272e+08 4.031766e+08 3.339082e+08 4.043437e+08 4.152328e+08 4.476745e+08 4.263304e+08 3.845508e+08 4.441907e+08 4.488262e+08 4.249135e+08 3.936160e+08 5.074864e+08 4.115685e+08 3.118856e+08 4.230828e+08 3.363451e+08 5.805700e+08 2.796772e+08 3.093710e+08 2.811355e+08 2.818933e+08 4.186555e+08 4.291432e+08 4.500832e+08 Pyridine_1.948 2.600053e+05 7.098995e+05 4.240172e+06 5.960738e+06 4.223472e+04 2.619320e+06 3.454392e+06 4.229635e+06 57629.52 3.185178e+06 3.446612e+06 3.958778e+06 144239.40 3.181401e+06 3.503908e+06 3.250335e+06 1.632871e+05 3.058549e+06 3.611145e+06 3.789389e+06 1.631054e+05 3.574974e+06 3.278869e+06 3.667729e+06 227160.572 3.201612e+06 3.367767e+06 3.869057e+06 3.915838e+05 3.404428e+06 3.166071e+06 4.288603e+06 64832.98 2.755868e+06 3.787543e+06 3.665231e+06 6.976844e+05 3.143908e+06 3.455130e+06 3.391815e+06 1.272433e+05 2.735745e+06 3.870570e+06 4.765953e+06 4.123131e+05 3.037214e+06 3.463438e+06 2.996472e+06 3.289689e+06 3.193220e+06 2.180300e+06 3.353299e+06 2.374498e+06 3.260037e+06 2.525170e+06 3.066116e+06 3.671344e+06 3.465100e+06 3.430429e+06 3.745658e+06 3.765039e+06 3.084133e+06 3.825422e+06 4.008526e+06 4.064425e+06 3.641167e+06 3.679189e+06 3.246664e+06 3.276214e+06 3.391268e+06 3.983538e+06 3.530870e+06 4.612684e+06 4.726832e+06 3.113762e+06 3.563839e+06 3.209295e+06 2.884457e+06 1.012994e+06 3.857338e+06 2.951160e+06 3.034179e+06 2.979617e+06 3.321811e+06 2.858216e+06 3.474014e+06 2.578333e+06 2.476303e+06 2.762926e+06 3.069373e+06 3.753570e+06 3.191446e+06 3.608372e+06 2.602323e+06 4.041848e+06 3.282508e+06 4.293756e+06 2.537975e+06 2.942263e+06 2.761218e+06 2.580168e+06 3.603359e+06 2.072369e+06 3.179896e+06 3.761934e+06 3.430476e+06 3.251406e+06 3.506661e+06 2.591099e+06 2.710615e+06 3.413722e+06 4.644208e+06 3.748498e+06 2.907247e+06 3.720369e+06 2.557231e+06 4.140375e+06 3.058041e+06 2.849181e+06 3.846096e+06 2.555999e+06 2.895411e+06 2.813151e+06 3.156515e+06 3.336311e+06 2.980261e+06 4.692430e+06 2.992505e+06 2.522239e+06 2.830354e+06 3.005134e+06 3.854192e+05 3.548287e+06 3.185902e+06 2.604230e+06 3.030680e+06 4.036221e+06 3.323104e+06 3.013312e+06 3.593810e+06 2.432131e+06 4.352318e+06 3.940325e+06 2.220971e+06 2.848065e+06 3.500900e+06 3.059359e+06 3.511704e+06 3.573941e+06 4.663641e+06 3.451596e+06 4.516265e+06 3.722412e+06 3.041008e+06 3.156470e+06 3.066253e+06 3.827097e+06 4.490874e+06 5.080202e+06 2.772719e+06 3.444773e+06 4.008155e+06 2.339202e+06 3.447895e+06 3.225393e+06 2.389235e+06 2.920543e+06 3.252452e+06 2.828344e+06 3.035587e+06 3.455686e+06 3.092498e+06 3.246716e+06 2.683005e+06 4.393260e+06 3.320857e+06 3.403851e+06 4.080154e+06 3.905708e+06 3.872679e+06 6.178322e+06 3.832656e+06 2.921323e+06 4.713128e+06 3.385255e+06 3.510623e+06 3.331200e+06 3.824543e+06 5.161857e+06 3.243314e+06 5.044356e+06 3.974588e+06 2.923004e+06 3.988562e+06 7.780503e+06 2.904265e+06 5.930357e+06 5.484700e+06 3.459570e+06 5.347737e+06 5.694084e+06 6.637076e+06 3.350531e+06 3.538532e+06 3.681841e+06 2.846608e+06 3.801946e+06 3.459294e+06 4.868696e+06 4.681567e+06 3.363202e+06 3.089490e+06 3.083451e+06 3.763371e+06 4.533850e+06 4.548483e+06 7.265854e+06 4.781449e+06 4.582742e+06 7.575936e+05 4.336873e+06 2.978874e+06 3.424650e+06 4.005211e+06 3.961956e+06 5.045267e+06 4.178526e+06 3.634559e+06 4.468974e+06 4.183275e+06 4.182296e+06 5.212727e+06 3.412023e+06 3.637255e+06 4.032762e+06 3.750475e+06 4.215605e+06 3.965146e+06 6.178533e+05 3.562770e+06 3.651416e+06 3.966798e+06 4.107847e+06 4.062100e+06 3.156879e+06 4.748832e+06 3.762438e+06 3.429937e+06 3.498564e+06 4.489113e+06 3.857779e+06 3.254671e+06 4.009423e+06 2.743893e+06 6.076752e+06 2.344669e+06 2.788940e+06 3.201285e+06 2.460475e+06 3.948560e+06 4.385459e+06 4.530773e+06 C5 H7 N_1.948 6.269432e+04 2.081380e+06 2.107199e+06 3.223330e+06 4.205751e+04 1.440938e+06 1.975744e+06 2.472570e+06 45164.73 2.031690e+06 2.404279e+06 2.297273e+06 40425.78 1.992939e+06 2.200147e+06 2.520713e+06 7.628868e+04 1.854167e+06 2.464102e+06 2.064388e+06 9.287271e+04 2.045801e+06 2.285323e+06 2.279733e+06 78847.970 1.955018e+06 2.303861e+06 2.547548e+06 8.174208e+04 2.094782e+06 2.076961e+06 2.486139e+06 100022.25 1.898238e+06 2.259229e+06 1.969337e+06 3.720518e+05 2.103702e+06 2.163949e+06 2.867322e+06 5.699088e+04 1.910981e+06 2.236351e+06 2.492828e+06 2.260538e+05 1.844086e+06 2.276710e+06 2.083036e+06 2.221541e+06 2.028161e+06 1.110162e+06 1.786118e+06 1.342100e+06 1.539432e+06 1.620002e+06 2.355448e+06 1.981972e+06 2.090680e+06 1.904635e+06 2.316708e+06 2.340419e+06 2.294521e+06 2.238652e+06 2.284742e+06 1.939554e+06 1.841360e+06 1.980308e+06 1.804091e+06 2.025544e+06 2.129413e+06 2.542707e+06 2.273170e+06 3.185148e+06 2.651312e+06 2.022727e+06 2.189731e+06 2.144835e+06 1.928578e+06 7.220523e+05 1.726189e+06 1.868350e+06 1.970322e+06 1.819251e+06 2.300155e+06 1.856579e+06 1.739631e+06 1.180618e+06 1.474674e+06 1.698034e+06 1.974555e+06 2.329166e+06 1.934500e+06 2.313142e+06 1.599512e+06 2.153234e+06 1.913296e+06 2.488319e+06 1.460886e+06 1.845364e+06 1.660689e+06 1.783475e+06 2.122349e+06 1.282634e+06 2.024164e+06 2.122851e+06 2.028368e+06 1.738842e+06 2.180976e+06 1.584896e+06 1.485291e+06 1.999544e+06 2.613388e+06 2.246202e+06 1.654583e+06 2.081025e+06 1.648745e+06 2.084541e+06 1.681073e+06 1.479498e+06 2.195143e+06 1.441894e+06 1.909288e+06 1.343816e+06 2.032269e+06 1.788963e+06 1.623791e+06 2.488689e+06 1.734630e+06 1.705762e+06 1.870611e+06 2.092085e+06 2.258423e+05 1.996748e+06 1.814588e+06 1.781018e+06 2.221582e+06 2.993352e+06 2.014821e+06 1.647715e+06 1.919112e+06 1.402487e+06 2.618766e+06 2.344670e+06 1.341552e+06 1.577929e+06 1.962731e+06 1.817031e+06 1.932805e+06 2.285874e+06 3.108837e+06 2.324488e+06 2.892235e+06 2.367266e+06 2.041640e+06 1.947288e+06 1.885304e+06 2.505287e+06 2.480781e+06 3.400288e+06 1.901844e+06 1.781929e+06 2.209397e+06 1.544280e+06 2.062400e+06 2.097972e+06 1.659402e+06 1.712830e+06 1.582646e+06 1.534937e+06 1.661163e+06 1.718351e+06 1.783673e+06 1.414059e+06 1.652946e+06 2.627553e+06 2.336815e+06 1.920341e+06 2.186246e+06 2.183274e+06 2.244033e+06 3.377553e+06 2.257653e+06 1.788826e+06 3.024589e+06 1.923529e+06 2.255653e+06 2.162109e+06 2.620400e+06 3.367007e+06 1.753366e+06 3.311853e+06 2.703287e+06 1.846448e+06 2.424633e+06 4.067278e+06 2.048758e+06 3.487546e+06 3.053449e+06 2.094585e+06 3.235634e+06 3.403820e+06 3.777256e+06 1.811168e+06 2.182184e+06 2.052822e+06 1.890063e+06 2.453500e+06 1.720849e+06 3.067475e+06 2.205488e+06 1.892897e+06 2.123853e+06 1.661506e+06 2.567427e+06 2.865926e+06 2.469931e+06 5.444524e+06 2.415853e+06 3.032376e+06 1.940542e+06 3.035716e+06 2.202507e+06 1.903191e+06 1.879065e+06 2.529000e+06 3.608088e+06 2.465469e+06 2.315020e+06 2.690302e+06 2.337854e+06 2.498444e+06 2.745531e+06 2.015315e+06 2.307360e+06 2.468849e+06 2.208740e+06 2.290450e+06 2.281751e+06 2.227891e+06 1.949877e+06 1.976009e+06 2.152863e+06 2.512775e+06 2.417830e+06 2.368509e+06 2.644004e+06 2.519762e+06 1.941174e+06 2.197888e+06 2.904333e+06 2.340755e+06 1.899584e+06 2.365390e+06 1.893421e+06 3.299678e+06 1.531480e+06 1.622325e+06 1.532886e+06 1.761191e+06 2.282588e+06 2.333124e+06 2.466169e+06 C6 H20 N9 O3 P_1.948 6.490718e+04 1.074731e+06 8.528297e+05 1.030947e+06 3.681286e+04 6.422610e+05 1.256508e+06 9.760660e+05 27436.26 8.341249e+05 1.110785e+06 1.303954e+06 26605.63 8.186515e+05 6.924346e+05 1.037630e+06 3.800008e+04 8.723798e+05 9.758495e+05 9.814165e+05 4.991856e+04 8.400422e+05 1.176665e+06 1.083202e+06 47556.159 8.604951e+05 9.424604e+05 9.617511e+05 3.102212e+04 1.025477e+06 9.022628e+05 1.109470e+06 46305.24 8.085001e+05 1.102594e+06 7.071745e+05 4.741794e+04 9.923642e+05 1.020837e+06 1.004277e+06 4.090446e+04 8.842862e+05 1.158206e+06 1.138920e+06 1.664250e+04 7.262988e+05 1.060928e+06 8.788456e+05 6.518674e+05 7.611531e+05 1.067731e+05 8.634385e+05 3.920592e+05 1.086730e+06 5.100661e+05 7.565388e+05 5.781383e+05 8.870558e+05 5.752813e+05 5.540173e+05 1.323277e+06 6.340203e+05 3.308433e+05 8.639354e+05 6.698174e+05 3.890646e+06 5.795371e+05 4.475097e+05 9.141637e+05 5.058838e+05 7.909294e+05 5.495573e+05 3.142324e+05 3.559203e+05 2.383524e+06 1.135110e+06 2.581995e+06 1.675780e+06 1.794440e+05 3.138935e+06 1.409854e+06 1.247688e+06 1.377861e+06 1.513916e+06 1.291994e+06 2.501106e+06 1.214945e+06 5.541316e+05 1.943151e+06 2.040787e+06 1.752444e+06 2.304350e+06 5.201126e+05 3.434334e+05 3.050044e+05 5.091149e+05 6.254086e+05 3.558554e+05 2.403157e+05 6.549202e+05 2.483342e+05 3.279968e+05 2.083164e+05 6.089632e+05 3.558906e+05 4.071165e+05 3.264218e+05 3.783723e+05 9.406424e+05 1.785540e+05 4.773583e+05 5.024634e+05 5.753470e+05 1.713747e+05 3.117028e+05 1.924470e+05 1.977051e+05 3.738941e+05 2.854751e+05 9.353538e+05 8.811848e+04 1.845865e+05 1.422363e+05 1.184643e+05 1.433684e+05 2.026435e+05 4.098370e+05 1.189457e+05 3.430795e+05 2.825767e+05 7.083156e+05 6.786710e+04 7.002057e+05 8.520488e+05 6.126458e+05 3.899751e+05 8.399953e+05 6.549941e+05 4.065431e+05 1.046721e+06 2.893871e+05 7.472658e+05 6.561148e+05 6.750987e+05 3.083360e+05 6.469789e+05 8.457591e+05 2.873746e+05 6.156961e+05 8.622902e+05 7.019014e+05 2.748455e+06 1.572414e+06 6.941106e+05 3.288422e+05 1.391057e+05 7.152980e+05 5.312662e+05 5.281405e+05 3.434229e+05 1.470663e+05 5.383439e+05 6.120925e+05 8.750922e+05 2.210265e+06 1.362134e+06 4.194300e+05 1.207121e+06 6.056948e+05 6.126068e+05 2.036695e+06 5.681038e+05 5.200181e+05 6.588014e+05 1.705232e+06 1.006832e+06 5.703818e+05 5.065714e+05 4.673883e+05 6.051465e+05 1.419673e+06 2.042974e+06 5.534578e+05 2.038867e+06 4.359657e+05 1.154033e+06 1.770203e+06 5.949394e+05 1.461375e+06 1.823589e+06 1.685993e+06 1.102687e+06 6.755766e+05 4.488244e+05 2.506843e+06 8.979384e+05 2.048932e+06 2.682819e+06 1.913694e+06 3.576407e+06 2.347796e+06 3.193816e+06 7.667639e+05 2.235928e+06 1.936619e+06 8.440143e+05 1.744457e+06 6.846532e+05 3.488334e+06 1.499446e+06 4.709171e+05 7.102394e+05 1.594903e+06 2.413317e+06 3.009790e+05 2.001947e+06 5.648359e+06 8.381654e+05 1.636228e+06 1.809720e+06 2.100119e+06 1.593301e+06 3.719269e+05 9.809313e+05 1.128570e+06 1.254551e+06 5.868709e+05 9.218812e+05 1.036480e+06 7.017823e+05 5.096000e+05 1.952495e+06 9.000447e+05 3.967980e+05 8.833317e+05 1.370699e+06 1.544323e+06 7.076470e+05 8.952778e+05 8.141049e+05 6.102496e+06 1.007404e+06 6.476795e+05 1.133683e+06 1.239497e+06 1.236816e+06 6.230709e+05 8.718423e+05 1.198102e+06 1.062510e+06 1.228734e+06 1.377515e+06 6.627291e+05 4.731766e+05 1.858991e+06 1.150034e+06 1.079002e+06 1.347027e+06 1.051858e+06 4.114526e+05 6.060667e+05 1.069880e+06 "10-Hydroxy-7a-methyl-3-methylenedecahydro-2H-furo[3',2':7,8]cycloocta[1,2-b]pyran-2,6(7H)-dione_1.948" 3.566590e+04 1.880234e+05 1.673369e+05 1.416514e+05 2.130766e+04 2.167661e+05 1.784021e+05 1.861020e+05 19652.53 1.597292e+05 1.834179e+05 1.943686e+05 21103.29 1.678006e+05 1.459511e+05 2.033784e+05 4.306725e+04 1.571189e+05 1.890075e+05 1.389793e+05 6.050393e+04 1.391568e+05 1.254200e+05 1.938431e+05 30227.273 2.381150e+05 1.263196e+05 2.382980e+05 2.471317e+04 1.869853e+05 1.535761e+05 2.154434e+05 32380.86 2.174939e+05 1.509137e+05 2.015770e+05 3.889702e+04 1.260899e+05 1.923394e+05 1.171589e+05 4.076989e+04 2.086380e+05 1.946680e+05 2.055305e+05 1.755224e+04 1.244887e+05 3.626882e+05 1.756142e+05 1.894648e+05 1.505075e+05 1.612019e+05 1.255449e+05 1.254440e+05 1.282639e+05 2.648084e+05 1.005316e+05 1.263199e+05 9.646742e+04 1.627690e+05 2.579955e+05 2.138663e+05 1.487733e+05 1.732409e+05 2.017524e+05 2.009853e+05 2.169902e+05 3.240936e+05 1.932717e+05 3.304459e+05 1.879757e+05 2.202866e+05 2.978788e+05 2.541815e+05 3.838170e+05 1.509616e+05 1.242923e+05 2.409320e+05 1.629752e+05 1.434523e+05 1.015279e+05 1.125144e+05 2.046060e+05 2.139808e+05 1.841647e+05 2.147775e+05 1.621580e+05 1.146137e+05 1.403678e+05 3.208774e+05 2.462187e+05 2.324498e+05 8.832810e+04 1.275429e+05 1.144626e+05 4.201073e+05 2.024746e+05 3.964062e+05 7.727130e+04 1.992316e+05 1.139874e+05 1.501895e+05 2.421312e+05 1.406126e+05 2.581457e+05 2.261155e+05 2.175158e+05 1.298833e+05 2.550126e+05 1.219665e+05 5.317495e+04 1.653961e+05 4.028367e+05 1.482172e+05 1.387407e+05 6.018572e+04 1.101235e+05 9.064022e+04 2.358306e+05 9.473183e+04 1.486132e+05 1.252513e+05 7.536647e+04 6.719309e+04 1.489327e+05 1.462615e+05 1.177844e+05 2.461937e+05 3.386162e+05 9.680775e+04 1.096446e+05 1.723263e+05 5.324143e+04 1.810174e+05 1.147396e+05 1.387024e+05 1.636484e+05 2.589495e+05 3.280245e+05 2.769287e+05 2.986564e+05 9.017117e+04 3.024605e+05 1.836356e+05 6.318250e+04 9.749869e+04 1.199612e+05 1.293745e+05 1.541236e+05 1.761548e+05 2.592176e+05 2.136383e+05 2.629719e+05 2.561430e+05 1.980891e+05 1.565570e+05 1.563216e+05 3.920780e+05 2.929748e+05 4.084873e+05 2.550016e+05 2.347856e+05 1.876683e+05 2.240997e+05 1.476141e+05 1.637147e+05 1.210864e+05 1.157018e+05 2.430550e+05 1.308088e+05 7.799177e+04 7.269460e+04 2.087878e+05 1.331952e+05 1.226176e+05 2.594208e+05 1.401877e+05 1.774116e+05 2.768557e+05 2.959854e+05 1.174712e+05 1.125029e+06 1.436589e+05 1.844688e+05 5.013431e+05 1.060848e+05 1.420056e+05 8.093631e+04 1.818882e+05 4.961859e+05 9.629456e+04 6.049476e+05 1.192549e+05 1.248727e+05 2.120545e+05 7.160438e+05 1.445837e+05 7.981910e+05 6.788117e+05 9.517339e+04 9.984153e+05 6.980392e+05 1.147944e+06 8.502972e+04 7.851108e+04 6.574445e+04 1.197010e+05 1.337432e+05 8.895967e+04 3.166244e+05 1.472238e+05 1.101637e+05 1.359823e+05 1.574749e+05 1.039898e+05 9.514232e+04 1.580790e+05 7.831743e+05 2.584066e+05 2.495553e+05 1.287822e+05 2.023896e+05 1.650615e+05 1.101070e+05 1.813252e+05 1.063025e+05 1.126859e+05 1.764646e+05 8.798336e+04 1.679834e+05 1.282481e+05 1.334120e+05 2.502050e+05 7.619365e+04 8.938166e+04 1.861992e+05 1.424518e+05 2.277860e+05 9.388095e+04 1.375275e+05 5.362313e+04 1.990158e+05 1.225681e+05 1.260678e+05 1.866676e+05 1.069588e+05 1.273631e+05 2.640738e+05 2.187088e+05 2.302039e+05 1.929488e+05 9.210367e+04 1.381339e+05 1.495107e+05 1.303241e+05 3.276096e+05 1.616142e+05 7.913404e+04 1.348868e+05 1.230251e+05 8.942629e+04 2.230945e+05 2.602025e+05 195.14704_1.948 1.146555e+05 2.368042e+06 2.245338e+06 2.523406e+06 4.028966e+04 1.588213e+06 1.974584e+06 2.404031e+06 157864.80 2.025886e+06 2.642593e+06 2.201081e+06 41716.90 1.932692e+06 1.907839e+06 2.216980e+06 3.957524e+04 2.539811e+06 2.305840e+06 1.965373e+06 8.047827e+04 1.888742e+06 2.256166e+06 2.435735e+06 48090.319 2.206343e+06 2.037969e+06 2.298656e+06 4.777433e+04 2.244621e+06 1.991796e+06 2.315231e+06 68450.53 2.263063e+06 2.084646e+06 1.797443e+06 7.388514e+04 2.514823e+06 2.351503e+06 1.596896e+06 7.274413e+04 2.344071e+06 2.580135e+06 2.406603e+06 3.235811e+04 1.939124e+06 2.297635e+06 1.993121e+06 2.207419e+06 2.081708e+06 1.045238e+06 1.550099e+06 1.062751e+06 2.021135e+06 1.226065e+06 1.535799e+06 1.488556e+06 1.801788e+06 1.728027e+06 2.137855e+06 2.680755e+06 2.771832e+06 2.435312e+06 3.437661e+06 2.732997e+06 3.475025e+06 2.946736e+06 2.375823e+06 3.060893e+06 2.350673e+06 3.013279e+06 3.191983e+06 3.143836e+06 3.226163e+06 2.756619e+06 2.417493e+06 2.773472e+06 2.817735e+06 2.736670e+05 2.954382e+06 2.200172e+06 2.150353e+06 2.822479e+06 2.226804e+06 2.244030e+06 3.020300e+06 2.502822e+06 1.993284e+06 3.012009e+06 2.656836e+06 3.189339e+06 2.831014e+06 2.288093e+06 2.190014e+06 3.199503e+06 2.062840e+06 4.028737e+06 1.433836e+06 2.296558e+06 2.326669e+06 2.118666e+06 2.520983e+06 1.255288e+06 3.200032e+06 3.789512e+06 2.984316e+06 3.017456e+06 2.833533e+06 2.198962e+06 1.255002e+06 2.448058e+06 4.231660e+06 3.160908e+06 1.648629e+06 1.598089e+06 1.509345e+06 9.553116e+05 1.590188e+06 1.496843e+06 2.751010e+06 1.654696e+06 1.537548e+06 1.519813e+06 2.059733e+06 1.761635e+06 1.564918e+06 3.187228e+06 1.695091e+06 1.409895e+06 1.766137e+06 2.369175e+06 1.106190e+05 2.482501e+06 2.266908e+06 2.651519e+06 2.682176e+06 4.066133e+06 2.894925e+06 2.227912e+06 3.051609e+06 1.455449e+06 3.445443e+06 2.937025e+06 1.319712e+06 1.730717e+06 2.755791e+06 2.831201e+06 2.835213e+06 4.101040e+06 5.563089e+06 3.896890e+06 4.554423e+06 3.913033e+06 2.003218e+06 1.284984e+06 1.523891e+06 2.645673e+06 2.900887e+06 2.840111e+06 1.991108e+06 2.048724e+06 2.134796e+06 1.337264e+06 1.471360e+06 1.934281e+06 1.417298e+06 1.500281e+06 1.332651e+06 1.457756e+06 1.812910e+06 1.611967e+06 1.387803e+06 2.101186e+06 1.770894e+06 3.511643e+06 2.415622e+06 1.896075e+06 2.752842e+06 2.845018e+06 2.596156e+06 5.280958e+06 1.546626e+06 1.487049e+06 4.209207e+06 1.014823e+06 1.296892e+06 1.896185e+06 2.155015e+06 4.911811e+06 1.786984e+06 4.940916e+06 1.580298e+06 1.251553e+06 1.802536e+06 5.536580e+06 1.050284e+06 5.749456e+06 4.676140e+06 1.433587e+06 5.373145e+06 4.729183e+06 5.087103e+06 1.299318e+06 1.552599e+06 1.553671e+06 1.159756e+06 1.561246e+06 8.277124e+05 2.707960e+06 1.724589e+06 1.425877e+06 1.534303e+06 1.762616e+06 2.099140e+06 1.383831e+06 2.255991e+06 6.815427e+06 2.470611e+06 1.563729e+06 1.541443e+06 3.064494e+06 1.572822e+06 9.153527e+05 1.743632e+06 1.502297e+06 2.298966e+06 2.028192e+06 1.547650e+06 1.541574e+06 1.627818e+06 1.483993e+06 3.115086e+06 2.117478e+06 1.538319e+06 1.714788e+06 2.121892e+06 2.843978e+06 2.533847e+06 1.745046e+06 1.330296e+06 1.948515e+06 1.489588e+06 1.151015e+06 1.932074e+06 1.592805e+06 1.916378e+06 1.356776e+06 1.679403e+06 1.872317e+06 1.814828e+06 1.396898e+06 1.719278e+06 1.512916e+06 1.395596e+06 2.678902e+06 7.367596e+05 1.170661e+06 1.817168e+06 1.329759e+06 1.604541e+06 1.953544e+06 1.637038e+06 C11 H4 N7 O7 P3 S2_1.949 4.300271e+04 3.646689e+07 3.278649e+07 2.839743e+07 2.616663e+04 1.967049e+07 2.990721e+07 3.331277e+07 25403.26 2.844589e+07 3.385514e+07 3.193954e+07 26486.27 2.544435e+07 2.701282e+07 3.541263e+07 2.742823e+04 2.922575e+07 3.040054e+07 2.764755e+07 5.635530e+04 2.828102e+07 2.956472e+07 2.736390e+07 52400.519 3.608160e+07 2.677770e+07 2.834723e+07 2.884020e+04 3.182397e+07 2.826047e+07 3.589979e+07 38714.57 3.092086e+07 2.741119e+07 2.541893e+07 4.664390e+04 3.486418e+07 3.633887e+07 1.078009e+07 5.347020e+04 4.662932e+07 8.383223e+06 4.201781e+07 1.945552e+04 3.218701e+07 3.086328e+07 2.913437e+07 3.158436e+07 2.370483e+07 1.028153e+07 3.598459e+07 2.304429e+07 2.299485e+07 1.057612e+07 1.536070e+07 1.975703e+07 1.232749e+07 2.190461e+07 2.185423e+07 2.135791e+07 1.659842e+07 2.283810e+07 1.371484e+07 3.438263e+07 2.823138e+07 2.592781e+07 1.000489e+07 1.665759e+07 2.755189e+07 2.579761e+07 1.295639e+07 2.418677e+07 2.748477e+07 1.815299e+07 2.067499e+07 1.804556e+07 1.619884e+07 5.618766e+04 2.861985e+07 1.538445e+07 1.874020e+07 1.732566e+07 1.506957e+07 1.287102e+07 1.669555e+07 1.343260e+07 5.425909e+06 1.567016e+07 8.586786e+06 1.982007e+07 2.302748e+07 2.705716e+07 1.550703e+07 2.248575e+07 2.162310e+07 3.467582e+07 2.781127e+07 3.262742e+07 2.217834e+07 8.752810e+06 2.776581e+07 2.069132e+07 3.053131e+07 1.449880e+07 1.460977e+07 1.586562e+07 1.322687e+07 7.860723e+06 1.120414e+07 2.011885e+07 8.793249e+06 1.153280e+07 3.743332e+07 2.765115e+07 1.288551e+07 9.900751e+06 3.795893e+07 1.215194e+07 1.024613e+07 2.028971e+07 1.477106e+07 1.899541e+07 1.459729e+07 1.522266e+07 1.170804e+07 1.412115e+07 1.228386e+07 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3.945343e+06 2.224363e+06 3.763525e+06 2.575828e+06 1.084158e+06 1.738776e+06 2.976012e+06 4.285368e+06 3.639459e+06 2.497349e+06 2.872100e+06 2.471705e+06 2.764857e+06 4.906588e+06 3.571376e+06 2.871838e+06 3.949149e+06 3.924893e+06 4.569754e+06 3.287144e+06 2.046760e+06 1.562831e+06 6.227195e+06 3.120336e+06 3.258783e+06 4.358041e+06 2.712456e+06 3.286087e+06 4.773088e+06 3.064816e+06 4.096739e+06 5.524667e+06 2.623989e+06 2.725729e+06 2.960212e+06 2.499272e+06 5.755294e+06 1.601067e+06 1.555394e+06 2.683101e+06 1.852563e+06 3.036426e+06 3.385351e+06 5.171496e+06 C11 H25 N O6_1.949 2.282331e+04 6.573525e+05 6.211062e+05 5.859289e+05 1.359787e+04 4.288050e+05 5.492857e+05 6.671723e+05 15029.21 3.912632e+05 6.856326e+05 5.860687e+05 16862.68 4.959294e+05 6.332779e+05 5.326429e+05 2.306515e+05 6.014309e+05 6.166110e+05 5.401985e+05 3.795996e+04 4.803707e+05 6.705167e+05 5.097379e+05 23119.469 5.990984e+05 5.265558e+05 6.195166e+05 2.052039e+04 5.094573e+05 5.689875e+05 7.637596e+05 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7.045581e+05 4.916653e+05 9.058075e+05 7.703301e+05 3.710711e+06 2.557521e+05 3.435347e+05 2.335648e+05 1.392576e+06 2.466417e+05 1.630733e+06 2.536875e+06 1.467641e+06 3.561285e+06 2.010384e+06 2.585553e+06 4.935385e+05 9.935632e+05 7.819015e+05 1.864905e+05 4.324728e+05 2.711060e+05 1.612497e+06 7.894426e+05 2.818154e+05 3.569703e+05 1.338471e+06 8.880867e+05 9.918178e+04 9.131938e+05 4.821966e+06 8.505849e+05 3.296477e+05 4.567926e+05 7.727595e+05 4.861061e+05 2.091945e+05 5.301955e+05 3.584859e+05 5.125365e+05 3.409585e+05 2.643666e+05 5.122676e+05 2.128149e+05 1.485120e+05 9.280066e+05 4.311023e+05 1.168793e+05 5.892317e+05 6.799778e+05 1.184917e+06 2.195270e+05 4.761724e+05 4.981453e+05 3.414212e+06 3.178519e+05 3.076653e+05 1.037713e+06 4.888566e+05 6.628799e+05 4.807376e+05 6.132460e+05 1.234065e+06 6.541191e+05 6.201186e+05 9.142217e+05 2.989585e+05 5.851157e+05 1.522185e+06 5.885500e+05 8.028762e+05 8.665398e+05 6.006571e+05 1.335436e+05 6.957461e+05 5.558296e+05 C8 H12 N3 O16 P3 S_1.949 2.721204e+04 8.113684e+06 6.225233e+06 6.358112e+06 1.728248e+04 5.996879e+06 6.521154e+06 7.006449e+06 22071.07 6.024900e+06 6.744431e+06 7.258892e+06 25942.75 5.841066e+06 6.875391e+06 7.323238e+06 2.816180e+04 6.139055e+06 6.862113e+06 6.134677e+06 5.722260e+04 6.862367e+06 6.618467e+06 5.265581e+06 32583.201 8.362310e+06 5.719343e+06 6.372353e+06 2.813795e+04 7.539388e+06 7.427913e+06 7.053964e+06 36165.75 6.363807e+06 4.796082e+06 5.535022e+06 3.259278e+04 7.884117e+06 6.547904e+06 7.183329e+06 2.770727e+04 6.661810e+06 7.080962e+06 7.601558e+06 1.272655e+04 6.089534e+06 6.298159e+06 6.058904e+06 6.128082e+06 6.550080e+06 3.118515e+06 7.523691e+06 5.127559e+06 5.291218e+06 2.708121e+06 3.211259e+06 4.410937e+06 2.650133e+06 4.516472e+06 7.647799e+06 4.834210e+06 3.338979e+06 5.929502e+06 2.647657e+06 6.081991e+06 5.035114e+06 5.475119e+06 2.165371e+06 3.653108e+06 7.309884e+06 4.888774e+06 2.526338e+06 3.740102e+06 5.903272e+06 4.205475e+06 3.896602e+06 3.696170e+06 3.279264e+06 5.726146e+04 4.347798e+06 2.995066e+06 4.459618e+06 3.485518e+06 3.726305e+06 2.487395e+06 2.489139e+06 4.140402e+06 1.142238e+06 3.720051e+06 1.735423e+06 4.495111e+06 3.928762e+06 6.273765e+06 2.015998e+06 3.223287e+06 5.197663e+06 6.993472e+06 4.980427e+06 7.449897e+06 5.376773e+06 2.139596e+06 6.982728e+06 4.828856e+06 5.961126e+06 4.460004e+06 3.854972e+06 5.131655e+06 3.844849e+06 1.834787e+06 3.542964e+06 5.715629e+06 1.421711e+06 2.115655e+06 6.522838e+06 6.809737e+06 3.186473e+06 1.427917e+06 6.360658e+06 3.875839e+06 2.844008e+06 4.056257e+06 2.929713e+06 4.169437e+06 3.151234e+06 3.888630e+06 2.250581e+06 2.602507e+06 3.006532e+06 4.235662e+06 4.918884e+06 3.103485e+06 4.777606e+04 2.280405e+06 2.761394e+06 3.452002e+06 3.715242e+06 2.334547e+06 4.362089e+06 3.318100e+06 2.715419e+06 2.188762e+06 2.695213e+06 3.873842e+06 2.242497e+06 3.316915e+06 3.458457e+06 4.287657e+06 3.857710e+06 2.597372e+06 1.774449e+06 1.701863e+06 3.113940e+06 2.539406e+06 3.056963e+06 2.997344e+06 2.823686e+06 1.713593e+06 1.341839e+06 2.052101e+06 2.074171e+06 2.194277e+06 2.844210e+06 4.989187e+06 7.497941e+06 9.545180e+06 6.242323e+06 6.469904e+06 7.390256e+06 4.429032e+06 6.691784e+06 4.056057e+06 8.073740e+06 6.248091e+06 4.774148e+06 5.996283e+06 4.352901e+06 3.498138e+06 4.587625e+06 2.347118e+06 6.261306e+06 4.260656e+06 7.956242e+06 1.000103e+07 2.035531e+06 1.547015e+07 1.150228e+07 7.822022e+06 1.122710e+07 5.889002e+05 7.848032e+06 3.652584e+05 1.432719e+07 1.132469e+07 1.353717e+07 5.767911e+06 8.942778e+06 1.757637e+06 3.342815e+06 7.354865e+06 1.725767e+05 2.310360e+05 2.296655e+06 8.891058e+06 8.428339e+06 1.175924e+07 1.822605e+07 1.028440e+07 5.230242e+06 9.307660e+06 1.365581e+07 1.601219e+07 1.158563e+07 7.305361e+06 1.306361e+07 1.436396e+07 1.020791e+07 7.616388e+05 8.267551e+06 1.634161e+07 1.045487e+07 1.112402e+07 1.170886e+07 7.550584e+06 6.249485e+06 1.810813e+07 7.887865e+06 9.725390e+06 1.283605e+07 1.054697e+07 1.033210e+07 1.358003e+07 1.226216e+07 1.037479e+07 1.086575e+07 1.035346e+07 1.197231e+07 1.192579e+07 8.060787e+06 4.146210e+06 4.313338e+06 3.124042e+06 8.820973e+06 8.650242e+06 8.938024e+06 9.332895e+06 9.035991e+06 8.314884e+06 4.997754e+06 5.219207e+06 9.186851e+06 8.262059e+06 4.195209e+06 9.973816e+06 3.394393e+06 5.678167e+06 5.250402e+06 3.045247e+06 3.737921e+06 4.143037e+06 1.119948e+07 1.056560e+07 8.060461e+06 C17 H30 N2 O3_1.949 3.849221e+04 1.550459e+06 1.311940e+06 1.832691e+06 2.410429e+04 1.127691e+06 1.427610e+06 1.777413e+06 28150.19 1.153261e+06 1.248602e+06 1.922848e+06 31477.88 1.134310e+06 1.704454e+06 1.554687e+06 3.969172e+04 1.323266e+06 1.214591e+06 1.429872e+06 8.694381e+04 1.490597e+06 1.431963e+06 1.451469e+06 72376.283 1.545753e+06 1.338351e+06 1.408046e+06 4.054710e+04 1.669088e+06 1.678834e+06 1.504576e+06 63137.53 1.320127e+06 1.096309e+06 1.405550e+06 5.132394e+04 1.291794e+06 1.531150e+06 1.738386e+06 4.110514e+04 1.235154e+06 1.924595e+06 1.534353e+06 1.932973e+04 1.172234e+06 1.378649e+06 1.362415e+06 1.382384e+06 1.948418e+06 4.656586e+05 1.097534e+06 4.349809e+05 1.080078e+06 9.127331e+05 6.973790e+05 1.308900e+06 1.025225e+06 1.323794e+06 2.485263e+06 1.849762e+06 1.403358e+06 1.641624e+06 1.666797e+06 1.800380e+06 2.206263e+06 1.900082e+06 1.581728e+06 1.673367e+06 1.872710e+06 1.848225e+06 2.021789e+06 2.160070e+06 2.371780e+06 1.933166e+06 1.297072e+06 2.010202e+06 1.712574e+06 1.737161e+05 1.935760e+06 1.026964e+06 1.630282e+06 2.027960e+06 1.771051e+06 1.788763e+06 1.590440e+06 1.033438e+06 7.335989e+05 2.269981e+06 2.053591e+06 3.129778e+06 1.179053e+06 1.801960e+06 1.480926e+06 2.332311e+06 1.588675e+06 2.497096e+06 8.275995e+05 1.339974e+06 1.192415e+06 1.446528e+06 2.108403e+06 9.149944e+05 1.622725e+06 2.776538e+06 2.119063e+06 1.742540e+06 2.724171e+06 1.080478e+06 9.940971e+05 1.676708e+06 3.630910e+06 1.419054e+06 1.181970e+06 1.092066e+06 9.939242e+05 6.397942e+05 9.917100e+05 1.091183e+06 2.347394e+06 8.050293e+05 9.749709e+05 8.896990e+05 1.155674e+06 1.438359e+06 8.494592e+05 2.342697e+06 1.042771e+06 1.054727e+06 1.346133e+06 1.402030e+06 1.753840e+06 1.522730e+06 1.388922e+06 1.531326e+06 1.784756e+06 1.880404e+06 1.783269e+06 1.432575e+06 2.483552e+06 6.260045e+05 1.955478e+06 1.825264e+06 6.233990e+05 6.937819e+05 1.632782e+06 1.598504e+06 2.060493e+06 1.664877e+06 3.741972e+06 2.607040e+06 4.732753e+06 2.628420e+06 1.496222e+06 1.278740e+06 1.027320e+06 3.066030e+06 2.894078e+06 5.415271e+06 1.232184e+06 2.878127e+06 2.043142e+06 8.264018e+05 9.941938e+05 1.873028e+06 1.072866e+06 7.693755e+05 1.049580e+06 1.175959e+06 9.531136e+05 8.269646e+05 1.126136e+06 1.552524e+06 1.129337e+06 2.016699e+06 1.399150e+06 1.715426e+06 1.870731e+06 2.844569e+06 1.765563e+06 4.347925e+06 6.865768e+05 1.123099e+06 3.109796e+06 6.863989e+05 6.162802e+05 1.008719e+06 1.231944e+06 3.750101e+06 8.535237e+05 6.359508e+06 9.596637e+05 6.803272e+05 1.550229e+06 4.259035e+06 4.376669e+05 3.921802e+06 4.628121e+06 1.115742e+06 6.544868e+06 5.470987e+06 6.398008e+06 1.122637e+06 9.942588e+05 8.788038e+05 6.985761e+05 6.822449e+05 6.151736e+05 2.810260e+06 1.641299e+06 1.168387e+06 1.441584e+06 1.165186e+06 1.473933e+06 7.389610e+05 1.264059e+06 8.021577e+06 2.155673e+06 1.316230e+06 9.921817e+05 1.854944e+06 7.920256e+05 4.972273e+05 9.970455e+05 1.054310e+06 1.728887e+06 1.394940e+06 1.010822e+06 1.171089e+06 8.187058e+05 1.121604e+06 2.102425e+06 1.124611e+06 7.862824e+05 1.781253e+06 1.487906e+06 1.751739e+06 1.086192e+06 1.097447e+06 8.828847e+05 2.012931e+06 1.499256e+06 2.295174e+06 2.276168e+06 1.715823e+06 1.916003e+06 3.605788e+06 2.919518e+06 2.732781e+06 3.562043e+06 1.580903e+06 1.133458e+06 2.057040e+06 9.116330e+05 4.689924e+06 5.319495e+05 6.509769e+05 1.102316e+06 7.888439e+05 1.516248e+06 3.400945e+06 1.838557e+06 HIPPURATE 3.059602e+07 1.373658e+07 1.149273e+07 1.180817e+07 5.771367e+04 9.557027e+06 1.256007e+07 1.485949e+07 49774.46 1.042414e+07 1.276914e+07 1.305441e+07 50163.26 1.058294e+07 1.188277e+07 1.171668e+07 5.411039e+04 1.217317e+07 1.188700e+07 1.261493e+07 1.027956e+05 1.059231e+07 1.305387e+07 1.338338e+07 64753.581 1.101715e+07 1.213921e+07 1.224268e+07 6.329332e+04 1.115392e+07 1.133723e+07 1.489862e+07 97603.73 1.112408e+07 1.175069e+07 1.127592e+07 9.165215e+04 1.131190e+07 1.314111e+07 1.186478e+07 8.592651e+04 1.059098e+07 1.302391e+07 1.536816e+07 3.554457e+04 9.853770e+06 1.238968e+07 1.108766e+07 3.248149e+07 1.521309e+07 1.003089e+07 6.882498e+06 2.389033e+07 4.167391e+07 4.972730e+06 1.149329e+08 1.580543e+08 3.071124e+07 4.148161e+07 1.398944e+07 1.440638e+07 1.155324e+07 1.961750e+07 1.558798e+07 3.098942e+07 1.123945e+07 4.166990e+06 8.759734e+06 1.612233e+07 3.814081e+06 3.409538e+06 7.027086e+06 1.882252e+07 6.702516e+06 1.952390e+07 1.221906e+07 8.011204e+06 6.858003e+07 5.345120e+06 4.087621e+06 1.334416e+07 3.715160e+06 8.191817e+06 2.128810e+07 1.676088e+07 8.558981e+06 3.988197e+06 7.053398e+06 9.439856e+07 4.858998e+06 1.119265e+07 8.878493e+06 7.872648e+06 8.869046e+06 8.047903e+06 8.165200e+06 1.394200e+07 5.176025e+06 2.435707e+06 3.411840e+06 1.627813e+07 1.419865e+07 6.378804e+06 2.740688e+07 8.312119e+06 4.588530e+06 5.252668e+06 7.875727e+06 3.040023e+06 3.633779e+06 1.850773e+07 1.337092e+07 1.050094e+07 6.934392e+06 3.496115e+06 1.272878e+07 3.462737e+06 7.589814e+07 3.580321e+06 4.006644e+06 3.960003e+06 5.979043e+06 2.399120e+07 4.823920e+07 4.161833e+07 1.261455e+07 2.237050e+07 2.641868e+06 1.590285e+06 1.295432e+07 7.391810e+06 9.947269e+06 9.628325e+06 1.887019e+07 7.719055e+06 1.226616e+07 2.276805e+07 2.435543e+07 1.243702e+07 2.652808e+06 3.989328e+06 5.352587e+07 1.722832e+07 9.349211e+06 6.046822e+06 1.048496e+07 1.427860e+07 5.532853e+06 4.332125e+06 3.675435e+06 7.187129e+07 2.932242e+07 6.537924e+06 1.873448e+07 2.031782e+07 1.003070e+07 1.090262e+07 2.685637e+07 4.228778e+06 6.201841e+07 9.777393e+06 1.249370e+07 3.330206e+07 4.451052e+07 6.371618e+06 2.492027e+07 8.529454e+06 7.326588e+06 7.703670e+06 2.510912e+06 4.683628e+06 1.994364e+07 1.086818e+07 9.714081e+07 1.292319e+07 1.536545e+07 1.157205e+07 9.712712e+07 1.551094e+07 6.128644e+06 2.111297e+06 4.387158e+06 1.271556e+07 3.603924e+06 7.512898e+06 2.232236e+06 3.252615e+06 1.360407e+07 1.408628e+08 6.082257e+06 1.360856e+07 7.195823e+06 1.308212e+06 3.018855e+06 2.754680e+06 2.030202e+07 9.475246e+06 2.303560e+07 1.504740e+07 7.014611e+06 5.537254e+06 7.064650e+06 2.236492e+07 1.269294e+07 1.130040e+07 6.605410e+06 5.320793e+06 3.292463e+06 5.217939e+06 4.922664e+06 2.707671e+07 2.126715e+07 1.582431e+07 8.690386e+06 3.575555e+06 6.511439e+06 4.418520e+06 4.542691e+06 3.212826e+06 6.597373e+06 3.565447e+06 1.841124e+06 1.948851e+07 6.746138e+06 3.431631e+06 4.734639e+06 5.101955e+06 2.206616e+07 1.116999e+07 9.508954e+06 3.313103e+06 5.152366e+06 5.179205e+07 5.824612e+06 1.832478e+06 1.287214e+07 6.671455e+06 1.077152e+07 2.017832e+07 7.199248e+06 1.818058e+07 1.509065e+06 4.662629e+06 2.671475e+07 9.032125e+06 2.000695e+07 6.968085e+06 1.408077e+07 2.179054e+07 7.291004e+06 1.569004e+07 1.520700e+07 2.907188e+06 6.051812e+07 1.207204e+07 1.279524e+07 4.962213e+06 5.447802e+06 1.261455e+07 9.809654e+06 1.292378e+07 4.706998e+07 C10 H14 O4_1.95 5.342293e+04 3.388838e+05 4.601215e+05 4.339902e+05 4.107242e+04 4.151214e+05 2.990498e+05 4.557246e+05 27344.07 3.425262e+05 5.889327e+05 3.957843e+05 27646.98 3.438088e+05 3.759279e+05 3.841672e+05 3.729593e+04 4.110822e+05 3.635725e+05 3.882788e+05 5.630260e+04 4.029440e+05 4.444793e+05 3.832523e+05 32783.909 5.076155e+05 2.730039e+05 4.717635e+05 3.031074e+04 3.775072e+05 3.363961e+05 4.730659e+05 44961.82 4.779843e+05 3.853459e+05 3.304823e+05 4.416742e+04 4.216115e+05 3.726415e+05 3.491174e+05 3.939368e+04 3.817083e+05 4.223320e+05 5.273061e+05 1.460327e+04 4.560063e+05 2.763042e+05 4.151614e+05 2.446160e+05 2.494827e+05 2.372646e+05 3.171189e+05 2.453208e+05 6.086658e+05 4.478515e+05 4.201360e+05 2.997834e+05 4.718073e+05 2.712276e+05 4.413829e+05 5.460751e+05 4.031326e+05 3.422044e+05 6.571918e+05 4.978291e+05 2.385922e+05 4.499754e+05 8.773406e+05 6.170295e+05 5.162610e+05 2.829594e+05 7.661772e+05 4.767488e+05 5.228612e+05 2.889325e+05 2.706936e+05 2.863002e+05 8.315057e+04 4.835714e+06 2.465051e+05 1.932889e+05 2.597820e+05 3.233792e+05 1.462710e+05 2.147978e+05 2.034061e+05 2.811269e+05 2.258332e+05 3.087204e+05 4.636923e+05 5.720003e+05 1.739530e+05 4.443285e+05 4.231885e+05 6.994013e+05 2.697781e+05 6.364100e+05 1.385869e+05 4.804926e+05 5.095677e+05 2.365469e+05 1.683070e+05 1.418347e+05 3.849975e+05 4.304461e+05 4.827283e+05 4.514776e+05 1.010249e+06 4.067067e+05 1.289114e+05 1.521663e+05 1.201430e+06 6.090352e+05 6.958142e+04 1.045050e+05 1.147264e+05 1.663812e+05 7.762350e+04 2.053883e+05 6.433115e+05 1.945107e+05 3.371666e+05 1.090198e+05 2.122715e+05 1.478187e+05 1.095285e+05 2.954186e+05 8.674903e+04 1.156180e+05 1.183144e+05 6.489332e+05 4.485095e+05 5.542423e+05 3.601156e+05 4.575123e+05 3.813969e+05 7.660478e+05 7.120817e+05 6.532904e+05 8.642240e+05 7.170785e+05 8.418958e+05 5.539159e+05 1.142441e+06 1.346535e+06 1.562602e+06 1.473716e+06 1.917217e+06 2.390649e+06 3.263688e+06 2.900744e+06 1.395652e+06 7.436033e+05 3.058804e+05 3.194811e+05 3.941483e+05 9.245550e+05 7.297647e+05 7.461503e+05 4.378988e+05 4.799256e+05 4.588861e+05 3.588894e+05 5.076529e+05 7.292778e+05 6.719316e+05 2.846959e+05 4.006819e+05 6.025814e+05 5.356896e+05 6.181512e+05 2.883615e+05 6.572527e+05 5.762639e+05 1.031543e+06 7.053667e+05 5.627990e+05 4.428283e+05 8.625400e+05 2.831259e+05 1.660275e+06 1.112421e+05 3.594117e+05 1.245594e+06 5.457011e+05 1.616611e+05 1.886010e+05 2.165072e+05 1.867944e+06 2.406303e+05 2.035104e+06 9.623730e+04 2.356339e+05 2.353298e+05 8.655427e+05 1.455338e+05 2.257476e+06 1.701498e+06 2.141237e+05 2.574498e+06 2.606530e+06 1.523829e+06 2.937590e+05 8.736654e+04 3.561510e+05 1.041084e+05 1.978736e+05 1.302395e+05 3.265439e+05 3.188902e+05 1.139619e+05 2.588658e+05 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6.191446e+06 2.046795e+07 1.303899e+07 1.778373e+06 1.883925e+07 1.890981e+07 1.277727e+07 1.077948e+07 3.460211e+05 1.458241e+07 2.429011e+05 1.524380e+07 1.961167e+07 1.806071e+07 5.400531e+06 1.218509e+07 8.488610e+05 2.630391e+06 1.019652e+07 1.257100e+05 1.384102e+05 1.799261e+06 5.290659e+06 1.145374e+07 2.078580e+07 1.824872e+07 2.189357e+07 1.418511e+07 2.977446e+06 1.719774e+07 2.016602e+07 1.998287e+07 6.603511e+06 7.894968e+06 2.954847e+07 8.401249e+06 5.291643e+05 4.793255e+06 1.225594e+07 2.118754e+07 9.304835e+06 1.665725e+06 1.250250e+07 8.937997e+06 2.205406e+07 1.078053e+07 1.307697e+07 1.829839e+07 2.466184e+06 1.627037e+07 1.799425e+07 1.794249e+07 4.866710e+06 1.747079e+07 1.638590e+07 1.878773e+07 1.760596e+07 1.757581e+07 6.980078e+06 5.558655e+06 4.728496e+06 1.000873e+07 1.333040e+07 6.405991e+06 1.415791e+07 5.497818e+06 4.414409e+06 2.422026e+06 3.148574e+06 8.001499e+06 5.924476e+06 3.562409e+06 1.045394e+07 2.744295e+06 6.588885e+06 4.569608e+06 3.362203e+06 2.884934e+06 5.679763e+06 2.004683e+07 4.183207e+06 6.712844e+06 C7 H26 N9 P_1.95 2.916132e+05 2.257439e+06 2.041160e+06 2.482226e+06 1.430644e+04 1.725115e+06 1.963937e+06 2.316041e+06 23031.87 1.867805e+06 1.952773e+06 2.432735e+06 19919.97 1.943294e+06 2.306668e+06 1.963163e+06 2.151934e+04 2.035056e+06 2.036852e+06 2.359302e+06 4.438835e+04 2.103374e+06 2.057010e+06 1.755972e+06 27667.736 2.273320e+06 2.154620e+06 2.131172e+06 2.586343e+04 2.171273e+06 2.123139e+06 2.178891e+06 34140.64 2.151845e+06 1.592293e+06 2.127555e+06 3.213734e+04 2.385095e+06 2.044026e+06 2.104975e+06 2.880764e+04 1.710232e+06 2.496628e+06 2.598562e+06 1.286181e+04 2.103444e+06 1.795890e+06 1.843438e+06 2.153355e+06 2.605189e+06 1.302952e+06 1.595781e+06 1.114129e+06 1.461242e+06 1.380431e+06 1.417665e+06 1.569962e+06 1.523380e+06 1.645536e+06 3.365915e+06 2.791155e+06 2.464580e+06 2.369748e+06 2.267226e+06 3.172646e+06 3.119869e+06 2.884970e+06 2.571229e+06 2.642587e+06 2.674086e+06 2.749086e+06 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2.675466e+06 5.335268e+06 4.373969e+06 5.708678e+06 3.715315e+06 2.091069e+06 1.500916e+06 1.568879e+06 4.762728e+06 4.067709e+06 5.381268e+06 2.402914e+06 3.500425e+06 2.541562e+06 1.155448e+06 1.181134e+06 2.374064e+06 1.632118e+06 1.496299e+06 1.103104e+06 1.563031e+06 1.283480e+06 1.033557e+06 1.633030e+06 2.145688e+06 1.565560e+06 2.611075e+06 2.036023e+06 2.452558e+06 2.442252e+06 4.353582e+06 2.419318e+06 5.804431e+06 1.122293e+06 1.773803e+06 3.079271e+06 7.752928e+05 8.943156e+05 1.418840e+06 1.620275e+06 4.609041e+06 1.455076e+06 6.788425e+06 1.060299e+06 7.050589e+05 2.152525e+06 5.976644e+06 6.883164e+05 5.043646e+06 6.351172e+06 1.693820e+06 6.510126e+06 5.415907e+06 5.887262e+06 1.302574e+06 1.335427e+06 1.430272e+06 1.024830e+06 1.245344e+06 6.366797e+05 2.627777e+06 2.078257e+06 1.608397e+06 1.855890e+06 1.500601e+06 2.115447e+06 1.040396e+06 1.776433e+06 6.323082e+06 3.480969e+06 1.582518e+06 1.069354e+06 2.138869e+06 1.219915e+06 7.598307e+05 1.250971e+06 1.300405e+06 1.891657e+06 2.472706e+06 1.487079e+06 1.826200e+06 1.392553e+06 1.243921e+06 2.573690e+06 1.686986e+06 9.681181e+05 2.369731e+06 1.986100e+06 2.859962e+06 1.294986e+06 1.584144e+06 1.350170e+06 1.941790e+06 1.801053e+06 2.421813e+06 2.775207e+06 2.204768e+06 2.520134e+06 3.466795e+06 3.016195e+06 2.979100e+06 3.699347e+06 1.997022e+06 1.739392e+06 2.037600e+06 1.477544e+06 3.835009e+06 9.939034e+05 9.027998e+05 1.640749e+06 1.211054e+06 1.711069e+06 4.020850e+06 2.372240e+06 C8 H15 N O2_1.951 1.520848e+05 8.880760e+05 6.596379e+05 5.220348e+05 6.009665e+04 5.017242e+05 7.985003e+05 7.742825e+05 53854.82 6.294116e+05 7.669792e+05 8.466044e+05 36096.08 5.730581e+05 6.523149e+05 7.310806e+05 1.748697e+05 7.339328e+05 5.216104e+05 8.317566e+05 9.109336e+04 5.531852e+05 8.383110e+05 6.802080e+05 60509.446 6.087305e+05 5.783773e+05 9.439607e+05 5.841619e+04 5.819180e+05 5.707291e+05 9.312983e+05 76292.55 6.049252e+05 7.583365e+05 4.749227e+05 7.954175e+04 9.031914e+05 6.338449e+05 6.335746e+05 8.454629e+04 5.792338e+05 8.033281e+05 8.152583e+05 3.163392e+04 5.571732e+05 9.045763e+05 5.332736e+05 1.958534e+05 6.667113e+05 1.471982e+05 2.097587e+06 2.142174e+05 2.619574e+05 2.970283e+06 1.561482e+06 1.061804e+07 2.817660e+06 3.530963e+05 5.341436e+06 5.384872e+06 2.163359e+05 3.142195e+05 5.324563e+05 1.719072e+05 2.797082e+05 1.608273e+05 1.160184e+07 1.236812e+06 2.075239e+05 1.763802e+05 1.472608e+05 1.382944e+06 1.707450e+05 2.361438e+05 2.401316e+05 1.685954e+05 2.323372e+05 2.936596e+05 1.455018e+05 1.695125e+05 1.417901e+05 6.717193e+05 6.984538e+05 7.881805e+05 2.479216e+05 1.273616e+05 2.136099e+05 1.401041e+05 3.095544e+05 1.707866e+06 1.107938e+05 1.876900e+06 1.594928e+05 5.425050e+05 6.842068e+05 3.232949e+05 2.353642e+06 1.380496e+05 1.308720e+05 3.959809e+05 2.015824e+05 2.875053e+05 1.324133e+05 2.332303e+06 2.179667e+06 2.292814e+05 1.594268e+06 1.662029e+05 1.199432e+05 1.631573e+05 2.355450e+05 1.224751e+06 1.649845e+06 2.810528e+06 2.433807e+05 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2.217011e+05 2.892361e+05 2.605283e+05 3.835641e+05 2.496600e+05 2.681723e+05 1.796012e+05 2.900650e+05 1.813406e+05 2.240232e+05 3.338113e+05 2.373699e+05 1.021476e+06 2.158170e+05 3.508070e+05 2.342554e+05 2.202165e+05 2.970572e+05 4.332111e+05 7.438872e+05 6.851098e+06 2.003349e+05 1.729823e+05 3.105531e+05 1.973379e+05 8.204188e+05 2.133189e+05 1.965250e+05 3.326045e+05 1.127097e+07 1.964526e+05 1.752133e+05 3.169537e+05 3.770172e+05 4.471973e+05 3.493801e+05 3.619249e+06 1.835039e+05 2.020605e+05 4.046412e+05 1.643944e+06 1.715825e+05 3.252738e+05 2.062749e+05 1.774335e+05 4.074873e+05 3.672151e+05 4.923997e+05 1.276056e+05 2.076067e+05 6.251767e+06 1.221097e+05 2.168961e+05 3.115578e+05 2.764883e+05 1.016436e+06 3.405673e+06 2.136935e+05 1.929666e+05 1.224815e+05 1.212107e+05 5.454591e+05 1.421568e+05 5.030210e+05 1.715475e+05 1.254569e+05 2.672167e+06 2.369358e+06 1.354635e+05 C17 H7 N9 O14 P2 S2_1.951 4.311535e+04 1.208741e+06 1.069410e+06 1.027321e+06 2.488365e+04 6.867142e+05 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3.328239e+04 5.709215e+05 7.635787e+05 6.376494e+05 19677.098 6.990215e+05 6.161127e+05 6.262493e+05 2.292490e+04 6.635069e+05 5.487364e+05 6.338538e+05 27529.09 7.839521e+05 6.885280e+05 5.003748e+05 3.040229e+04 6.761717e+05 7.808998e+05 3.005653e+05 2.987131e+04 6.768711e+05 8.849631e+05 7.761153e+05 1.877816e+04 5.309033e+05 5.773391e+05 6.531948e+05 5.049224e+05 5.084027e+05 1.583478e+05 5.460272e+05 1.916906e+05 6.520979e+05 2.102782e+05 3.907436e+05 4.318180e+05 5.692555e+05 2.275249e+05 4.791629e+05 4.666506e+05 2.277570e+05 1.649417e+05 5.460445e+05 2.330451e+05 2.787460e+06 3.178884e+05 2.520813e+05 5.078808e+05 2.632703e+05 2.834660e+05 2.284990e+05 1.042669e+05 2.792017e+05 1.448589e+06 6.551861e+05 1.756966e+06 1.173592e+06 3.407638e+04 2.763600e+06 7.582002e+05 5.033023e+05 1.199699e+06 8.306964e+05 8.998422e+05 2.809597e+06 1.152316e+06 3.216440e+05 1.370745e+06 1.479367e+06 9.116794e+05 1.940657e+06 4.940309e+05 2.124188e+05 1.255967e+05 3.752278e+05 5.229476e+05 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7.052917e+05 3.417140e+05 5.461743e+05 1.462312e+06 5.041226e+05 8.774859e+05 5.296138e+05 7.496523e+05 2.871536e+05 5.222612e+05 4.453317e+05 C37 H77 N O16_1.951 4.708188e+04 5.169421e+05 3.656969e+05 3.687552e+05 2.773826e+04 1.373745e+05 5.133125e+05 3.978179e+05 24074.79 3.721457e+05 3.781013e+05 5.338753e+05 26110.51 2.489012e+05 3.631696e+05 4.062028e+05 3.394287e+04 3.780783e+05 3.186736e+05 3.903424e+05 6.020359e+04 3.187034e+05 2.910621e+05 5.567595e+05 31111.341 3.821076e+05 3.563938e+05 3.469658e+05 2.956451e+04 4.617318e+05 3.538220e+05 3.268824e+05 49121.44 3.583983e+05 4.490888e+05 2.724348e+05 4.286188e+04 3.313074e+05 5.558752e+05 3.185449e+05 3.932657e+04 4.065269e+05 2.943930e+05 5.063103e+05 1.760407e+04 3.293179e+05 4.470555e+05 2.972511e+05 4.033381e+05 2.725638e+05 2.280313e+05 2.945457e+05 3.280912e+05 2.387680e+05 3.585280e+05 2.912773e+05 2.615173e+05 3.207764e+05 2.015362e+05 5.379492e+05 3.427475e+05 3.432791e+05 1.987168e+05 2.892593e+05 2.090300e+05 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4.891307e+07 5.881386e+07 2.525502e+07 5.303077e+07 4.782264e+07 3.515754e+07 1.391500e+07 9.387107e+06 1.137130e+07 4.271527e+07 6.161254e+07 2.259989e+07 4.109940e+07 5.332713e+07 2.567377e+07 4.739570e+06 9.231649e+06 4.034072e+07 3.577983e+07 5.057793e+06 3.137036e+07 5.369395e+06 2.068457e+07 7.949939e+06 3.239767e+06 2.586075e+06 7.196203e+06 7.371308e+07 2.226656e+07 2.462351e+07 C29 H57 N O4 P2_1.952 4.262041e+04 9.031143e+05 8.436081e+05 7.396662e+05 2.540192e+04 7.059984e+05 9.170923e+05 8.997733e+05 22272.05 6.966566e+05 9.229830e+05 1.044674e+06 23806.01 7.015687e+05 6.920505e+05 7.744008e+05 9.318459e+04 9.001622e+05 6.888064e+05 8.969055e+05 4.736492e+04 7.304167e+05 8.847290e+05 9.696106e+05 27272.455 7.900207e+05 7.832562e+05 8.050984e+05 2.673171e+04 7.940933e+05 9.178709e+05 8.088968e+05 44212.36 8.432150e+05 8.278591e+05 6.593456e+05 4.233520e+04 7.643192e+05 8.832099e+05 8.135212e+05 3.753010e+04 8.850821e+05 8.866958e+05 9.025098e+05 1.602897e+04 7.791986e+05 7.845534e+05 7.915326e+05 6.105637e+05 5.986968e+05 1.651135e+05 8.770490e+05 4.666853e+05 5.083500e+05 6.517337e+05 6.987989e+05 7.369732e+05 8.105136e+05 9.583097e+05 8.396427e+05 1.273012e+06 1.346633e+06 8.626123e+05 9.289925e+05 1.256984e+06 8.477309e+05 1.348618e+06 8.696530e+05 9.804039e+05 8.829643e+05 1.363200e+06 1.164013e+06 1.526484e+06 1.380027e+06 6.274486e+05 7.076349e+05 7.519117e+05 7.523284e+05 2.343172e+06 8.175833e+05 6.989969e+05 7.704841e+05 6.017474e+05 7.842006e+05 3.973783e+05 7.849283e+05 5.498017e+05 3.665395e+05 6.016506e+05 6.698959e+05 1.352089e+06 5.876738e+05 7.981962e+05 7.660253e+05 1.391581e+06 7.623679e+05 1.273074e+06 2.752803e+05 8.959700e+05 7.651808e+05 5.975134e+05 1.115065e+06 2.793640e+05 1.232659e+06 9.915513e+05 7.515394e+05 5.968456e+05 9.592415e+05 3.642474e+05 2.949114e+05 3.656130e+05 1.316687e+06 7.901417e+05 5.775131e+05 5.652806e+05 2.544826e+05 5.803526e+05 5.173868e+05 3.786963e+05 8.737605e+05 2.838439e+05 2.426370e+05 2.567767e+05 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2.458104e+06 2.865213e+06 4.298006e+05 4.868406e+05 6.244804e+05 5.250787e+05 4.800704e+05 2.736050e+05 8.472440e+05 7.225540e+05 7.061846e+05 5.464939e+05 4.150160e+05 7.387917e+05 6.458816e+05 9.051994e+05 3.571846e+06 1.070120e+06 9.036644e+05 6.075367e+05 1.053967e+06 5.761952e+05 2.693172e+05 5.488813e+05 9.638949e+05 1.163271e+06 8.663048e+05 6.602810e+05 7.786431e+05 3.984254e+05 7.313512e+05 1.059940e+06 8.721973e+05 5.744558e+05 1.014716e+06 9.817112e+05 1.056903e+06 6.660805e+05 5.327364e+05 4.983014e+05 1.959717e+06 7.426898e+05 1.129050e+06 1.130837e+06 8.719849e+05 7.976140e+05 9.074514e+05 7.418413e+05 8.928005e+05 1.573007e+06 7.920404e+05 6.827013e+05 8.477037e+05 5.812614e+05 1.845788e+06 3.876678e+05 3.356274e+05 5.484781e+05 4.701227e+05 7.791971e+05 7.119511e+05 1.046910e+06 C9 H19 N O7_1.952 5.240665e+04 1.742412e+06 1.583560e+06 1.537628e+06 3.209707e+04 3.811458e+05 1.463865e+06 1.479250e+06 21580.18 9.087868e+05 1.919998e+06 1.374067e+06 18916.71 9.914017e+05 1.632982e+06 1.239011e+06 1.859231e+04 1.571883e+06 1.160259e+06 1.228317e+06 3.881092e+04 1.109520e+06 1.378171e+06 2.115479e+06 24318.892 1.257853e+06 1.060782e+06 1.120398e+06 2.536839e+04 1.224851e+06 1.099408e+06 1.975889e+06 36717.34 1.629946e+06 1.096537e+06 1.107929e+06 3.706400e+04 1.344455e+06 1.304500e+06 1.425532e+06 3.480025e+04 1.091562e+06 1.695445e+06 1.656677e+06 1.427712e+04 1.067889e+06 1.461208e+06 1.177652e+06 1.085924e+06 1.535292e+06 3.596930e+05 1.212711e+06 6.131273e+05 1.436489e+06 6.963244e+05 1.072467e+06 8.757420e+05 1.525917e+06 6.496424e+05 7.568734e+05 1.381338e+06 9.655799e+05 5.802953e+05 1.546201e+06 1.768889e+06 5.015080e+06 7.048910e+05 4.240392e+05 1.322644e+06 7.891293e+05 9.221269e+05 6.412946e+05 5.302747e+05 6.417678e+05 3.065881e+06 2.030480e+06 3.586796e+06 1.723612e+06 8.064774e+04 4.329857e+06 1.780003e+06 1.157907e+06 1.769166e+06 1.582057e+06 1.636982e+06 4.892239e+06 2.847183e+06 6.022133e+05 2.847368e+06 2.772935e+06 2.158077e+06 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1.214346e+06 1.361174e+06 2.436617e+06 9.399811e+05 8.287872e+05 1.108047e+06 2.795269e+06 1.847935e+06 7.914155e+05 1.778383e+06 8.889795e+05 7.826005e+05 1.580163e+06 2.853620e+06 7.848822e+05 1.897934e+06 7.239517e+05 1.350669e+06 2.518071e+06 8.162049e+05 1.660807e+06 2.277710e+06 3.742644e+06 1.305809e+06 8.951883e+05 7.208552e+05 4.962747e+06 1.126706e+06 2.929065e+06 3.668422e+06 2.149433e+06 3.371603e+06 2.627858e+06 3.731938e+06 9.556633e+05 2.440360e+06 2.494627e+06 8.077400e+05 1.748368e+06 9.804908e+05 5.002532e+06 2.565932e+06 8.933434e+05 2.131309e+06 1.812955e+06 3.181847e+06 5.262316e+05 2.438462e+06 7.119416e+06 2.127667e+06 1.654981e+06 2.216240e+06 3.063772e+06 1.655287e+06 6.203064e+05 1.877001e+06 2.314853e+06 1.594194e+06 1.088682e+06 1.171110e+06 1.325617e+06 2.021784e+06 7.661312e+05 3.141677e+06 7.849064e+05 5.334362e+05 1.118855e+06 1.412391e+06 3.353574e+06 9.183322e+05 1.322079e+06 1.114814e+06 6.799183e+06 9.617200e+05 1.114398e+06 2.264420e+06 1.233811e+06 1.391503e+06 1.206170e+06 8.924749e+05 1.635714e+06 1.324294e+06 1.232925e+06 1.348060e+06 7.442543e+05 8.779043e+05 2.518032e+06 9.169034e+05 1.686918e+06 9.495356e+05 8.072670e+05 6.171996e+05 7.136675e+05 1.108625e+06 C16 H8 N3 O8 P3 S_1.952 8.959671e+04 4.523327e+06 4.132346e+06 4.830875e+06 4.954218e+04 2.472567e+06 4.825635e+06 5.066442e+06 32180.10 4.094596e+06 4.323069e+06 4.001887e+06 29776.26 4.075920e+06 4.824444e+06 4.392322e+06 3.186445e+04 3.830391e+06 3.564348e+06 3.664838e+06 5.870073e+04 6.062200e+06 4.222677e+06 4.456213e+06 34534.155 3.018158e+06 4.737216e+06 5.303327e+06 2.965883e+04 3.002988e+06 3.247160e+06 5.096232e+06 38878.37 5.252864e+06 3.649846e+06 3.558082e+06 3.683778e+04 5.690115e+06 3.642515e+06 3.590551e+06 4.239721e+04 4.782136e+06 3.861704e+06 5.487700e+06 2.180344e+04 3.798726e+06 4.282551e+06 3.926749e+06 3.947497e+06 3.391762e+06 4.007453e+06 1.904541e+06 3.469773e+06 4.313433e+06 1.240066e+06 3.681530e+06 1.815472e+06 1.085906e+06 1.626669e+06 3.267728e+06 1.564764e+06 1.991596e+06 3.590211e+06 2.786804e+06 2.486737e+06 3.605693e+06 2.946182e+06 1.111884e+06 1.484472e+06 3.048968e+06 3.148818e+06 1.730741e+06 3.614245e+06 3.362893e+06 1.461698e+06 3.741029e+06 2.871314e+06 2.001953e+06 5.922548e+04 2.680015e+06 2.055092e+06 2.350753e+06 1.216880e+06 1.616130e+06 1.266523e+06 2.551571e+06 3.840592e+06 5.927653e+05 1.551232e+06 1.068937e+06 1.234696e+06 3.418207e+06 3.747099e+06 1.238581e+06 9.562976e+05 3.030399e+06 2.191337e+06 4.262437e+06 5.472057e+06 2.998831e+06 8.398053e+05 3.075123e+06 3.679205e+06 4.202479e+06 1.400535e+06 1.110962e+06 1.269912e+06 9.309729e+05 1.157542e+06 1.640761e+06 1.879971e+06 7.074037e+05 1.515561e+06 2.998840e+06 4.070283e+06 2.582375e+06 1.588789e+06 5.235008e+06 1.227555e+06 7.540300e+05 2.410301e+06 1.635728e+06 1.633740e+06 2.234877e+06 1.653621e+06 1.881443e+06 9.189898e+05 3.076087e+06 2.485521e+06 2.763717e+06 1.898446e+06 5.103993e+04 1.539163e+06 1.247887e+06 1.734861e+06 2.152020e+06 2.068295e+06 1.836582e+06 2.033515e+06 1.402682e+06 1.051835e+06 1.809119e+06 2.057085e+06 1.152663e+06 2.767445e+06 1.626032e+06 3.985257e+06 1.873591e+06 2.330688e+06 9.814323e+05 5.581042e+05 9.443738e+05 1.183686e+06 7.068381e+05 1.289949e+06 1.212188e+06 4.853406e+05 3.089412e+05 8.508837e+05 8.893719e+05 7.012491e+05 7.756713e+05 2.085290e+06 6.599563e+06 2.732931e+06 3.085728e+06 4.852164e+06 5.549341e+06 2.558394e+06 3.746043e+06 4.443575e+06 4.384230e+06 3.072887e+06 2.629541e+06 4.806345e+06 3.022732e+06 9.677217e+05 2.281204e+06 7.524134e+05 4.431144e+06 3.518643e+06 9.571259e+06 7.652679e+06 1.148216e+06 8.180842e+06 5.186022e+06 7.236093e+06 1.222366e+07 3.402283e+05 1.065362e+07 1.935390e+05 9.861585e+06 4.736351e+06 3.975636e+06 5.153199e+06 7.168104e+06 6.694476e+05 1.625037e+06 3.641619e+06 1.191635e+05 1.154115e+05 1.025201e+06 2.047102e+06 6.592086e+06 1.005964e+07 8.688535e+06 6.229091e+06 6.949711e+06 8.250970e+06 9.903650e+06 4.572906e+06 5.537668e+06 5.110587e+06 5.371249e+06 2.644198e+07 3.948486e+06 5.908125e+05 2.549122e+06 9.195787e+06 9.663711e+06 7.235961e+06 8.102029e+06 7.179304e+06 7.079187e+06 8.820520e+06 5.502531e+06 3.584167e+06 6.236215e+06 7.980740e+06 8.790475e+06 8.228903e+06 6.009482e+06 9.072113e+06 9.992168e+06 7.616853e+06 7.035963e+06 1.127101e+07 8.618268e+06 3.801156e+06 3.731515e+06 2.549382e+06 5.084851e+06 6.310067e+06 3.718395e+06 7.127204e+06 4.541969e+06 2.829555e+06 9.717447e+05 1.495524e+06 3.647840e+06 3.820396e+06 1.890410e+06 5.963954e+06 2.162559e+06 2.970046e+06 1.725800e+06 1.664766e+06 1.428615e+06 3.519341e+06 1.281831e+07 2.168576e+06 4.041610e+06 C8 H15 N O3_1.952 1.271214e+06 1.727683e+06 1.822381e+06 1.924824e+06 6.080708e+04 7.893668e+05 1.641052e+06 1.887208e+06 49750.31 1.433201e+06 1.936447e+06 1.446792e+06 47948.27 1.649780e+06 1.714961e+06 1.633176e+06 4.815391e+04 1.573326e+06 1.535533e+06 1.381004e+06 9.401906e+04 1.668927e+06 1.873531e+06 1.301070e+06 57358.421 1.828226e+06 1.663081e+06 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1.163378e+06 1.057672e+06 3.021069e+06 2.721045e+06 C33 H14 N4 O16 P2_1.953 3.010204e+04 1.601602e+05 2.132631e+05 2.292627e+05 1.953101e+04 1.208189e+05 2.344818e+05 2.179584e+05 18303.49 1.250754e+05 1.469264e+05 3.229623e+05 18374.01 1.401243e+05 1.702563e+05 1.724590e+05 2.220152e+04 2.055575e+05 2.126216e+05 1.325189e+05 4.408592e+04 2.243324e+05 1.434188e+05 3.062647e+05 28237.941 2.058669e+05 1.950914e+05 1.066386e+05 3.237241e+04 2.032857e+05 1.746907e+05 4.091482e+05 50181.95 2.438989e+05 1.953717e+05 1.933538e+05 4.422659e+04 1.391460e+05 2.294096e+05 2.250088e+05 3.820421e+04 1.220421e+05 2.397597e+05 1.875428e+05 1.464494e+04 1.894996e+05 2.101134e+05 1.733179e+05 1.038304e+05 5.521103e+04 2.123804e+05 1.940285e+05 1.049903e+05 8.194693e+04 1.313541e+05 5.488761e+05 1.251901e+05 1.203796e+05 9.652987e+04 9.572081e+04 9.249675e+05 4.540199e+05 1.205945e+05 1.359662e+05 3.769481e+05 8.563842e+04 7.310887e+04 1.195912e+05 1.051238e+05 2.066151e+05 3.523275e+05 1.233428e+05 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9.248687e+04 7.652210e+04 1.016166e+05 5.857312e+04 3.868330e+05 1.896612e+05 2.570244e+05 9.459601e+04 3.670379e+05 2.296272e+05 1.026916e+05 2.286022e+05 5.966051e+04 5.246835e+04 1.243924e+05 1.069221e+06 9.470864e+04 9.301906e+04 1.466989e+05 7.205942e+05 4.022755e+05 1.754661e+05 7.999184e+04 1.206212e+05 1.242932e+05 3.932492e+05 1.665421e+05 5.412366e+04 2.579550e+05 1.246623e+06 9.707930e+04 4.972700e+05 4.625183e+04 9.179008e+04 3.474892e+05 9.320602e+05 C17 H31 N5 O5_1.953 4.590089e+04 7.627762e+05 5.514479e+05 8.735874e+05 2.736454e+04 6.651084e+05 5.864085e+05 7.918559e+05 38739.15 6.663744e+05 7.574696e+05 9.995155e+05 36520.63 5.815819e+05 5.577045e+05 6.393207e+05 2.884782e+04 7.367458e+05 6.861164e+05 7.753084e+05 5.090747e+04 7.047933e+05 6.955618e+05 6.281972e+05 32306.325 8.282964e+05 6.986247e+05 7.537851e+05 3.253102e+04 6.491143e+05 7.672642e+05 6.656273e+05 52897.28 6.700641e+05 7.794846e+05 6.576751e+05 4.612976e+04 6.058621e+05 7.092546e+05 6.776185e+05 3.816108e+04 7.666943e+05 7.498672e+05 8.806263e+05 1.568786e+04 6.208110e+05 7.374730e+05 5.972838e+05 1.541397e+05 2.741087e+05 2.476716e+05 2.740631e+05 8.851523e+04 4.709408e+05 1.984511e+05 1.646885e+05 7.282556e+05 2.245393e+05 1.500318e+05 4.406893e+05 3.225777e+05 1.604245e+05 1.494364e+05 2.623351e+05 1.860902e+05 2.354078e+06 2.644151e+05 3.223879e+05 1.771981e+05 2.096124e+05 2.113248e+05 1.428960e+05 5.984795e+05 1.333105e+05 1.862411e+06 4.152226e+05 1.134494e+06 1.663222e+06 5.262877e+05 2.419201e+06 6.810570e+05 4.594368e+05 6.498981e+05 7.400299e+05 6.916321e+05 1.740780e+06 1.545909e+06 3.098813e+05 1.430665e+06 1.575195e+06 8.230018e+05 1.791624e+06 1.546567e+05 1.475637e+05 1.266397e+06 2.546710e+05 3.460954e+05 9.695874e+04 1.080199e+05 1.784433e+05 7.282474e+04 3.645344e+05 7.786876e+04 2.665260e+05 1.122992e+05 2.640828e+05 1.456682e+05 3.596667e+05 2.446573e+05 1.400243e+05 7.759982e+05 3.096033e+05 1.833043e+05 1.764422e+05 1.916446e+05 6.742357e+04 1.073852e+07 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2.078403e+06 4.271957e+05 1.316890e+06 3.645605e+06 1.343085e+06 2.701402e+06 1.933008e+06 2.948266e+06 2.361836e+05 1.107337e+06 1.122730e+06 3.740869e+05 7.185531e+05 2.693382e+05 1.770381e+06 7.296449e+05 3.460099e+05 4.835105e+05 1.256820e+06 1.155216e+06 1.819432e+05 1.055199e+06 5.880128e+06 6.519390e+05 6.139457e+05 8.219004e+05 9.975500e+05 6.745454e+05 1.626237e+05 3.136551e+05 3.981751e+05 6.175230e+05 1.794064e+05 2.725378e+05 6.126716e+05 1.910689e+05 2.908991e+05 8.727620e+05 8.924029e+05 1.867723e+05 4.395487e+05 7.261018e+05 1.409149e+06 4.692213e+05 2.938835e+05 2.978779e+05 1.166163e+07 3.715621e+05 2.650456e+05 6.397067e+05 7.153662e+05 7.167668e+05 4.055726e+05 4.240081e+05 9.159990e+05 7.276369e+05 1.032085e+06 5.036935e+05 3.708740e+05 4.562088e+05 1.277254e+06 6.738609e+05 1.148379e+06 4.590316e+05 5.464903e+05 2.177609e+05 5.477858e+05 5.971245e+05 C64 H131 N4 O17 P S_1.954 3.254340e+04 1.856870e+05 1.046544e+05 1.456217e+05 2.045885e+04 1.206061e+05 1.908835e+05 1.666312e+05 16944.16 1.364799e+05 1.920369e+05 1.984105e+05 18546.21 9.809244e+04 1.565563e+05 1.855958e+05 2.249445e+04 1.500617e+05 1.035401e+05 1.460700e+05 3.523910e+04 6.051692e+04 1.272811e+05 1.953352e+05 21230.718 1.694779e+05 2.554410e+05 1.211497e+05 2.477235e+04 1.273483e+05 8.555041e+04 2.664959e+05 41156.12 1.406801e+05 1.289720e+05 1.451314e+05 3.956746e+04 9.192542e+04 2.028515e+05 1.440326e+05 3.199877e+04 8.826414e+04 1.701936e+05 2.148021e+05 1.089869e+04 5.272251e+04 1.076746e+05 1.507111e+05 7.093930e+04 1.302029e+05 4.769083e+04 4.499291e+05 9.320307e+04 9.491753e+04 1.068531e+05 4.024215e+05 1.257515e+05 1.362857e+05 1.899724e+05 1.947734e+05 2.559423e+05 2.009636e+05 8.831216e+04 2.483734e+05 2.002345e+05 6.700565e+04 2.094428e+05 1.393863e+05 1.155748e+05 1.911058e+05 2.364536e+05 1.749942e+05 2.588717e+05 2.691768e+05 1.716992e+05 1.594535e+05 1.167533e+05 1.332126e+05 2.222233e+06 1.221303e+05 1.237975e+05 9.633694e+04 2.019425e+05 1.745885e+05 1.066999e+05 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3.551460e+08 2.361557e+08 7.266523e+07 5.255948e+08 4.609892e+08 2.397300e+08 3.975930e+08 2.737718e+07 2.624319e+08 1.144385e+07 5.867612e+08 3.804269e+08 3.623908e+08 2.908342e+08 3.043525e+08 5.916943e+07 1.095450e+08 7.857566e+07 7.870111e+06 1.267606e+07 7.568650e+07 2.121629e+08 2.762244e+08 4.167909e+08 4.964786e+08 4.647061e+08 1.696615e+08 3.237367e+08 3.876979e+08 4.352006e+08 3.525018e+08 1.346463e+08 3.760971e+08 7.148236e+08 3.682898e+08 4.299788e+07 1.826953e+08 6.315251e+08 4.103004e+08 3.986573e+08 4.312222e+08 2.007545e+08 2.085197e+08 5.801511e+08 3.375549e+08 2.868137e+08 4.724082e+08 3.479455e+08 3.352057e+08 4.621417e+08 5.021702e+08 3.765231e+08 3.925968e+08 2.424483e+08 3.863799e+08 3.734983e+08 3.157126e+08 1.623536e+08 1.362694e+08 1.340934e+08 3.281852e+08 3.756390e+08 2.388394e+08 3.157486e+08 2.029028e+08 2.174452e+08 1.007393e+08 1.202942e+08 3.090878e+08 2.877949e+08 8.942324e+07 2.738217e+08 1.013532e+08 2.019736e+08 1.099620e+08 7.612422e+07 6.627176e+07 1.132318e+08 4.657106e+08 2.223359e+08 2.451786e+08 C11 H22 O7_1.956 1.203284e+05 1.813640e+06 1.836761e+06 1.765036e+06 8.152547e+04 7.478239e+05 1.680008e+06 1.680633e+06 91409.63 1.381107e+06 1.905878e+06 1.643807e+06 73233.87 1.546951e+06 1.628833e+06 1.571158e+06 2.840333e+05 1.470268e+06 1.623849e+06 1.539933e+06 1.379674e+05 1.413645e+06 1.604780e+06 1.693736e+06 77400.025 1.718812e+06 1.431730e+06 1.683605e+06 7.091557e+04 1.616210e+06 1.551629e+06 1.644458e+06 113835.87 1.668604e+06 1.521088e+06 1.315391e+06 1.092282e+05 1.623564e+06 1.840154e+06 1.186048e+06 1.027215e+05 1.637465e+06 1.973432e+06 1.863432e+06 4.756204e+04 1.187117e+06 1.764180e+06 1.412774e+06 1.147194e+06 1.085811e+06 2.293583e+06 8.951782e+05 4.953442e+05 1.651230e+06 5.547468e+05 8.581253e+05 1.221122e+06 9.746174e+05 6.356651e+05 8.849337e+05 1.142392e+06 7.575522e+05 5.392411e+05 1.122680e+06 6.539851e+05 7.308251e+06 8.562062e+05 5.270896e+05 1.084042e+06 6.478813e+05 6.194884e+05 7.285713e+05 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1.057240e+06 1.145630e+06 1.687126e+06 8.611970e+05 8.033889e+05 3.159990e+06 1.853262e+06 6.546569e+05 1.187866e+06 2.320447e+06 3.662256e+06 1.153058e+06 1.009956e+06 1.422430e+06 1.488988e+07 1.233776e+06 9.876374e+05 2.301151e+06 1.705584e+06 2.105042e+06 9.522625e+05 1.224667e+06 2.316791e+06 1.801321e+06 2.474008e+06 1.601379e+06 8.744534e+05 1.506721e+06 3.354487e+06 1.609298e+06 2.611773e+06 1.139803e+06 1.596047e+06 6.123280e+05 1.396704e+06 1.285626e+06 C8 H17 N O7_1.956 4.117904e+04 2.089456e+05 1.948472e+05 2.331711e+05 2.965618e+04 2.113563e+05 1.551295e+05 2.219915e+05 30734.78 1.606957e+05 2.454046e+05 2.877373e+05 26387.69 1.835548e+05 1.515451e+05 1.831799e+05 2.983285e+04 2.043090e+05 2.020046e+05 1.891510e+05 4.698459e+04 1.915007e+05 2.156475e+05 1.945769e+05 22074.547 2.517845e+05 1.891924e+05 2.003757e+05 2.076439e+04 2.297252e+05 1.492299e+05 2.374570e+05 35707.04 2.097923e+05 2.174112e+05 1.738430e+05 3.818736e+04 1.965003e+05 2.640229e+05 9.992032e+04 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9.083448e+05 122409.40 6.219781e+05 1.067112e+06 7.857811e+05 68347.37 6.671470e+05 8.538514e+05 7.608753e+05 9.459297e+04 6.736276e+05 8.680048e+05 8.230392e+05 1.399516e+05 7.966911e+05 8.261474e+05 8.301898e+05 79326.553 8.440362e+05 7.973287e+05 8.546109e+05 7.429667e+04 6.708876e+05 7.564247e+05 1.011027e+06 112280.63 7.563224e+05 8.271798e+05 7.533908e+05 1.053651e+05 7.290672e+05 8.022020e+05 6.442054e+05 9.607369e+04 6.485027e+05 8.728824e+05 1.268648e+06 3.922397e+04 6.417002e+05 7.241214e+05 6.722951e+05 7.748097e+05 9.580872e+05 3.901453e+05 5.513753e+05 3.092897e+05 7.961397e+05 3.552048e+05 5.649846e+05 4.785449e+05 5.779432e+05 4.514874e+05 6.536492e+05 7.976972e+05 4.620971e+05 5.749250e+05 7.278881e+05 3.883594e+05 2.540330e+06 5.514308e+05 4.208277e+05 7.392629e+05 4.320793e+05 6.038996e+05 5.035334e+05 1.411865e+06 6.874133e+05 1.679303e+06 7.441346e+05 1.822888e+06 1.354156e+06 1.499774e+05 2.548420e+06 8.382617e+05 7.346985e+05 1.759782e+06 9.279240e+05 1.180056e+06 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6.167525e+05 3.184398e+06 5.730954e+05 1.170520e+06 1.175320e+06 6.995368e+05 8.213449e+05 7.053227e+05 6.346523e+05 1.068241e+06 7.357322e+05 7.381130e+05 8.783922e+05 6.625913e+05 7.456820e+05 1.737107e+06 5.220189e+05 7.219204e+05 6.493608e+05 7.257669e+05 2.964903e+05 6.614295e+05 6.912539e+05 C12 H16 O6_1.956 4.187931e+04 1.916520e+05 1.349061e+05 1.635849e+05 2.950514e+04 1.237768e+05 2.108155e+05 1.949143e+05 29535.91 1.264697e+05 1.426849e+05 2.469602e+05 26779.27 9.719837e+04 1.295087e+05 1.039757e+05 2.864904e+04 2.212453e+05 2.259662e+05 1.223902e+05 5.277932e+04 3.632179e+05 1.189855e+05 2.224035e+05 28208.064 1.241426e+05 1.769410e+05 1.555002e+05 2.491072e+04 1.612435e+05 1.800755e+05 1.908269e+05 39995.27 1.441848e+05 1.354922e+05 1.826778e+05 3.861126e+04 1.196475e+05 2.647192e+05 1.477679e+05 3.347773e+04 1.612933e+05 1.963247e+05 2.150733e+05 1.418670e+04 1.496542e+05 8.799603e+04 1.742724e+05 1.334759e+05 1.841829e+05 1.359717e+05 8.991030e+04 6.577609e+04 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6.495990e+04 1.281822e+05 1.053936e+05 8.312669e+04 1.394366e+05 1.409505e+05 1.040719e+05 1.026866e+05 1.585734e+05 1.108428e+06 9.539518e+04 9.968318e+04 1.539270e+05 1.247309e+05 1.148478e+05 1.022536e+05 7.313634e+04 9.999037e+04 1.437907e+05 8.105476e+04 6.998400e+04 1.872558e+05 9.497759e+04 9.052007e+04 8.853356e+04 8.024398e+04 8.985500e+04 1.294652e+05 1.005059e+05 1.063488e+05 7.798011e+04 1.241410e+05 1.057774e+05 2.503032e+05 1.204323e+05 9.180464e+04 1.353794e+05 9.380548e+04 9.689513e+04 1.854532e+05 1.494719e+05 1.827871e+05 1.907535e+05 8.831371e+04 1.574182e+05 1.159183e+05 1.490138e+05 3.037955e+05 2.441637e+05 1.529208e+05 6.428573e+04 1.101741e+05 1.301789e+05 1.069024e+05 1.954504e+05 C9 H18 O6_1.956 1.403561e+05 3.397470e+06 2.688133e+06 3.131002e+06 7.540383e+04 1.861577e+06 3.083341e+06 3.084006e+06 66972.96 2.578941e+06 3.410209e+06 3.210227e+06 63217.81 2.382599e+06 2.622543e+06 3.105290e+06 8.871073e+04 2.558470e+06 3.086742e+06 2.716818e+06 1.293117e+05 2.700760e+06 3.150316e+06 2.868114e+06 77344.363 2.967196e+06 2.445036e+06 2.900682e+06 7.540007e+04 3.140606e+06 2.827171e+06 2.760723e+06 111275.01 3.065388e+06 3.038301e+06 2.364712e+06 1.044972e+05 2.770316e+06 3.254046e+06 2.208888e+06 9.761108e+04 3.020594e+06 3.353034e+06 3.385856e+06 4.544315e+04 2.462303e+06 2.778981e+06 2.724684e+06 2.195007e+06 2.325203e+06 8.800051e+05 2.030792e+06 1.113326e+06 3.244650e+06 1.005796e+06 1.976492e+06 1.864831e+06 2.198893e+06 1.189172e+06 2.129908e+06 2.044218e+06 1.275092e+06 9.115323e+05 2.165923e+06 1.346357e+06 1.255786e+07 1.430828e+06 1.331450e+06 2.216710e+06 1.254587e+06 1.268708e+06 1.277857e+06 7.050459e+05 1.371408e+06 6.823080e+06 3.032754e+06 7.428484e+06 5.172773e+06 3.040985e+05 1.117283e+07 3.475258e+06 2.535620e+06 5.048569e+06 3.357451e+06 4.061571e+06 1.231946e+07 6.799400e+06 1.555094e+06 7.017402e+06 6.495234e+06 4.558569e+06 8.322621e+06 2.012398e+06 1.210115e+06 8.587072e+05 1.436147e+06 1.854512e+06 7.831128e+05 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3.671519e+06 1.252218e+06 1.409172e+06 2.015894e+06 1.123944e+06 2.627950e+06 7.212174e+06 2.188589e+06 7.261435e+06 9.678150e+05 2.490570e+06 4.553750e+06 2.120435e+06 3.261004e+06 5.414046e+06 1.033140e+07 2.128086e+06 2.534541e+06 1.433233e+06 6.324551e+06 2.106284e+06 6.250802e+06 7.064767e+06 5.862100e+06 1.287310e+07 7.196857e+06 1.022855e+07 2.143315e+06 6.241886e+06 6.909192e+06 1.793139e+06 4.455977e+06 1.794621e+06 1.038775e+07 4.901691e+06 1.619800e+06 2.447388e+06 6.523512e+06 7.499261e+06 1.367258e+06 6.392135e+06 2.237348e+07 3.525584e+06 3.116772e+06 4.092818e+06 5.490916e+06 3.959534e+06 1.158849e+06 3.258623e+06 2.053619e+06 3.326948e+06 1.902218e+06 1.715810e+06 2.696997e+06 1.361934e+06 1.475502e+06 5.796277e+06 3.359956e+06 1.010469e+06 2.736896e+06 3.977188e+06 7.157000e+06 2.752226e+06 2.300544e+06 2.411743e+06 2.014772e+07 2.129684e+06 2.251375e+06 4.034235e+06 2.970669e+06 3.253075e+06 1.948400e+06 1.982825e+06 4.336004e+06 2.818720e+06 3.634297e+06 3.097077e+06 1.654764e+06 2.728439e+06 5.679585e+06 2.430278e+06 3.808619e+06 2.332542e+06 3.093031e+06 1.024261e+06 2.220444e+06 2.434824e+06 C13 H26 O8_1.956 8.091439e+04 7.596069e+05 6.921755e+05 7.141687e+05 5.739494e+04 4.796247e+05 7.007342e+05 8.382257e+05 55838.92 4.350989e+05 6.916559e+05 7.923551e+05 45929.62 6.607295e+05 5.923498e+05 7.522049e+05 1.634199e+05 6.641911e+05 6.368327e+05 5.405359e+05 9.042884e+04 5.846478e+05 7.966617e+05 7.952305e+05 48419.079 7.059277e+05 5.959341e+05 6.545378e+05 4.949608e+04 5.483891e+05 8.088721e+05 6.436265e+05 82905.71 7.370143e+05 6.180420e+05 5.342915e+05 7.959366e+04 6.591635e+05 6.672491e+05 7.043467e+05 7.024777e+04 6.846162e+05 8.687244e+05 6.158869e+05 3.343851e+04 5.569314e+05 6.918852e+05 6.578935e+05 4.054653e+05 6.512190e+05 1.334638e+05 3.520570e+05 2.363617e+05 5.869708e+05 2.493484e+05 3.469930e+05 4.300618e+05 4.213791e+05 2.228639e+05 4.512396e+05 4.542398e+05 3.219477e+05 2.125483e+05 3.612481e+05 2.450550e+05 2.885114e+06 2.943052e+05 2.725309e+05 4.129244e+05 2.091883e+05 2.174089e+05 2.730359e+05 2.705486e+05 3.009737e+05 1.673058e+06 4.836277e+05 1.542361e+06 1.117262e+06 1.047156e+05 2.404474e+06 7.505226e+05 5.038113e+05 1.059319e+06 7.756154e+05 6.160167e+05 2.846696e+06 1.408020e+06 4.188434e+05 1.327797e+06 1.277049e+06 7.290882e+05 1.960310e+06 3.182321e+05 1.922132e+05 3.339023e+05 3.236283e+05 4.202726e+05 1.859799e+05 1.905690e+05 3.223679e+05 1.573119e+05 2.784395e+05 2.076323e+05 2.609126e+05 2.138486e+05 2.736277e+05 1.958715e+05 2.736288e+05 3.416990e+05 2.448184e+05 7.458616e+05 3.721142e+05 2.877411e+05 1.909753e+05 1.771738e+05 1.605900e+05 4.003884e+05 3.531297e+05 2.630449e+05 4.193209e+05 1.337445e+05 1.366032e+05 1.680659e+05 2.601866e+05 1.621171e+05 3.137939e+05 5.286513e+05 1.451252e+05 2.579432e+05 1.746731e+05 4.555293e+05 2.114316e+05 4.234346e+05 5.962871e+05 2.826245e+05 3.844049e+05 5.952690e+05 3.032750e+05 3.481413e+05 4.590133e+05 2.420544e+05 4.191269e+05 3.665520e+05 4.503951e+05 2.412228e+05 3.399467e+05 4.838603e+05 2.349389e+05 2.787778e+05 8.268604e+05 4.882345e+05 1.182018e+06 7.785364e+05 3.036478e+05 1.842548e+05 2.563806e+05 4.120539e+05 4.348138e+05 3.760947e+05 3.104699e+05 2.670614e+05 2.870094e+05 2.752189e+05 6.725034e+05 1.478697e+06 7.084547e+05 2.835415e+05 7.379962e+05 5.644023e+05 5.920838e+05 1.103269e+06 4.805930e+05 4.920722e+05 4.581139e+05 8.498717e+05 6.866828e+05 2.491498e+05 2.645356e+05 3.225327e+05 2.398803e+05 8.205071e+05 1.540375e+06 4.877012e+05 1.951247e+06 2.623325e+05 5.273177e+05 8.992336e+05 3.881808e+05 7.445304e+05 8.772421e+05 2.725449e+06 6.956757e+05 5.338493e+05 2.796585e+05 1.738118e+06 4.155962e+05 1.218610e+06 2.334466e+06 1.371740e+06 3.117716e+06 1.443375e+06 2.498352e+06 3.854530e+05 1.097580e+06 1.352079e+06 5.842750e+05 6.130991e+05 3.151748e+05 1.930821e+06 8.962302e+05 3.821128e+05 3.755249e+05 1.126188e+06 1.209311e+06 2.477350e+05 9.675301e+05 6.060385e+06 8.936775e+05 6.966749e+05 6.806091e+05 1.146011e+06 8.410718e+05 1.972357e+05 6.290563e+05 4.808192e+05 7.380228e+05 1.839867e+05 3.772974e+05 5.667860e+05 2.652964e+05 2.124295e+05 1.272311e+06 7.875347e+05 2.033206e+05 4.784268e+05 9.518246e+05 1.273523e+06 3.926090e+05 3.623900e+05 4.775590e+05 6.869202e+06 5.882517e+05 4.721466e+05 8.393178e+05 8.639423e+05 8.411022e+05 4.406200e+05 4.045213e+05 8.919491e+05 7.825825e+05 8.232807e+05 6.948713e+05 3.901977e+05 5.666789e+05 1.460559e+06 5.851044e+05 1.404947e+06 6.235891e+05 6.681864e+05 2.601821e+05 5.604496e+05 5.105826e+05 C17 H18 N2 O3_1.956 2.753446e+05 4.898091e+05 4.256874e+05 2.681351e+05 3.553784e+04 2.620818e+05 5.474802e+05 3.803729e+05 29767.51 1.609892e+05 5.133858e+05 5.993359e+05 22067.08 2.620884e+05 4.102015e+05 3.715835e+05 2.918276e+04 3.176820e+05 3.658191e+05 3.716017e+05 6.021654e+04 2.705985e+05 3.781330e+05 5.809946e+05 30564.313 3.731109e+05 3.654719e+05 3.494933e+05 2.926697e+04 3.479659e+05 3.845986e+05 3.663663e+05 43522.57 4.368237e+05 4.586617e+05 3.698226e+05 3.859629e+04 2.384055e+05 4.360846e+05 3.201389e+05 3.274106e+04 4.456097e+05 4.221090e+05 3.747694e+05 1.286610e+04 3.921911e+05 4.987108e+05 2.604153e+05 2.241347e+05 2.200844e+05 1.804626e+05 3.667341e+05 1.617075e+05 1.702823e+05 3.317953e+05 8.482687e+05 8.783548e+04 4.782426e+05 2.008615e+05 4.323333e+05 2.626519e+06 2.126575e+06 6.054705e+05 3.578489e+05 7.797626e+05 4.427859e+05 2.065328e+05 1.711041e+06 2.850023e+05 3.254088e+05 6.407957e+05 9.148541e+05 4.738523e+05 4.559349e+05 9.379182e+04 3.485889e+05 4.233901e+05 4.179701e+05 1.525873e+06 5.388693e+05 2.291985e+05 2.429163e+05 2.971394e+05 2.644813e+05 1.219609e+06 1.201043e+05 2.710863e+05 1.049033e+05 2.245126e+05 4.486211e+05 3.381862e+05 1.771872e+05 8.081787e+04 1.567018e+05 1.821699e+05 3.762577e+05 1.879181e+05 9.483031e+05 3.193737e+05 3.913895e+05 1.019511e+05 3.546023e+05 6.710789e+05 1.593907e+05 4.806104e+05 3.940688e+05 1.466941e+05 2.482307e+05 3.619460e+06 1.647631e+05 7.801315e+04 1.827963e+05 1.300302e+05 3.518032e+05 1.078017e+05 1.756191e+05 3.174451e+05 1.596829e+05 1.113039e+05 1.112759e+06 1.072620e+05 3.176612e+05 9.953456e+04 7.350230e+04 1.568413e+05 9.859313e+04 2.296344e+05 1.956023e+05 1.860527e+05 7.806962e+05 4.673456e+05 5.511843e+04 3.903723e+05 4.990065e+05 3.386099e+05 3.335870e+05 3.665052e+05 2.219238e+05 1.475329e+05 1.145558e+06 5.319052e+04 1.905885e+05 1.634138e+05 2.218284e+05 2.378776e+05 2.079391e+05 1.648762e+05 8.205895e+04 7.841442e+04 1.827870e+05 2.541013e+05 1.861592e+05 1.178258e+05 5.865572e+05 2.057797e+05 1.016251e+05 5.143182e+05 2.944886e+05 5.489258e+05 3.562145e+05 1.795093e+05 3.038600e+05 2.818449e+05 5.903765e+04 1.976966e+05 4.315531e+05 6.800584e+05 2.127273e+05 7.339060e+04 1.940205e+05 2.243346e+05 3.739254e+05 2.985061e+05 2.289483e+05 1.587403e+05 3.325241e+05 2.492266e+05 4.234566e+05 3.125682e+05 1.071554e+05 5.529809e+05 6.743748e+04 1.569644e+05 1.267871e+05 2.072552e+05 3.310660e+05 3.137997e+05 1.286961e+05 6.999932e+05 4.070982e+05 2.255794e+05 9.532356e+04 7.640655e+04 1.230662e+05 5.454000e+05 1.584855e+05 4.304372e+05 6.142436e+05 3.119071e+05 7.836137e+05 4.757914e+05 1.482682e+05 1.216354e+05 3.402314e+05 9.534028e+04 3.049989e+05 3.468151e+05 1.069877e+05 6.663263e+05 2.420539e+05 1.045214e+06 3.475399e+05 1.399700e+05 2.264849e+05 8.044215e+04 2.888003e+05 1.666864e+05 4.671927e+05 3.248281e+05 1.095669e+06 2.349047e+05 1.440998e+05 2.138423e+05 6.365755e+04 9.676895e+04 3.149683e+05 1.123623e+05 8.711043e+04 1.996303e+05 1.614316e+05 5.034054e+05 3.149752e+05 1.251411e+05 1.513193e+05 5.475979e+05 3.396385e+05 3.884362e+05 1.334117e+05 2.050547e+05 2.041789e+05 4.555871e+05 2.124993e+06 2.623760e+05 5.551012e+05 2.870987e+05 1.361629e+06 8.467998e+05 7.100139e+05 3.489521e+05 9.448541e+04 3.081929e+05 6.885698e+05 4.360963e+05 3.049064e+05 1.116750e+06 5.067177e+06 4.564124e+05 1.470167e+06 1.041208e+05 7.965652e+04 6.925233e+05 1.902315e+06 644.80779_1.956 9.431020e+04 8.451891e+05 9.591072e+05 9.044310e+05 5.876665e+04 4.383910e+05 1.233990e+06 9.390686e+05 37473.16 8.264907e+05 9.424474e+05 9.018833e+05 29535.79 9.274657e+05 9.132816e+05 8.433089e+05 3.244695e+04 7.584076e+05 7.358668e+05 7.474253e+05 5.472243e+04 1.365886e+06 7.678127e+05 8.606297e+05 29208.013 9.264633e+05 8.640155e+05 1.077573e+06 2.451395e+04 6.576681e+05 8.456389e+05 9.984993e+05 31838.99 9.675813e+05 7.459969e+05 6.060895e+05 2.475715e+04 1.051234e+06 1.093259e+06 9.492263e+05 2.307287e+04 8.860713e+05 6.966725e+05 9.312057e+05 1.108519e+04 9.999774e+05 9.793217e+05 7.030391e+05 7.415519e+05 8.455337e+05 2.218997e+05 8.386074e+05 7.647945e+05 6.548107e+05 3.175409e+05 6.163946e+05 5.058167e+05 4.045690e+05 3.461149e+05 8.345058e+05 6.030479e+05 3.892406e+05 9.291913e+05 2.805855e+05 7.650944e+05 6.390473e+05 8.050969e+05 2.451409e+05 5.769199e+05 1.239637e+06 7.293225e+05 3.391126e+05 7.885519e+05 9.391513e+05 6.749741e+05 7.215798e+05 7.506008e+05 4.593639e+05 6.048962e+04 5.449568e+05 5.489232e+05 6.619489e+05 4.819188e+05 4.939989e+05 2.976740e+05 3.592338e+05 3.928459e+05 1.936802e+05 5.203043e+05 3.005667e+05 5.854446e+05 6.334494e+05 1.223113e+06 3.803464e+05 4.183490e+05 6.303219e+05 7.559784e+05 5.000379e+05 7.733425e+05 7.620117e+05 2.463403e+05 7.794590e+05 6.592517e+05 7.299086e+05 3.754023e+05 5.114910e+05 4.715337e+05 3.518281e+05 4.152270e+05 4.088469e+05 6.152658e+05 2.757729e+05 4.043697e+05 7.417261e+05 6.985564e+05 6.705214e+05 4.092358e+05 5.815870e+05 3.579169e+05 2.394036e+05 4.111302e+05 2.434674e+05 3.581211e+05 2.028582e+05 3.798700e+05 2.485232e+05 5.459645e+05 3.583096e+05 4.752444e+05 6.724819e+05 5.086838e+05 3.611111e+04 2.758197e+05 3.683098e+05 5.251668e+05 4.695152e+05 3.535287e+05 5.742767e+05 5.292888e+05 4.397862e+05 2.439328e+05 2.903395e+05 5.267356e+05 4.221652e+05 6.294023e+05 4.478690e+05 3.528798e+05 5.280196e+05 3.131129e+05 2.455094e+05 1.207341e+05 3.886505e+05 3.914932e+05 3.582325e+05 4.118038e+05 5.675516e+05 2.433582e+05 2.950211e+05 3.582312e+05 3.170974e+05 1.529930e+05 1.599859e+05 6.801683e+05 9.039150e+05 1.205559e+06 7.754479e+05 7.018151e+05 1.117735e+06 5.433702e+05 8.801467e+05 6.554780e+05 1.223994e+06 7.965927e+05 7.049669e+05 1.100186e+06 5.990144e+05 5.305291e+05 3.962969e+05 3.617556e+05 7.265280e+05 5.917893e+05 6.700734e+05 9.329993e+05 3.307193e+05 4.416657e+05 6.020398e+05 8.593601e+05 1.099734e+06 1.771599e+05 5.926882e+05 6.716457e+04 2.203932e+05 5.763599e+05 9.346223e+05 6.985446e+05 8.192395e+05 1.131209e+05 4.631061e+05 7.118147e+05 1.190564e+05 1.135071e+05 3.636344e+05 1.179704e+06 7.800414e+05 1.236145e+06 5.162922e+05 8.673455e+05 9.888365e+05 1.404183e+06 8.939039e+05 9.818972e+05 1.074621e+06 8.765331e+05 1.968831e+06 1.085541e+06 9.526029e+05 2.171294e+05 7.981904e+05 6.236866e+05 8.552924e+05 1.096123e+06 5.673169e+05 9.590621e+05 1.108666e+06 8.021793e+05 9.465994e+05 1.018544e+06 5.186754e+05 1.030265e+06 8.340964e+05 1.293343e+06 8.536975e+05 4.691551e+05 7.736902e+05 1.072288e+06 7.541359e+05 1.285568e+06 6.152905e+05 7.165949e+05 9.578722e+05 6.335644e+05 1.318683e+06 1.295019e+06 1.620276e+06 1.538140e+06 9.813572e+05 1.424028e+06 5.296785e+05 6.382941e+05 1.262516e+06 7.594703e+05 4.499794e+05 1.248001e+06 5.440934e+05 1.235733e+06 6.031943e+05 6.055434e+05 3.101712e+05 3.252952e+05 4.493646e+05 1.039465e+06 9.042521e+05 C4 H10 N2 O6 P2_1.956 4.133581e+04 1.387802e+06 1.310305e+06 1.387066e+06 2.910915e+04 1.346264e+06 1.593030e+06 1.379488e+06 28757.49 1.328348e+06 1.543373e+06 1.372262e+06 25686.54 1.310802e+06 1.302135e+06 1.433357e+06 2.816370e+04 1.325972e+06 1.502698e+06 1.369846e+06 5.173005e+04 1.481243e+06 1.297706e+06 1.206236e+06 29106.686 1.597774e+06 1.367881e+06 1.423625e+06 2.577863e+04 1.369338e+06 1.355565e+06 1.369574e+06 37924.47 1.481154e+06 1.444046e+06 1.382578e+06 3.465494e+04 1.312977e+06 1.479846e+06 1.211380e+06 3.288252e+04 1.400389e+06 1.448725e+06 1.481904e+06 1.238891e+04 1.346884e+06 1.493970e+06 1.296016e+06 1.429494e+06 2.097113e+06 9.428856e+05 1.696957e+06 1.418682e+06 1.295994e+06 1.843644e+06 1.317555e+06 1.672350e+06 1.709647e+06 1.495935e+06 1.362487e+06 1.834446e+06 1.553222e+06 1.933505e+06 2.250126e+06 1.733787e+06 2.300776e+06 1.812157e+06 2.376656e+06 2.523804e+06 1.964647e+06 1.579831e+06 1.844902e+06 1.870639e+06 2.063959e+06 1.983016e+06 1.433531e+06 1.939615e+06 1.556831e+06 5.265099e+04 2.078198e+06 1.738711e+06 1.946092e+06 3.186171e+06 2.239700e+06 2.357833e+06 2.119079e+06 1.376859e+06 2.564151e+06 2.174966e+06 2.504643e+06 2.261285e+06 1.473448e+06 2.162613e+06 1.991758e+06 2.451848e+06 1.867374e+06 2.433756e+06 1.201279e+06 9.155903e+05 1.421823e+06 1.858254e+06 1.503284e+06 9.580624e+05 1.433610e+06 2.585765e+06 2.307347e+06 2.169895e+06 2.407905e+06 2.012783e+06 1.982216e+06 1.893820e+06 3.228655e+06 2.135649e+06 1.468430e+06 1.224963e+06 1.667256e+06 1.830164e+06 1.189866e+06 1.889598e+06 2.152099e+06 1.410540e+06 1.620461e+06 1.763715e+06 6.856613e+05 1.590016e+06 1.401427e+06 2.904717e+06 1.501030e+06 1.359702e+06 1.671193e+06 1.547593e+06 4.888453e+04 1.687700e+06 1.410765e+06 1.709398e+06 1.687577e+06 1.790134e+06 1.765990e+06 1.460656e+06 2.392326e+06 1.383055e+06 9.689045e+05 1.895575e+06 1.601180e+06 1.401027e+06 1.490284e+06 9.715253e+05 1.746839e+06 8.886663e+05 2.567562e+06 2.116117e+06 3.101735e+06 2.726917e+06 2.369776e+06 2.074032e+06 2.438519e+06 3.615598e+06 3.947333e+06 3.853084e+06 1.830776e+06 2.612114e+06 2.114848e+06 1.980966e+06 1.470847e+06 2.027200e+06 1.402760e+06 1.579578e+06 1.380439e+06 1.878211e+06 1.807834e+06 1.122373e+06 1.646510e+06 1.867751e+06 1.396475e+06 1.967816e+06 1.478160e+06 2.085137e+06 1.756664e+06 2.858302e+06 8.803535e+05 1.707289e+06 3.775351e+05 1.022318e+06 1.680342e+06 1.519678e+05 2.820627e+05 9.149737e+05 8.744763e+05 2.599076e+06 7.227476e+05 3.099550e+06 9.092591e+04 4.340479e+05 9.064745e+05 1.560868e+06 7.063650e+05 1.953083e+06 1.780920e+06 1.143533e+06 3.299131e+06 3.701395e+06 2.220502e+06 2.009408e+06 7.112970e+05 4.583150e+05 2.639529e+05 4.744791e+05 9.219920e+05 1.210886e+06 5.237514e+05 7.357021e+05 7.420122e+05 1.329313e+06 6.372257e+05 4.946912e+05 6.160706e+05 2.508242e+06 1.726114e+06 1.759763e+05 4.396634e+05 9.362514e+05 5.633858e+05 8.595983e+05 1.380093e+06 2.194891e+05 9.594529e+05 1.243834e+06 3.914244e+05 9.486415e+05 5.318699e+05 5.874426e+05 6.472823e+05 3.992441e+05 5.397651e+05 1.178460e+06 7.160825e+05 8.817557e+05 3.417296e+05 1.245351e+06 1.582754e+06 1.561753e+06 1.631457e+06 1.322135e+06 2.601789e+06 1.224618e+06 1.895654e+06 2.567260e+06 3.391485e+06 2.647820e+06 2.245524e+06 1.312348e+06 1.812349e+06 1.674242e+06 1.845291e+06 2.716250e+06 1.289341e+06 2.412693e+06 2.032744e+06 5.551083e+05 2.651795e+05 2.795409e+06 1.485131e+06 C46 H89 N O17_1.956 1.621384e+06 4.128007e+06 3.819625e+06 3.647195e+06 9.482356e+04 2.987851e+06 3.802438e+06 4.044722e+06 92960.18 3.304778e+06 3.906679e+06 4.353785e+06 85710.50 3.206745e+06 3.511640e+06 3.756422e+06 1.710228e+05 3.519671e+06 3.722442e+06 3.810546e+06 1.560194e+05 3.387768e+06 3.699458e+06 4.450551e+06 87739.266 3.737909e+06 3.336621e+06 3.287043e+06 8.526490e+04 3.533416e+06 4.039484e+06 4.077293e+06 128322.93 3.733547e+06 3.318524e+06 3.272102e+06 1.154858e+05 4.011223e+06 3.811917e+06 3.672472e+06 1.052318e+05 3.380815e+06 4.362624e+06 4.264220e+06 4.147907e+04 2.779695e+06 3.630059e+06 3.817551e+06 2.125491e+06 3.703540e+06 1.208314e+06 3.313561e+06 2.094326e+06 2.894072e+06 2.753450e+06 6.555513e+06 1.339973e+07 1.900933e+07 3.860382e+06 5.481720e+06 3.922784e+06 4.044969e+06 3.031750e+06 4.491181e+06 8.179977e+06 2.653776e+06 4.535674e+06 2.906971e+06 6.807827e+06 4.947410e+06 4.352239e+06 5.438032e+06 4.369661e+06 4.384415e+06 4.748033e+06 9.901005e+06 3.603355e+06 2.939021e+06 1.858848e+06 3.339799e+06 4.755684e+06 2.372784e+06 9.466689e+06 2.572037e+06 1.879329e+06 3.087898e+06 2.138698e+06 3.942556e+06 3.353123e+06 2.625066e+06 3.967000e+06 2.658209e+06 7.489880e+06 2.945960e+06 4.887674e+06 2.817814e+06 4.069025e+06 3.281794e+06 2.660189e+06 2.289551e+06 2.773854e+06 4.712468e+06 4.813950e+06 4.846907e+06 2.687999e+06 3.848039e+06 4.318731e+06 4.637220e+06 2.249033e+06 1.994154e+06 3.790473e+06 1.480524e+07 4.592010e+06 2.553785e+06 2.051550e+06 2.252696e+06 2.627693e+06 2.350709e+06 2.733481e+06 3.739335e+06 1.729173e+06 1.398932e+06 1.928810e+06 7.549218e+06 4.509651e+06 3.206809e+06 1.138348e+07 1.870817e+06 3.125027e+06 3.299321e+06 2.544534e+06 1.175292e+06 4.773703e+06 4.367284e+06 3.137051e+06 4.550283e+06 3.793210e+06 3.886933e+06 3.637704e+06 3.932077e+06 2.019472e+06 4.930183e+06 3.088277e+06 3.544235e+06 8.725122e+06 3.896774e+06 9.477834e+06 6.008722e+06 7.683144e+06 5.041996e+06 6.528377e+06 8.363116e+06 5.628345e+06 2.352083e+06 3.063161e+06 2.598212e+06 1.494806e+07 6.590628e+06 4.811984e+06 1.471744e+07 2.716247e+06 3.830665e+06 4.184624e+06 2.611567e+06 2.740129e+06 1.659266e+06 1.702654e+06 1.769455e+06 1.880977e+06 2.084158e+06 2.380108e+06 3.692877e+06 2.946920e+06 2.213529e+06 4.201824e+06 2.262942e+06 5.961835e+06 6.685681e+06 4.084720e+06 3.522250e+06 7.018183e+06 2.755250e+06 7.555096e+06 6.847215e+06 1.548542e+06 1.900995e+06 3.647188e+06 3.633578e+06 5.479950e+06 2.199279e+06 5.813894e+06 3.674831e+06 2.175197e+06 3.171326e+06 8.209375e+06 2.041449e+06 5.849286e+06 6.710901e+06 2.942082e+06 6.409928e+06 8.443135e+06 7.917102e+06 2.384634e+06 2.722821e+06 2.759797e+06 2.154083e+06 1.946914e+06 1.200723e+07 3.568891e+06 2.803247e+06 2.045492e+06 2.316324e+06 2.323355e+06 3.341107e+06 1.785736e+06 3.808475e+06 7.932420e+06 3.412296e+06 2.966584e+06 2.284145e+06 6.527716e+06 2.342425e+06 1.949249e+06 2.155909e+06 3.273246e+06 4.772890e+06 3.376107e+06 4.141243e+06 2.571637e+06 5.933433e+06 4.133816e+06 5.319660e+06 4.014061e+06 2.143473e+06 3.139882e+06 2.907703e+06 4.335552e+06 4.341855e+06 3.377855e+06 3.758795e+06 4.705633e+06 3.747683e+06 4.019831e+06 3.927795e+06 2.418642e+06 3.793493e+06 4.556745e+06 2.462286e+06 3.789109e+06 4.694812e+06 2.458398e+06 2.065532e+06 2.779537e+06 3.294748e+06 6.899050e+06 3.015567e+06 1.513522e+06 1.276890e+07 1.893247e+06 3.359279e+06 2.981310e+06 1.039413e+07 C4 H8 N2 O_1.956 4.096809e+04 2.340124e+06 1.829753e+06 2.044217e+06 2.881148e+04 1.623573e+06 2.180304e+06 2.170393e+06 27366.15 1.590760e+06 2.387964e+06 2.271768e+06 23350.88 1.644380e+06 1.937543e+06 2.107927e+06 2.602076e+04 1.810230e+06 2.169428e+06 1.861247e+06 4.908950e+04 1.977276e+06 2.112947e+06 2.034299e+06 28481.405 2.119051e+06 1.633931e+06 1.946845e+06 2.633855e+04 2.272844e+06 2.051105e+06 1.891437e+06 40612.80 2.163511e+06 2.065258e+06 1.657836e+06 3.741054e+04 1.921335e+06 2.129059e+06 1.778483e+06 3.384464e+04 2.154549e+06 2.233234e+06 2.306167e+06 1.404957e+04 1.778721e+06 1.962161e+06 1.871794e+06 1.512190e+06 1.646237e+06 6.084743e+05 1.602301e+06 7.800898e+05 2.246303e+06 6.652721e+05 1.484620e+06 1.300718e+06 1.456514e+06 8.401368e+05 1.444198e+06 1.306658e+06 1.076525e+06 7.652262e+05 1.459561e+06 9.186507e+05 8.492512e+06 9.752074e+05 1.003040e+06 1.408819e+06 8.585650e+05 8.503239e+05 8.837070e+05 4.594357e+05 8.106771e+05 4.789381e+06 2.083365e+06 4.870678e+06 3.602906e+06 1.245382e+05 7.393658e+06 2.480611e+06 1.758792e+06 3.281831e+06 2.359064e+06 2.673902e+06 8.251521e+06 4.902236e+06 1.083297e+06 4.915742e+06 4.230611e+06 3.196153e+06 5.884892e+06 1.198606e+06 6.908471e+05 6.714944e+05 1.087417e+06 1.225359e+06 5.608058e+05 3.437406e+05 1.088073e+06 5.396074e+05 8.071983e+05 5.967638e+05 1.079836e+06 9.671858e+05 8.983928e+05 7.582542e+05 7.852168e+05 1.497611e+06 7.284366e+05 2.474163e+06 1.410727e+06 9.766780e+05 6.075152e+05 8.203136e+05 6.100984e+05 3.935737e+05 9.867697e+05 1.145006e+06 1.547007e+06 5.292670e+05 4.681154e+05 5.437652e+05 8.230402e+05 4.674232e+05 7.250448e+05 1.714453e+06 6.738495e+05 9.058214e+05 9.308448e+05 2.041363e+06 1.485560e+05 2.303665e+06 2.311251e+06 1.508490e+06 1.466803e+06 2.163593e+06 1.687371e+06 1.299519e+06 2.138289e+06 9.480112e+05 1.800450e+06 1.488178e+06 1.690469e+06 7.768811e+05 1.428625e+06 2.036988e+06 9.425845e+05 1.439650e+06 3.420291e+06 2.153018e+06 4.911456e+06 3.608424e+06 1.614917e+06 7.169198e+05 7.415504e+05 1.539786e+06 1.381589e+06 1.542736e+06 8.954228e+05 9.237975e+05 1.148534e+06 1.230090e+06 2.936160e+06 4.111233e+06 2.960398e+06 1.356438e+06 2.520207e+06 1.722355e+06 2.255263e+06 3.965052e+06 1.674907e+06 1.691295e+06 1.851038e+06 4.290483e+06 2.608548e+06 9.429013e+05 1.015438e+06 1.175885e+06 9.154100e+05 1.860726e+06 5.032086e+06 1.563040e+06 5.218647e+06 7.053814e+05 1.717650e+06 3.035289e+06 1.633861e+06 2.318912e+06 3.672044e+06 7.361193e+06 1.701628e+06 1.684557e+06 1.039918e+06 4.279388e+06 1.457101e+06 4.410268e+06 4.883182e+06 4.061211e+06 8.995751e+06 4.722196e+06 6.722086e+06 1.469103e+06 4.393916e+06 4.799769e+06 1.382347e+06 3.080837e+06 1.219455e+06 7.131391e+06 3.361204e+06 1.314101e+06 1.750846e+06 4.621899e+06 5.299424e+06 9.180872e+05 4.594698e+06 1.496069e+07 2.312958e+06 2.517368e+06 2.887849e+06 4.006505e+06 2.667313e+06 8.143763e+05 2.187535e+06 1.429219e+06 2.472986e+06 1.328927e+06 1.137728e+06 1.964053e+06 1.038919e+06 1.056941e+06 3.973409e+06 2.285102e+06 7.377170e+05 2.011638e+06 2.674169e+06 4.882490e+06 2.013982e+06 1.584819e+06 1.571674e+06 1.381956e+07 1.420334e+06 1.761239e+06 2.682954e+06 2.202472e+06 2.254145e+06 1.234432e+06 1.135170e+06 3.022688e+06 2.035258e+06 2.626322e+06 2.119787e+06 1.230982e+06 2.030725e+06 3.753386e+06 1.760975e+06 2.633899e+06 1.591057e+06 2.068064e+06 7.316059e+05 1.681620e+06 1.509968e+06 C11 H8 N2 O4_1.956 5.868817e+04 1.180150e+06 1.213507e+06 1.392940e+06 3.910372e+04 9.034184e+05 1.280722e+06 1.079543e+06 44877.26 1.231823e+06 1.174511e+06 1.252351e+06 43003.10 1.166910e+06 1.164722e+06 1.120450e+06 3.855668e+04 1.241331e+06 1.227814e+06 1.205427e+06 7.085616e+04 1.058614e+06 1.227414e+06 1.200574e+06 44568.162 1.246699e+06 1.179612e+06 1.152513e+06 3.769305e+04 1.181211e+06 1.166944e+06 1.273719e+06 56878.36 1.088123e+06 1.259223e+06 1.071376e+06 5.025399e+04 1.205309e+06 1.180245e+06 1.228359e+06 4.555040e+04 1.090324e+06 1.219896e+06 1.408794e+06 1.845831e+04 1.048003e+06 1.302915e+06 1.032371e+06 9.717321e+05 9.483933e+05 2.781757e+05 1.131243e+06 9.621226e+05 9.603227e+05 3.284550e+05 5.509791e+05 9.515676e+05 3.380552e+05 6.722667e+05 9.668913e+05 1.005358e+06 4.241104e+05 1.130780e+06 3.263631e+05 1.101270e+06 8.165312e+05 1.143176e+06 2.191139e+05 5.056508e+05 1.009297e+06 1.017404e+06 6.624090e+05 8.403450e+05 1.234210e+06 6.297998e+05 1.005649e+06 7.154578e+05 4.707062e+05 7.201231e+04 7.439978e+05 4.663359e+05 6.070919e+05 4.104377e+05 4.826537e+05 2.897178e+05 4.300717e+05 4.377020e+05 9.331511e+04 4.044282e+05 2.205034e+05 5.936564e+05 9.926805e+05 1.024122e+06 2.767811e+05 4.271788e+05 1.061451e+06 8.692401e+05 8.235319e+05 1.235417e+06 8.950170e+05 2.063372e+05 1.084018e+06 5.151039e+05 1.507553e+06 3.090056e+05 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2.819050e+06 1.520194e+06 1.609950e+06 331.4279_1.957 8.639166e+04 1.066258e+06 1.507872e+06 1.457294e+06 5.580630e+04 8.956275e+05 1.787408e+06 1.575163e+06 43569.82 1.252736e+06 1.266833e+06 1.267238e+06 38241.66 1.410702e+06 1.370698e+06 1.503173e+06 3.312085e+04 1.007112e+06 1.335340e+06 1.191276e+06 6.076797e+04 1.944387e+06 1.430453e+06 1.288868e+06 45578.321 1.051242e+06 1.192347e+06 1.647325e+06 3.643811e+04 1.189373e+06 1.087357e+06 1.219916e+06 43818.75 1.745587e+06 1.361849e+06 1.097068e+06 3.592072e+04 1.736009e+06 1.290116e+06 1.304929e+06 3.760311e+04 1.364229e+06 1.278239e+06 1.407390e+06 1.809700e+04 1.353739e+06 1.474103e+06 1.222835e+06 1.162121e+06 9.681334e+05 3.586416e+05 1.040194e+06 1.082689e+06 1.042246e+06 3.723071e+05 6.398008e+05 5.704216e+05 2.802950e+05 6.783033e+05 9.871562e+05 7.449724e+05 2.653276e+05 9.235029e+05 3.478865e+05 9.341558e+05 9.363377e+05 9.322688e+05 2.680691e+05 3.811106e+05 9.146533e+05 8.060393e+05 3.623070e+05 1.097189e+06 9.939829e+05 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1.954135e+06 3.154483e+06 3.408400e+06 2.257378e+06 1.870734e+06 2.418987e+06 2.518470e+06 1.804491e+06 3.153616e+06 1.879218e+06 1.235048e+06 1.155251e+06 1.074131e+06 1.697776e+06 1.574956e+06 1.231074e+06 2.488450e+06 7.244297e+05 1.075346e+06 3.315324e+05 4.340061e+05 1.345568e+06 9.146253e+05 5.828671e+05 1.983627e+06 6.001266e+05 6.020876e+05 6.845977e+05 5.812457e+05 4.797069e+05 1.067867e+06 2.120259e+06 1.388248e+06 1.300379e+06 441.31191_1.957 3.907544e+04 3.612145e+06 2.960619e+06 3.401309e+06 2.709207e+04 2.614743e+06 3.540515e+06 3.479376e+06 24592.69 3.095756e+06 3.607093e+06 3.980254e+06 22133.98 2.745285e+06 2.934747e+06 3.302003e+06 2.507882e+05 3.161451e+06 2.932610e+06 3.414733e+06 5.074122e+04 2.969334e+06 3.397170e+06 3.943486e+06 28068.071 3.318070e+06 2.934723e+06 2.859170e+06 2.732763e+04 3.356407e+06 3.189328e+06 3.735023e+06 42437.71 3.396804e+06 3.246748e+06 2.761826e+06 4.031305e+04 3.207660e+06 3.245759e+06 3.231897e+06 3.646388e+04 3.245915e+06 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8.849268e+06 1.032650e+07 1.643553e+06 9.433655e+06 8.148713e+06 1.012685e+07 2.112220e+06 1.780888e+06 2.682625e+06 2.268136e+06 2.472997e+06 1.514387e+06 4.224962e+06 3.459996e+06 2.021495e+06 2.763481e+06 2.109719e+06 3.136668e+06 2.339646e+06 3.646170e+06 1.101933e+07 3.880644e+06 3.925257e+06 2.496985e+06 3.741014e+06 2.555336e+06 1.359091e+06 1.774130e+06 3.010730e+06 4.116280e+06 3.945582e+06 2.429411e+06 2.824301e+06 2.401082e+06 2.849445e+06 4.842160e+06 3.475876e+06 2.813452e+06 3.353194e+06 3.870825e+06 4.476528e+06 3.219348e+06 2.412749e+06 1.970502e+06 6.494425e+06 2.923852e+06 3.965657e+06 4.125139e+06 2.645726e+06 2.979729e+06 4.417184e+06 2.897027e+06 3.777970e+06 5.702290e+06 2.599320e+06 2.613955e+06 3.166325e+06 2.298721e+06 6.664309e+06 1.724644e+06 1.637101e+06 2.692683e+06 1.865467e+06 3.114029e+06 3.280222e+06 4.037784e+06 C10 H17 Cl O3 S2_1.957 5.342002e+04 1.477697e+06 1.581216e+06 2.170099e+06 3.788058e+04 1.108512e+06 1.818443e+06 1.664633e+06 41232.89 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5.184273e+05 8.566873e+05 7.175824e+05 9.166128e+05 1.571454e+05 7.507625e+05 7.987034e+05 7.183269e+05 7.462293e+04 1.689544e+05 8.641413e+05 7.729270e+05 6.816063e+05 8.729841e+05 4.375972e+05 2.813634e+05 1.111264e+06 5.254656e+05 4.444411e+05 8.721136e+05 7.417619e+05 8.156982e+05 1.150682e+06 9.919799e+05 6.740066e+05 8.574562e+05 4.085656e+05 6.980112e+05 5.004390e+05 5.865334e+05 2.185055e+05 1.050094e+05 9.305120e+04 3.649790e+05 4.577835e+05 2.298320e+05 5.698275e+05 3.471864e+05 1.397579e+05 4.524080e+04 1.555838e+05 2.276726e+05 2.441728e+05 7.438999e+04 3.282715e+05 7.447021e+04 1.246153e+05 8.926856e+04 7.114359e+04 5.778022e+04 9.761359e+04 7.925431e+05 9.663232e+04 3.041082e+05 C44 H82 N10 O6 S2_1.957 3.181955e+04 1.768073e+05 1.946716e+05 1.752015e+05 2.450513e+04 1.050946e+05 1.410423e+05 1.856604e+05 19563.23 1.217177e+05 2.022940e+05 2.164426e+05 15791.43 1.476276e+05 1.794861e+05 9.141170e+04 2.060723e+04 1.548215e+05 1.457095e+05 2.474891e+05 4.192616e+04 1.526871e+05 1.435841e+05 1.831436e+05 26115.052 1.048132e+05 1.850719e+05 1.545561e+05 2.253671e+04 1.509250e+05 2.021046e+05 2.209625e+05 34277.52 8.905688e+04 1.899733e+05 1.470146e+05 3.552567e+04 1.602500e+05 1.830327e+05 1.339373e+05 3.642804e+04 1.338696e+05 1.331306e+05 2.743099e+05 1.310208e+04 1.385736e+05 9.038202e+04 1.878563e+05 1.507799e+05 1.238143e+05 5.652194e+04 2.223282e+05 5.620962e+04 8.568450e+04 1.522193e+05 1.651406e+05 1.640777e+05 1.528264e+05 2.350220e+05 2.306875e+05 2.566360e+05 2.178266e+05 2.264841e+05 2.847122e+05 3.434760e+05 2.095142e+05 2.811476e+05 1.647002e+05 1.924852e+05 2.008126e+05 3.185519e+05 3.253466e+05 3.281039e+05 3.050765e+05 1.152168e+05 1.134034e+05 1.696162e+05 1.302948e+05 1.060270e+05 1.085628e+05 1.502122e+05 8.287617e+04 1.249049e+05 9.344390e+04 1.146889e+05 1.699520e+05 5.444867e+04 1.368462e+05 1.447702e+05 1.134807e+05 2.257556e+05 1.494217e+05 1.967807e+05 1.569024e+05 1.881402e+05 1.830406e+05 3.442112e+05 6.825124e+04 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1.843329e+05 1.953034e+05 2.663126e+05 2.108283e+05 2.380571e+05 6.688644e+05 1.458947e+05 9.295867e+04 3.207771e+05 1.429592e+05 1.292031e+05 8.972880e+04 1.096470e+05 2.860809e+05 1.292952e+05 2.809336e+05 2.528111e+05 2.010463e+05 3.749236e+05 6.297251e+05 1.113581e+05 3.584095e+05 4.168980e+05 1.337813e+05 3.536617e+05 3.942714e+05 4.840343e+05 9.142856e+04 7.880429e+04 1.406216e+05 9.415371e+04 1.655374e+05 1.563198e+06 1.715819e+05 9.734995e+04 1.007029e+05 1.154379e+05 8.669777e+04 9.245409e+04 1.755230e+05 2.004224e+05 5.256997e+05 1.783951e+05 1.518556e+05 1.970809e+05 1.673465e+05 1.326484e+05 6.690391e+04 1.194019e+05 2.008679e+05 2.410770e+05 1.562115e+05 1.236082e+05 1.254388e+05 1.637277e+05 1.654814e+05 2.837589e+05 1.171882e+05 1.265382e+05 1.309243e+05 1.951536e+05 2.652378e+05 2.119616e+05 1.438273e+05 1.243083e+05 3.668701e+05 1.593799e+05 1.974492e+05 2.002532e+05 1.183742e+05 1.530280e+05 2.611683e+05 7.096610e+04 1.832704e+05 2.384269e+05 1.376992e+05 1.437991e+05 1.331389e+05 1.290563e+05 4.252020e+05 6.011261e+04 8.159585e+04 1.423265e+05 1.209569e+05 1.114134e+05 1.032787e+05 2.086649e+05 C8 H24 N9 O3 P_1.957 1.693882e+04 1.826569e+05 1.623350e+05 1.285944e+05 1.439752e+04 1.144587e+05 1.871274e+05 1.456403e+05 21350.98 5.940772e+04 1.086215e+05 1.554392e+05 33456.17 1.201990e+05 1.849002e+05 1.546652e+05 2.591533e+04 1.542608e+05 1.786108e+05 1.409754e+05 4.972071e+04 1.040560e+05 1.496241e+05 2.149489e+05 27862.072 1.171741e+05 8.068578e+04 1.512745e+05 2.775070e+04 1.741201e+05 1.058268e+05 1.654622e+05 43769.01 1.807795e+05 1.761716e+05 7.884443e+04 3.422911e+04 1.446544e+05 1.877982e+05 2.030088e+05 2.642554e+04 7.232126e+04 1.668254e+05 1.696491e+05 1.045403e+04 1.979890e+05 9.024187e+04 6.579410e+04 6.924142e+04 1.041602e+05 4.911549e+04 1.060820e+05 8.242432e+04 1.596328e+05 2.909759e+05 1.851530e+05 1.984304e+05 7.036629e+04 9.556888e+04 1.749527e+05 1.991057e+05 2.392831e+05 8.317999e+04 1.352428e+05 8.849846e+04 8.826139e+05 7.080319e+04 1.019005e+05 1.550327e+05 2.387466e+05 7.938190e+04 1.169697e+05 6.865582e+04 9.466487e+04 7.230166e+05 1.973854e+05 3.855417e+05 3.257309e+05 4.824624e+04 6.735509e+05 3.416686e+05 1.682102e+05 3.671076e+05 5.745424e+05 3.143134e+05 4.777920e+05 4.843425e+05 1.817832e+05 6.993281e+05 6.080212e+05 3.459929e+05 4.734161e+05 7.511422e+04 1.295428e+05 5.288468e+04 1.091872e+05 1.338808e+05 4.853654e+04 8.273618e+04 1.298420e+05 1.155641e+05 1.113227e+05 6.707927e+04 1.200816e+05 8.167284e+04 1.027260e+05 1.528929e+05 1.244875e+05 1.132488e+05 6.561326e+04 2.038378e+05 7.480733e+04 6.609451e+04 4.702759e+04 6.711267e+04 3.990460e+04 9.373863e+04 6.422014e+04 1.136141e+05 1.483714e+05 4.368502e+04 6.120096e+04 9.744184e+04 1.149314e+05 4.942624e+04 5.371592e+04 1.595431e+05 8.833288e+04 9.140511e+04 9.624762e+04 1.123304e+05 5.063938e+04 1.408125e+05 2.180042e+05 1.312744e+05 2.121293e+05 1.108979e+05 1.339200e+05 1.526061e+05 2.913938e+05 5.152762e+04 1.345942e+05 1.498597e+05 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2.364649e+05 7.347070e+04 1.083085e+05 1.292466e+05 8.364960e+04 9.260146e+04 6.422694e+04 5.365616e+04 2.185985e+05 5.481007e+04 8.595271e+04 1.393267e+05 1.567292e+05 6.954423e+04 9.449114e+04 6.793478e+04 1.739220e+05 8.033364e+04 1.252598e+05 8.932058e+04 7.927800e+05 5.579780e+04 1.725262e+05 2.456669e+05 1.083457e+05 1.055151e+05 7.890027e+04 7.481547e+04 1.865766e+05 1.679503e+05 1.697820e+05 3.416613e+05 1.522671e+05 1.327296e+05 2.236468e+05 2.102705e+05 2.220224e+05 2.151449e+05 1.129913e+05 6.605681e+04 8.455850e+04 1.447651e+05 C9 H30 N9 O P_1.957 1.814953e+04 1.678995e+06 1.336345e+06 2.034138e+06 1.513639e+04 1.203983e+06 1.422480e+06 1.881741e+06 19016.36 1.316180e+06 1.441680e+06 1.827363e+06 18888.09 1.335647e+06 1.638301e+06 1.687684e+06 2.312458e+04 1.524697e+06 1.344228e+06 1.490463e+06 4.711251e+04 1.651950e+06 1.584593e+06 1.620454e+06 27173.201 1.534416e+06 1.278289e+06 1.594021e+06 2.391753e+04 1.727097e+06 1.870433e+06 1.632672e+06 37024.18 1.384146e+06 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7.165737e+05 7.057338e+05 5.906667e+05 2.929226e+04 4.116128e+05 7.275922e+05 6.127550e+05 28844.69 6.181306e+05 7.080221e+05 7.089128e+05 26442.23 5.836143e+05 5.966471e+05 5.441743e+05 3.157966e+04 6.329829e+05 7.036732e+05 5.090020e+05 5.630437e+04 6.471672e+05 5.777502e+05 7.302433e+05 28229.890 7.472239e+05 5.375443e+05 5.116558e+05 2.558933e+04 6.978966e+05 7.168699e+05 6.461080e+05 40732.82 7.012167e+05 4.893615e+05 5.492987e+05 3.879130e+04 6.434253e+05 6.815480e+05 6.461413e+05 3.418734e+04 5.633179e+05 7.453051e+05 6.984215e+05 1.309343e+04 5.033121e+05 6.968978e+05 5.815653e+05 3.107501e+05 1.933997e+06 1.046180e+05 1.237374e+06 2.016076e+05 1.605528e+05 2.059152e+06 1.921258e+05 2.437461e+06 4.830554e+06 8.085737e+05 1.274668e+06 1.236160e+05 2.049862e+06 9.346865e+05 1.935110e+06 7.527185e+04 5.610832e+05 4.073681e+05 3.444541e+05 1.800971e+06 2.306575e+05 1.814388e+05 2.323605e+06 1.618711e+06 2.244556e+05 9.135843e+05 5.660109e+05 4.958927e+05 1.175085e+06 4.113900e+06 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3.943481e+06 1.087196e+05 1.222624e+06 1.525981e+05 1.702049e+05 7.110482e+05 1.001644e+06 2.068261e+05 2.723683e+06 2.229504e+05 1.556749e+06 7.005195e+05 2.082849e+05 7.418800e+04 7.857146e+05 1.991232e+06 1.301073e+05 6.348665e+05 6.935616e+05 8.639487e+04 2.810445e+06 3.320049e+05 1.914867e+06 4.510462e+05 9.134462e+04 1.719725e+06 5.845382e+05 2.036904e+06 8.567149e+05 1.807671e+05 8.997989e+05 9.081588e+04 5.832405e+05 2.756234e+06 1.051292e+06 9.136076e+04 7.597408e+04 2.291855e+05 2.095541e+05 1.018849e+05 1.397185e+06 5.286799e+05 4.673612e+05 1.564421e+06 1.338697e+06 3.385496e+05 8.099501e+04 1.920472e+05 2.771456e+05 9.926428e+04 1.570704e+06 3.656234e+05 1.223622e+05 2.443889e+05 7.884822e+05 8.171324e+04 1.970351e+05 9.445437e+05 6.161864e+04 1.030116e+05 9.548699e+05 1.462812e+06 1.069458e+05 1.953062e+06 1.841552e+06 1.081348e+05 1.508624e+05 1.327377e+05 1.334707e+05 2.736451e+05 8.259497e+04 1.428358e+06 1.218823e+05 8.906162e+05 9.105232e+04 8.585182e+04 1.221466e+05 1.317182e+05 1.886713e+06 9.702881e+04 9.182536e+04 1.533330e+05 1.540250e+05 8.765535e+05 2.862601e+05 1.586445e+06 3.218888e+05 2.866368e+05 9.015833e+04 6.145974e+05 7.180342e+05 1.312689e+06 4.746212e+05 1.521126e+06 8.460234e+04 1.100038e+06 8.364500e+04 1.006567e+05 2.145664e+06 1.064554e+05 9.790069e+05 5.085773e+05 1.205168e+06 8.142600e+04 2.102431e+06 1.590356e+06 C18 H39 N O10_1.958 4.235466e+04 2.508900e+05 3.800509e+05 2.449202e+05 3.162287e+04 1.635015e+05 2.829041e+05 2.255003e+05 39110.87 1.663744e+05 2.196531e+05 3.246834e+05 44551.53 2.583199e+05 2.243043e+05 3.054863e+05 6.470016e+04 2.807222e+05 2.226348e+05 2.099485e+05 5.045377e+04 2.721069e+05 2.614485e+05 2.873729e+05 29956.048 2.542135e+05 2.374241e+05 2.378669e+05 3.021648e+04 2.553716e+05 2.395074e+05 3.326793e+05 47519.29 2.230752e+05 2.212267e+05 2.564864e+05 4.237824e+04 2.324511e+05 2.606425e+05 2.636605e+05 3.717445e+04 2.507124e+05 2.762399e+05 2.624074e+05 1.482478e+04 2.541845e+05 2.457980e+05 2.447472e+05 1.742290e+05 9.702559e+04 8.777003e+04 7.375054e+04 1.246613e+05 7.888018e+04 1.285375e+05 1.009819e+05 3.344542e+05 1.218383e+05 1.381385e+05 1.586490e+05 1.970400e+05 6.985808e+04 1.423264e+05 1.113685e+05 1.275026e+05 8.188063e+05 1.438719e+05 1.268740e+05 2.087554e+05 1.143619e+05 1.778259e+05 8.925609e+04 4.468448e+05 8.945202e+04 5.120818e+05 1.391038e+05 4.239538e+05 7.570651e+05 1.192190e+05 7.950807e+05 1.983242e+05 1.431758e+05 2.373815e+05 2.247138e+05 1.237984e+05 7.400366e+05 4.132295e+05 1.388986e+05 3.718011e+05 4.998389e+05 2.045330e+05 7.451408e+05 1.113822e+05 1.386239e+05 7.672970e+05 8.480666e+04 2.172115e+05 6.919489e+04 9.897332e+04 1.091269e+05 1.012807e+05 1.146677e+05 8.195676e+04 2.025725e+05 1.366692e+05 8.227311e+04 7.927219e+04 1.748305e+05 7.068639e+04 2.507674e+05 1.667777e+05 1.159200e+05 1.042529e+05 6.675581e+04 1.483384e+05 1.081720e+05 7.658343e+06 7.201843e+04 1.231616e+05 2.677319e+05 6.240465e+04 8.169731e+04 7.594586e+04 1.290511e+05 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1.274194e+06 1.021935e+06 1.508783e+06 1.375095e+06 1.624923e+06 7.593357e+05 2.502729e+06 1.902233e+06 1.686662e+06 1.590739e+06 1.253165e+06 1.599828e+06 1.458951e+06 1.952569e+06 7.384284e+06 2.524189e+06 2.283410e+06 1.403750e+06 2.332726e+06 1.434568e+06 7.403676e+05 1.555675e+06 1.729415e+06 2.823794e+06 1.994861e+06 1.523335e+06 1.939584e+06 1.485653e+06 1.956704e+06 3.173142e+06 2.224808e+06 2.005283e+06 2.322509e+06 2.119142e+06 2.536990e+06 2.181009e+06 1.716862e+06 1.252259e+06 3.892100e+06 1.958999e+06 2.583114e+06 2.699475e+06 1.536975e+06 1.703534e+06 2.677387e+06 1.858619e+06 2.365381e+06 3.314651e+06 2.012673e+06 1.568087e+06 1.948579e+06 1.505361e+06 4.567706e+06 1.090813e+06 1.152924e+06 1.484697e+06 1.010158e+06 2.008701e+06 2.131782e+06 2.421465e+06 C12 H26 O6_1.958 1.419422e+05 1.577839e+07 1.372565e+07 1.486198e+07 2.910962e+05 1.121909e+07 1.429539e+07 1.616519e+07 357341.42 1.137591e+07 1.603739e+07 1.562012e+07 383334.39 1.264614e+07 1.299501e+07 1.453556e+07 3.061059e+06 1.384888e+07 1.444366e+07 1.387097e+07 1.811528e+05 1.312574e+07 1.424420e+07 1.480223e+07 102547.879 1.529247e+07 1.234474e+07 1.385899e+07 9.649031e+04 1.457805e+07 1.474191e+07 1.464712e+07 152533.92 1.427989e+07 1.331226e+07 1.251123e+07 1.486664e+05 1.404380e+07 1.417221e+07 1.365369e+07 1.671366e+05 1.440974e+07 1.562037e+07 1.649566e+07 3.071887e+05 1.176136e+07 1.513295e+07 1.237487e+07 1.405713e+07 1.377588e+07 4.905907e+06 8.890408e+06 6.830784e+06 1.185562e+07 8.433217e+06 9.699914e+06 1.095913e+07 1.103706e+07 1.010205e+07 1.577710e+07 1.727600e+07 1.228146e+07 1.388755e+07 1.437560e+07 1.513898e+07 2.050217e+07 1.687053e+07 1.488707e+07 1.420174e+07 1.376089e+07 1.784736e+07 1.671659e+07 1.832300e+07 1.860817e+07 1.384426e+07 1.500662e+07 1.645695e+07 1.497102e+07 1.763041e+06 1.409664e+07 1.240898e+07 1.384062e+07 1.294080e+07 1.248357e+07 1.323001e+07 1.723959e+07 1.008321e+07 8.997319e+06 1.575232e+07 1.498808e+07 1.869762e+07 1.485992e+07 1.478960e+07 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9.648905e+05 1.420622e+06 5.940901e+05 1.545940e+06 1.101150e+06 5.417410e+05 6.868247e+05 1.149834e+06 1.333706e+06 1.529368e+06 1.760939e+06 1.934796e+06 1.521494e+06 1.660355e+06 1.652754e+06 1.142516e+06 9.630078e+05 1.110441e+06 2.004663e+06 1.877427e+06 2.183095e+06 1.006309e+06 1.175209e+06 1.165728e+06 5.462171e+05 5.872081e+05 1.044912e+06 6.920723e+05 7.057288e+05 6.613916e+05 6.383887e+05 6.923143e+05 6.591039e+05 7.019806e+05 7.863426e+05 8.464247e+05 1.354192e+06 8.548509e+05 1.370109e+06 1.539976e+06 1.744433e+06 1.393657e+06 3.300785e+06 4.725377e+05 9.718008e+05 3.108484e+06 8.805616e+05 7.593264e+05 9.458978e+05 1.053042e+06 2.151979e+06 7.864405e+05 1.968274e+06 1.417002e+06 9.814784e+05 1.105468e+06 3.382953e+06 5.826814e+05 2.263986e+06 2.402704e+06 6.495099e+05 2.889232e+06 3.193205e+06 3.405162e+06 8.058417e+05 6.853491e+05 7.699746e+05 8.690360e+05 7.341470e+05 2.590433e+06 1.650517e+06 7.275600e+05 7.784225e+05 8.345691e+05 7.528787e+05 1.057389e+06 7.983984e+05 1.082428e+06 3.312583e+06 1.451309e+06 1.223902e+06 1.029964e+06 1.483409e+06 8.157819e+05 4.758037e+05 8.632003e+05 1.300654e+06 1.997609e+06 1.273703e+06 1.130501e+06 1.530948e+06 8.181817e+05 1.251597e+06 2.141782e+06 1.241965e+06 1.068605e+06 1.191477e+06 1.341034e+06 1.229973e+06 1.118059e+06 9.060667e+05 7.033370e+05 1.849797e+06 1.185908e+06 1.495830e+06 1.679188e+06 1.128797e+06 1.047199e+06 1.435993e+06 9.622891e+05 1.432400e+06 1.982659e+06 1.181751e+06 9.758936e+05 1.118946e+06 7.854242e+05 2.525035e+06 6.207391e+05 6.554946e+05 9.612439e+05 5.342307e+05 1.321726e+06 1.319025e+06 1.148255e+06 C6 H24 N9 P_1.959 2.440286e+04 6.847286e+05 5.958907e+05 7.346529e+05 2.069568e+04 3.919070e+05 5.964952e+05 6.115797e+05 30489.27 4.745123e+05 5.748927e+05 7.303298e+05 31812.53 5.258059e+05 6.099889e+05 6.179838e+05 7.950332e+04 6.098990e+05 5.632504e+05 5.791682e+05 5.297998e+04 6.233100e+05 5.928865e+05 5.044299e+05 29467.320 7.422991e+05 4.657492e+05 6.961284e+05 2.633396e+04 5.802064e+05 6.155674e+05 6.329005e+05 40241.46 5.914057e+05 5.027475e+05 6.092965e+05 3.474509e+04 5.113630e+05 6.901461e+05 5.261653e+05 2.996996e+04 5.741269e+05 7.042034e+05 6.361313e+05 2.128627e+04 6.371897e+05 5.091309e+05 5.643400e+05 5.833510e+05 8.374619e+05 3.824453e+05 4.394921e+05 2.938743e+05 5.339364e+05 3.693318e+05 3.941075e+05 4.173041e+05 3.404275e+05 3.905260e+05 1.162020e+06 7.309803e+05 5.281051e+05 6.041989e+05 6.665329e+05 8.768336e+05 1.285783e+06 6.471198e+05 7.014795e+05 6.225559e+05 7.527165e+05 5.620043e+05 7.678230e+05 5.676713e+05 9.260150e+05 8.686790e+05 5.340216e+05 6.431390e+05 6.212404e+05 5.770081e+04 8.339773e+05 5.666322e+05 6.043864e+05 1.276457e+06 6.081257e+05 7.654465e+05 8.193648e+05 4.295948e+05 4.353877e+05 8.705165e+05 9.353949e+05 1.230073e+06 6.122066e+05 6.888843e+05 6.518635e+05 8.280814e+05 6.101732e+05 1.215418e+06 3.999928e+05 4.901488e+05 6.016233e+05 6.809680e+05 7.318079e+05 3.971983e+05 6.725981e+05 1.308141e+06 1.143955e+06 8.554470e+05 1.154551e+06 5.205033e+05 4.353197e+05 7.737344e+05 1.400068e+06 5.064626e+05 4.867558e+05 2.877115e+05 5.388415e+05 1.159568e+05 4.891396e+05 5.570548e+05 9.049933e+05 4.096895e+05 5.344524e+05 6.106385e+05 4.664697e+05 6.564128e+05 4.989825e+05 1.397712e+06 3.725889e+05 4.352021e+05 4.668614e+05 6.590676e+05 5.017116e+04 1.502719e+05 5.290425e+05 6.693229e+05 7.894849e+05 9.088935e+05 7.540861e+05 6.851280e+05 8.288410e+05 2.402053e+05 6.983695e+05 6.297180e+05 3.207546e+05 4.309501e+05 7.418158e+05 9.392201e+05 9.017243e+05 7.890226e+05 2.167277e+06 1.142124e+06 2.163483e+06 9.866057e+05 7.425819e+05 4.037695e+05 5.671230e+05 1.440943e+06 1.401359e+06 2.011692e+06 5.195153e+05 1.311857e+06 8.517651e+05 2.999124e+05 3.515916e+05 6.346110e+05 4.300121e+05 3.834376e+05 5.037626e+05 7.112583e+05 5.112042e+05 3.280244e+05 3.817107e+05 8.240842e+05 6.275631e+05 9.038645e+05 4.885090e+05 5.585603e+05 8.601595e+05 1.180984e+06 4.233005e+05 1.404593e+06 2.915534e+05 5.407159e+05 1.535450e+06 1.365923e+05 2.762351e+05 4.997848e+05 7.210859e+05 1.416116e+06 5.379022e+05 2.365753e+06 4.452618e+05 3.463538e+05 5.851282e+05 1.679217e+06 2.673253e+05 1.642589e+06 1.473351e+06 5.056860e+05 1.831542e+06 2.377716e+06 1.097894e+06 5.902042e+05 4.814505e+05 4.562367e+05 2.073892e+05 3.680387e+05 2.863721e+05 8.308792e+05 5.282735e+05 5.096870e+05 5.404792e+05 4.866863e+05 7.556921e+05 3.048662e+05 5.485914e+05 1.146681e+06 1.028044e+06 4.389467e+05 3.658457e+05 8.778837e+05 3.330688e+05 1.795588e+05 6.038858e+05 3.735315e+05 8.736311e+05 8.213697e+05 5.740961e+05 4.225941e+05 4.349750e+05 3.659326e+05 1.016012e+06 5.686078e+05 3.580663e+05 9.428583e+05 7.782530e+05 8.203123e+05 4.326332e+05 7.811813e+05 3.598313e+05 5.632330e+05 6.158050e+05 7.413133e+05 1.164685e+06 7.987985e+05 8.707836e+05 1.157918e+06 1.081202e+06 9.003929e+05 1.230300e+06 8.091268e+05 6.671469e+05 7.873985e+05 3.407483e+05 1.628271e+06 2.370763e+05 3.190717e+05 5.659309e+05 3.196032e+05 6.232389e+05 1.271260e+06 6.143087e+05 C8 H26 N9 O3 P_1.959 3.866632e+04 6.260358e+05 5.569054e+05 6.470891e+05 3.060499e+04 3.788894e+05 5.840264e+05 7.381213e+05 28392.25 3.519910e+05 5.952397e+05 6.831497e+05 28213.24 5.258248e+05 4.902961e+05 6.255233e+05 1.419017e+05 5.602473e+05 5.253776e+05 4.841723e+05 4.681124e+04 5.303813e+05 5.637560e+05 6.959746e+05 24846.384 6.261955e+05 4.933781e+05 5.389315e+05 2.498112e+04 4.816096e+05 6.593549e+05 5.573860e+05 41256.78 6.062035e+05 5.307563e+05 4.412443e+05 3.896488e+04 5.644884e+05 5.300521e+05 5.922434e+05 3.387690e+04 5.856574e+05 7.595070e+05 5.084961e+05 1.800574e+04 4.528302e+05 5.810191e+05 5.522258e+05 3.183310e+05 5.275223e+05 6.560639e+04 2.693064e+05 1.677622e+05 5.044754e+05 1.679873e+05 2.673330e+05 3.762761e+05 3.518325e+05 1.513888e+05 3.535602e+05 3.037919e+05 2.430160e+05 1.379869e+05 2.723364e+05 1.642601e+05 2.445062e+06 2.354969e+05 2.005034e+05 3.570413e+05 1.515759e+05 1.412731e+05 2.118760e+05 1.762171e+05 2.172920e+05 1.490341e+06 3.862154e+05 1.367978e+06 9.597291e+05 5.540218e+04 2.057297e+06 6.559951e+05 4.533510e+05 8.867466e+05 6.761121e+05 5.663028e+05 2.394885e+06 1.208429e+06 3.654545e+05 1.225785e+06 1.169843e+06 6.459032e+05 1.722677e+06 2.549660e+05 1.386355e+05 2.509278e+05 2.670168e+05 2.585622e+05 1.171755e+05 9.895887e+04 2.263282e+05 9.723210e+04 2.118349e+05 1.532820e+05 1.798403e+05 1.319767e+05 2.056496e+05 1.264623e+05 2.038964e+05 2.879558e+05 1.864762e+05 6.443028e+05 2.758303e+05 2.326737e+05 1.241896e+05 1.132173e+05 1.006982e+05 3.302844e+05 2.438322e+05 2.055522e+05 2.991683e+05 7.330483e+04 7.189969e+04 1.080959e+05 1.987743e+05 9.189331e+04 2.378611e+05 4.413457e+05 7.211930e+04 1.976440e+05 9.970951e+04 3.612497e+05 1.525397e+05 3.509851e+05 5.107098e+05 2.151318e+05 2.496618e+05 5.071539e+05 2.003259e+05 2.789771e+05 4.121295e+05 1.698290e+05 3.498204e+05 2.935687e+05 3.754803e+05 1.811549e+05 2.412365e+05 3.842756e+05 1.618466e+05 1.644915e+05 7.178076e+05 4.255663e+05 9.903719e+05 6.757513e+05 2.240634e+05 1.332919e+05 1.846890e+05 2.765047e+05 3.592713e+05 2.866196e+05 2.370237e+05 1.867194e+05 2.076229e+05 2.086207e+05 5.241591e+05 1.285082e+06 6.221472e+05 1.943251e+05 5.733543e+05 4.505036e+05 5.003848e+05 9.181731e+05 4.233703e+05 3.872567e+05 3.920160e+05 7.147365e+05 6.025392e+05 1.414037e+05 1.850829e+05 2.591520e+05 1.741105e+05 6.456210e+05 1.276835e+06 3.792838e+05 1.689092e+06 1.842785e+05 4.256378e+05 8.080817e+05 2.877289e+05 6.668650e+05 7.293700e+05 2.379336e+06 5.271881e+05 4.169305e+05 1.859753e+05 1.510217e+06 3.471806e+05 1.035158e+06 2.066430e+06 1.198700e+06 2.729245e+06 1.269928e+06 2.295082e+06 2.952457e+05 9.109366e+05 1.323677e+06 5.143809e+05 5.314926e+05 2.637602e+05 1.720192e+06 8.140380e+05 2.380100e+05 3.158417e+05 1.014847e+06 1.064803e+06 1.726988e+05 8.963056e+05 4.966028e+06 7.240999e+05 4.655326e+05 6.173297e+05 1.046426e+06 7.396513e+05 1.375073e+05 4.887452e+05 3.824618e+05 6.463800e+05 8.170262e+04 2.912813e+05 4.289886e+05 1.961684e+05 1.401457e+05 1.088578e+06 6.441878e+05 1.359876e+05 4.030670e+05 7.689166e+05 1.126456e+06 3.015962e+05 2.987538e+05 4.106540e+05 5.951810e+06 5.168427e+05 3.950163e+05 7.346151e+05 6.654521e+05 7.095259e+05 3.630194e+05 2.877111e+05 7.587603e+05 7.089224e+05 7.180017e+05 6.277690e+05 3.101542e+05 4.828769e+05 1.220524e+06 5.257521e+05 1.324814e+06 4.454048e+05 5.404563e+05 1.734551e+05 4.609704e+05 4.447032e+05 C7 H5 N O3_1.959 6.900445e+04 1.740225e+05 2.334709e+05 1.538159e+05 5.276744e+04 2.300449e+05 2.261432e+05 1.879526e+05 45509.49 1.750163e+05 2.236681e+05 2.375085e+05 37925.35 1.530620e+05 1.907154e+05 1.699391e+05 4.290664e+04 1.768510e+05 1.148743e+05 2.184662e+05 8.412160e+04 1.291827e+05 2.392542e+05 1.409762e+05 54754.919 1.892717e+05 1.525395e+05 1.838768e+05 4.758491e+04 2.318207e+05 2.412523e+05 1.964419e+05 70472.21 1.683279e+05 1.905793e+05 1.260201e+05 6.673535e+04 2.019398e+05 1.974107e+05 1.352424e+05 7.359771e+04 1.341927e+05 1.306411e+05 2.312377e+05 2.359040e+04 1.062765e+05 2.502069e+05 1.844055e+05 1.738063e+05 1.134355e+05 7.153354e+05 1.476247e+05 1.453045e+05 3.922797e+05 1.231625e+05 1.782909e+05 2.359312e+05 2.248621e+05 1.978519e+05 1.625576e+05 2.677711e+05 1.084599e+05 3.403585e+05 9.473705e+05 1.390487e+05 5.466196e+05 3.459363e+05 1.475321e+05 1.417689e+05 1.737170e+05 2.482434e+05 1.772950e+05 1.484755e+05 2.356981e+05 1.268474e+05 1.431443e+05 1.144877e+05 1.391335e+05 7.882031e+04 4.801306e+05 1.404508e+05 1.389780e+05 2.175242e+05 4.659589e+05 1.773943e+05 1.168369e+05 1.173285e+05 1.005631e+05 1.526176e+05 2.108729e+05 1.595273e+05 2.409297e+05 2.685168e+05 1.140395e+05 1.279787e+05 1.117256e+05 1.596300e+05 1.497751e+05 1.143838e+05 1.719988e+05 3.108881e+05 1.581988e+05 1.319153e+05 3.008593e+05 1.310350e+05 1.222008e+05 1.216466e+05 5.429946e+05 1.213796e+05 1.828205e+05 2.344733e+05 6.683640e+06 1.142385e+06 1.172296e+05 1.102771e+05 2.144577e+05 1.732319e+05 1.241170e+05 1.139915e+05 2.145935e+05 1.659224e+05 3.458134e+05 1.065193e+05 1.170462e+05 1.974026e+05 1.462298e+05 1.410588e+05 9.129292e+04 1.196064e+05 1.193830e+05 4.325933e+05 9.374335e+04 9.312563e+04 3.379151e+05 1.510594e+05 2.841173e+05 3.016432e+05 3.550939e+05 1.399013e+05 1.449884e+05 1.126130e+05 1.789943e+05 1.321643e+05 1.180861e+05 1.153463e+05 1.974540e+05 1.630797e+05 2.988537e+05 1.176223e+05 1.908793e+05 1.624124e+05 8.066895e+05 3.932220e+05 3.524577e+05 1.099673e+05 3.810700e+05 3.683069e+05 1.338984e+05 2.485048e+05 1.070883e+05 1.127210e+05 3.513700e+05 1.462785e+05 2.960784e+05 1.227731e+05 1.116073e+05 1.371904e+05 1.156458e+05 2.846502e+05 2.575881e+05 1.116628e+05 2.153996e+05 1.140786e+05 1.469069e+05 1.221596e+05 1.105642e+05 1.754326e+05 2.646082e+05 4.713025e+05 3.183941e+05 1.700236e+05 9.767155e+04 2.562045e+05 1.962012e+05 1.398631e+05 1.511015e+05 4.325878e+05 1.006198e+05 1.393959e+05 4.357571e+05 1.463825e+05 1.382371e+05 1.280983e+05 3.159141e+05 1.850202e+05 1.213662e+05 1.946164e+05 1.525867e+05 1.732632e+05 1.398412e+05 2.184756e+05 1.724332e+05 1.414707e+05 2.328945e+05 4.101103e+05 1.361179e+05 4.625810e+05 2.184991e+05 2.434670e+05 1.379400e+05 4.119459e+05 2.164011e+05 1.669618e+05 2.668137e+05 9.346022e+04 2.573753e+05 1.986655e+05 2.175119e+05 1.457071e+05 2.009711e+05 4.589478e+05 1.263384e+05 4.156932e+05 1.225708e+05 1.814474e+05 1.570132e+05 1.954913e+05 1.328537e+05 3.989335e+05 1.559201e+05 2.654148e+05 1.602948e+05 1.274663e+05 2.801219e+05 1.608138e+05 6.261218e+05 2.952178e+05 1.430171e+05 4.998169e+05 1.666856e+05 1.923767e+05 1.313963e+05 2.111419e+05 2.361229e+05 1.262849e+05 1.264058e+05 1.420474e+05 3.662864e+05 2.004979e+05 1.467091e+05 1.339764e+05 1.145648e+05 1.236402e+05 1.630469e+05 1.872179e+05 1.232913e+05 1.237004e+05 1.216578e+05 9.043877e+04 1.473034e+05 1.377096e+05 1.677797e+05 C8 H8 N3 O16 P3 S_1.959 3.268099e+04 1.883806e+06 1.580047e+06 1.412160e+06 2.629040e+04 1.356780e+06 1.567766e+06 1.898770e+06 26758.97 1.354551e+06 1.554172e+06 1.885588e+06 35015.20 1.407041e+06 1.598934e+06 1.669244e+06 2.872098e+04 1.514925e+06 1.445577e+06 1.489012e+06 5.472186e+04 1.479745e+06 1.683792e+06 1.504322e+06 28293.541 1.846682e+06 1.499453e+06 1.452851e+06 2.483235e+04 1.725995e+06 1.436684e+06 1.680388e+06 37249.23 1.749173e+06 1.498866e+06 1.334655e+06 3.519416e+04 1.687800e+06 1.761798e+06 1.300868e+06 3.452628e+04 1.652741e+06 1.570878e+06 1.976928e+06 1.400219e+04 1.276096e+06 1.781558e+06 1.399366e+06 1.581028e+06 1.166839e+06 5.046408e+05 1.641304e+06 1.149387e+06 1.200271e+06 4.608034e+05 1.002656e+06 9.426184e+05 5.111132e+05 9.403183e+05 1.088431e+06 9.778896e+05 6.416160e+05 1.280808e+06 4.975376e+05 1.400736e+06 9.015899e+05 1.023150e+06 3.591269e+05 7.826561e+05 1.189399e+06 1.230427e+06 4.825680e+05 1.272498e+06 1.344849e+06 7.876817e+05 9.198391e+05 9.797996e+05 6.603267e+05 1.927225e+05 9.176546e+05 5.725663e+05 1.017864e+06 5.920202e+05 6.939195e+05 4.334855e+05 6.774367e+05 5.316600e+05 1.066799e+05 5.331962e+05 3.463116e+05 1.102675e+06 1.168399e+06 1.211920e+06 4.046143e+05 6.262027e+05 1.025297e+06 1.441133e+06 1.072101e+06 1.983851e+06 9.654095e+05 3.261835e+05 1.415367e+06 1.029549e+06 1.557091e+06 5.380440e+05 6.021471e+05 5.885982e+05 4.576280e+05 3.259298e+05 3.785203e+05 8.986463e+05 2.574297e+05 5.484882e+05 1.207725e+06 1.685831e+06 4.369713e+05 4.814307e+05 1.537802e+06 4.054232e+05 3.731934e+05 5.035311e+05 4.558561e+05 5.481694e+05 5.549808e+05 4.962608e+05 3.568194e+05 5.193982e+05 4.852380e+05 5.590695e+05 1.075256e+06 5.528236e+05 2.549015e+05 4.366575e+05 4.520572e+05 5.258262e+05 7.672917e+05 4.278733e+05 7.291517e+05 7.037686e+05 5.366521e+05 4.084967e+05 6.200650e+05 8.546518e+05 3.155712e+05 6.243633e+05 5.319937e+05 1.014444e+06 7.049744e+05 5.480591e+05 4.503761e+05 3.658955e+05 4.625255e+05 3.736960e+05 4.324309e+05 5.163523e+05 4.041980e+05 3.539327e+05 2.820988e+05 5.002606e+05 3.572363e+05 1.982678e+05 3.801244e+05 9.469380e+05 1.663547e+06 1.948714e+06 1.225575e+06 1.236453e+06 1.895966e+06 7.667379e+05 1.463856e+06 1.188387e+06 1.375455e+06 1.072484e+06 1.142593e+06 1.395416e+06 1.247119e+06 6.803096e+05 1.002905e+06 4.063507e+05 1.864671e+06 1.580622e+06 2.187640e+06 1.984875e+06 5.329269e+05 4.889170e+06 4.284950e+06 2.053039e+06 2.574495e+06 1.739739e+05 2.358548e+06 7.041572e+04 5.325703e+06 3.162013e+06 3.155611e+06 2.429458e+06 2.580171e+06 5.162216e+05 9.317822e+05 1.214143e+06 9.477685e+04 8.899407e+04 5.013061e+05 1.874891e+06 2.294221e+06 2.428903e+06 4.533303e+06 4.077171e+06 1.338979e+06 2.821086e+06 3.481086e+06 3.209260e+06 2.793544e+06 8.406093e+05 3.180801e+06 5.026488e+06 3.340348e+06 2.370334e+05 1.359995e+06 6.076723e+06 3.734245e+06 3.100014e+06 3.750172e+06 1.444701e+06 1.558347e+06 5.240810e+06 2.752336e+06 1.915943e+06 4.253070e+06 2.307488e+06 2.712401e+06 3.572180e+06 4.137604e+06 2.557370e+06 3.791573e+06 2.039096e+06 3.424703e+06 2.992449e+06 2.705784e+06 1.125368e+06 8.685763e+05 1.160158e+06 2.662361e+06 2.966289e+06 1.912814e+06 2.705299e+06 3.367306e+06 1.721502e+06 7.446129e+05 8.990421e+05 2.599335e+06 2.448719e+06 6.758982e+05 2.227036e+06 6.657634e+05 1.383008e+06 8.877362e+05 4.778398e+05 3.903650e+05 8.795101e+05 4.143159e+06 1.684908e+06 2.024323e+06 C9 H30 N9 O2 P_1.959 4.303410e+04 8.242651e+06 7.676705e+06 7.374827e+06 5.745046e+04 2.579778e+06 7.355652e+06 7.846206e+06 57950.49 5.988133e+06 7.336561e+06 7.423108e+06 202909.35 6.055194e+06 6.465467e+06 6.641343e+06 9.092810e+05 6.773389e+06 6.753256e+06 6.384353e+06 4.773860e+04 6.638616e+06 6.663013e+06 7.915245e+06 26399.326 7.125321e+06 5.578967e+06 6.594244e+06 6.226955e+04 6.736120e+06 7.046023e+06 7.441869e+06 38499.25 6.879610e+06 5.947936e+06 6.246715e+06 3.589099e+04 6.875912e+06 7.345447e+06 5.645690e+06 3.365874e+04 7.092298e+06 8.019054e+06 7.274546e+06 2.214826e+04 5.607286e+06 6.601274e+06 6.871958e+06 6.535402e+06 7.356835e+06 2.486209e+06 5.053669e+06 3.516056e+06 5.252302e+06 4.443273e+06 9.848884e+05 5.520876e+06 5.386123e+06 5.362925e+06 7.785651e+06 7.185188e+06 5.782052e+06 6.326674e+06 6.594346e+06 6.549037e+06 7.903637e+06 7.683437e+06 6.614171e+06 6.832203e+06 6.015678e+06 8.889232e+06 7.949447e+06 7.944800e+06 8.854216e+06 6.747410e+06 6.526498e+06 7.839304e+06 6.961787e+06 5.877622e+05 6.842749e+06 6.154559e+06 5.944683e+06 6.199253e+06 6.320864e+06 5.907725e+06 6.911587e+06 4.599055e+06 3.925532e+06 6.500250e+06 6.092548e+06 8.415735e+06 6.659162e+06 6.893946e+06 6.882285e+06 9.159244e+06 6.244899e+06 8.754909e+06 4.021547e+06 6.083710e+06 5.378158e+06 5.966680e+06 7.832656e+06 3.407385e+06 8.599527e+06 7.043150e+06 6.976024e+06 5.252751e+06 8.578350e+06 4.759660e+06 3.610371e+06 5.236656e+06 1.092308e+07 7.559092e+06 5.298655e+06 5.884832e+06 4.969811e+06 9.129316e+06 5.065446e+06 3.983960e+06 6.769897e+06 4.052230e+06 3.633068e+06 3.053675e+06 5.504734e+06 4.623808e+06 4.562189e+06 1.047912e+07 4.586268e+06 5.048034e+06 6.325169e+06 7.012256e+06 1.092694e+06 5.255734e+06 5.280906e+06 6.255804e+06 7.186057e+06 8.149387e+06 8.016877e+06 6.708449e+06 8.283490e+06 3.137456e+06 9.457770e+06 8.097589e+06 2.553048e+06 4.193140e+06 5.025433e+06 7.141881e+06 6.959399e+06 8.453745e+06 9.846324e+06 9.036276e+06 9.863245e+06 8.393254e+06 5.964151e+06 6.012542e+06 6.331825e+06 1.125353e+07 1.009714e+07 1.282476e+07 6.144603e+06 6.913334e+06 6.985699e+06 3.344607e+06 3.882596e+06 6.971574e+06 4.514708e+06 4.209374e+06 4.647951e+06 4.556541e+06 4.883096e+06 4.839856e+06 4.696085e+06 5.428942e+06 4.991916e+06 9.336062e+06 6.656809e+06 6.197109e+06 7.643235e+06 8.433091e+06 7.461968e+06 1.504495e+07 4.999509e+06 6.170075e+06 1.414096e+07 4.327974e+06 5.292295e+06 6.317401e+06 6.279857e+06 1.313692e+07 5.132715e+06 1.228217e+07 7.302003e+06 4.372365e+06 6.769111e+06 1.845955e+07 3.863926e+06 1.555312e+07 1.221108e+07 4.426982e+06 1.573923e+07 1.887968e+07 1.530409e+07 4.280838e+06 4.713276e+06 6.609377e+06 5.571164e+06 6.037913e+06 3.801533e+06 9.748374e+06 5.367262e+06 5.350548e+06 6.155623e+06 4.751319e+06 7.263559e+06 5.535907e+06 7.138252e+06 1.812353e+07 8.081296e+06 8.321947e+06 5.796420e+06 1.065535e+07 6.039554e+06 3.097643e+06 5.762142e+06 6.519925e+06 1.106598e+07 7.331123e+06 5.961251e+06 6.962156e+06 6.005819e+06 7.005935e+06 1.136047e+07 8.086161e+06 6.414284e+06 8.036702e+06 7.931024e+06 9.072118e+06 1.096728e+06 6.804565e+06 4.738006e+06 8.789074e+06 8.836211e+06 9.010158e+06 1.103047e+07 7.824524e+06 8.939959e+06 1.026307e+07 7.654793e+06 1.013613e+07 1.235184e+07 8.628501e+06 4.841369e+06 8.092890e+06 5.406613e+06 1.749819e+07 2.934534e+06 4.420159e+06 4.187694e+06 3.896246e+06 8.817058e+06 8.521118e+06 8.173884e+06 C9 H N3 O13_1.959 5.638742e+04 1.113108e+06 1.169201e+06 1.174094e+06 3.927526e+04 1.106502e+06 1.232397e+06 1.349643e+06 39894.17 9.406459e+05 1.396992e+06 1.191234e+06 38836.73 1.041469e+06 1.143114e+06 1.140821e+06 3.657468e+04 1.133281e+06 1.156942e+06 1.165198e+06 6.653911e+04 1.205441e+06 1.110727e+06 1.178471e+06 40705.797 1.326056e+06 1.085501e+06 1.073090e+06 3.232997e+04 1.161821e+06 1.125280e+06 1.395415e+06 46550.78 1.145759e+06 1.126448e+06 1.184372e+06 4.251583e+04 1.065171e+06 1.166717e+06 1.145729e+06 3.901416e+04 1.059217e+06 1.220802e+06 1.485276e+06 1.498959e+04 1.034670e+06 1.176458e+06 1.063522e+06 1.071568e+06 9.163350e+05 3.206885e+05 9.897628e+05 9.574910e+05 8.958795e+05 2.534748e+05 7.803492e+05 7.179478e+05 2.911671e+05 8.152095e+05 8.085111e+05 7.922477e+05 4.789905e+05 1.157373e+06 4.259163e+05 9.015108e+05 8.535146e+05 9.087227e+05 3.015193e+05 5.327428e+05 9.507823e+05 9.864066e+05 4.690529e+05 8.678944e+05 1.228065e+06 6.796358e+05 9.040700e+05 6.637494e+05 4.355443e+05 6.758362e+04 7.139180e+05 4.240664e+05 7.383973e+05 4.198324e+05 5.104557e+05 3.568361e+05 4.662560e+05 3.710504e+05 1.105105e+05 5.212195e+05 1.846996e+05 6.654860e+05 7.002901e+05 1.038350e+06 3.296508e+05 4.683515e+05 7.719331e+05 8.509011e+05 7.917360e+05 1.308842e+06 6.115689e+05 2.266568e+05 1.056909e+06 6.472559e+05 1.230328e+06 3.199928e+05 5.365706e+05 4.150768e+05 4.056009e+05 2.661496e+05 3.052272e+05 7.673555e+05 1.945593e+05 3.369111e+05 8.622627e+05 1.284486e+06 3.909179e+05 4.000026e+05 1.205719e+06 3.791623e+05 3.252081e+05 3.723223e+05 3.076903e+05 3.800237e+05 4.671318e+05 3.687871e+05 2.376095e+05 3.633581e+05 2.273341e+05 5.581961e+05 7.551649e+05 4.352893e+05 6.015690e+04 2.732340e+05 3.502033e+05 3.468925e+05 6.287230e+05 3.025743e+05 6.558809e+05 5.097198e+05 3.903309e+05 3.279860e+05 4.697049e+05 5.497144e+05 3.494553e+05 4.744055e+05 4.031638e+05 8.354708e+05 4.471749e+05 4.409858e+05 3.294384e+05 1.485781e+05 4.174700e+05 3.430044e+05 3.808689e+05 3.531047e+05 2.727327e+05 3.237229e+05 1.570561e+05 4.175508e+05 1.955393e+05 1.557205e+05 3.026459e+05 6.653263e+05 1.177366e+06 1.579060e+06 8.059307e+05 1.012732e+06 1.218411e+06 5.538437e+05 1.119540e+06 9.441392e+05 8.775190e+05 8.610579e+05 8.381574e+05 1.060690e+06 8.368328e+05 5.941132e+05 7.174386e+05 2.998888e+05 1.301980e+06 1.178423e+06 1.643347e+06 1.372706e+06 3.998597e+05 3.135377e+06 2.998454e+06 1.282926e+06 1.745086e+06 1.112967e+05 1.622157e+06 1.540920e+05 3.612179e+06 2.329394e+06 2.322304e+06 1.784046e+06 1.770896e+06 3.331017e+05 5.963863e+05 1.023149e+06 1.366491e+05 1.381277e+05 6.207785e+05 1.248439e+06 1.678379e+06 2.560676e+06 3.322514e+06 2.940315e+06 9.406149e+05 1.940724e+06 2.566551e+06 2.540157e+06 2.190019e+06 8.265246e+05 2.323994e+06 3.291943e+06 2.159264e+06 1.934523e+05 9.373374e+05 4.049808e+06 2.385992e+06 2.180766e+06 2.573086e+06 1.385396e+06 1.172525e+06 3.316879e+06 1.982554e+06 1.693419e+06 2.544518e+06 2.302004e+06 1.883367e+06 2.864949e+06 2.743567e+06 2.319377e+06 2.487892e+06 1.393827e+06 1.883628e+06 2.254090e+06 2.089263e+06 9.275096e+05 7.785294e+05 8.707726e+05 1.911484e+06 2.357541e+06 1.415706e+06 1.903278e+06 2.154844e+06 1.300900e+06 5.990342e+05 6.524401e+05 1.925366e+06 1.986527e+06 5.239638e+05 1.606471e+06 5.115655e+05 1.113218e+06 7.065904e+05 3.527315e+05 3.743296e+05 6.826810e+05 3.121897e+06 1.290024e+06 1.631903e+06 C5 H9 N O8 S_1.959 1.050272e+05 5.184791e+06 4.604024e+06 5.271733e+06 8.202848e+04 3.600738e+06 5.204338e+06 5.042575e+06 79523.28 4.658182e+06 5.045130e+06 4.857104e+06 72643.57 4.649991e+06 4.828800e+06 5.021132e+06 6.474294e+04 4.356020e+06 4.736602e+06 4.693116e+06 1.166493e+05 5.169652e+06 4.832082e+06 4.242230e+06 71938.216 5.173404e+06 4.822375e+06 4.998998e+06 5.664404e+04 4.679300e+06 4.714171e+06 4.756698e+06 83902.87 5.086932e+06 4.509899e+06 5.028382e+06 7.482660e+04 4.486207e+06 5.137883e+06 4.520142e+06 7.071410e+04 4.658787e+06 4.866138e+06 5.352756e+06 2.830140e+04 4.508533e+06 5.349921e+06 4.199197e+06 5.353169e+06 7.020393e+06 4.766560e+06 5.735357e+06 4.122858e+06 4.399274e+06 6.799155e+06 5.664464e+06 6.157645e+06 5.925640e+06 5.309480e+06 5.186053e+06 6.177396e+06 5.731677e+06 6.733443e+06 7.474537e+06 5.724669e+06 8.165012e+06 5.970588e+06 8.280176e+06 8.882053e+06 6.734704e+06 5.763133e+06 5.727358e+06 6.486865e+06 7.107250e+06 6.473204e+06 5.131182e+06 6.745697e+06 5.465450e+06 1.210488e+05 6.481108e+06 5.933068e+06 6.405277e+06 1.013808e+07 8.350415e+06 8.191721e+06 6.547172e+06 4.474675e+06 8.943338e+06 7.483295e+06 8.852116e+06 7.703261e+06 5.299709e+06 7.356607e+06 7.067600e+06 9.442875e+06 6.073087e+06 8.061519e+06 3.976100e+06 3.243050e+06 4.934513e+06 6.752981e+06 4.980486e+06 3.294272e+06 5.039786e+06 8.307111e+06 7.305078e+06 7.580524e+06 7.802310e+06 6.806860e+06 7.131771e+06 6.585109e+06 1.200998e+07 6.666038e+06 4.778107e+06 4.232698e+06 6.092909e+06 5.920657e+06 3.714640e+06 6.176273e+06 6.895120e+06 4.664933e+06 5.499460e+06 5.862793e+06 2.057505e+06 5.133981e+06 4.394246e+06 1.040888e+07 6.124165e+06 4.976793e+06 5.660570e+06 5.211522e+06 1.062495e+05 6.347099e+06 4.848071e+06 6.429869e+06 6.483221e+06 6.267496e+06 5.715114e+06 5.123529e+06 8.158585e+06 4.510175e+06 3.580856e+06 6.740822e+06 5.705394e+06 5.345930e+06 5.290507e+06 3.140798e+06 6.053813e+06 3.949562e+06 8.470262e+06 6.994759e+06 1.055598e+07 1.009522e+07 7.677691e+06 7.096675e+06 8.293988e+06 1.224380e+07 1.320855e+07 1.530194e+07 5.757551e+06 8.315804e+06 7.010168e+06 6.559674e+06 4.947212e+06 7.222479e+06 4.655667e+06 4.748660e+06 4.508705e+06 5.633161e+06 5.069720e+06 3.944626e+06 5.377893e+06 5.755189e+06 4.559857e+06 6.946487e+06 5.333910e+06 7.590564e+06 5.315338e+06 9.360877e+06 3.691924e+06 5.642425e+06 1.774232e+06 3.556113e+06 6.418539e+06 5.280470e+05 1.583453e+06 3.179968e+06 3.456006e+06 8.641576e+06 2.328830e+06 9.443401e+06 2.697470e+05 1.534821e+06 3.164121e+06 4.816967e+06 2.336084e+06 6.967568e+06 5.973004e+06 3.467892e+06 1.223766e+07 1.335021e+07 7.673615e+06 7.212167e+06 2.651381e+06 1.817272e+06 9.212339e+05 1.657712e+06 3.341312e+06 4.033322e+06 2.128144e+06 2.318882e+06 2.555706e+06 4.307163e+06 2.151825e+06 1.740080e+06 2.436369e+06 7.814817e+06 5.552615e+06 9.709443e+05 2.088439e+06 3.737389e+06 1.356448e+06 3.213191e+06 4.591931e+06 1.559223e+06 3.592418e+06 3.805811e+06 1.259005e+06 3.409662e+06 1.970229e+06 2.371967e+06 2.127380e+06 1.475716e+06 2.196543e+06 4.051781e+06 2.649362e+06 3.336356e+06 1.524243e+06 4.615255e+06 6.014440e+06 6.159108e+06 5.395462e+06 4.674280e+06 9.077452e+06 4.667343e+06 6.945264e+06 9.377069e+06 1.087907e+07 8.651221e+06 8.303957e+06 4.813747e+06 6.000819e+06 5.946080e+06 6.803155e+06 1.050695e+07 4.468295e+06 8.171765e+06 6.499103e+06 1.991980e+06 1.115384e+06 8.702409e+06 4.560893e+06 C12 H20 N2 O4_1.96 5.603596e+05 2.252615e+05 1.004484e+05 1.606468e+05 3.290433e+04 1.985937e+05 1.846450e+05 2.426934e+05 34754.51 1.146047e+05 1.372316e+05 1.754242e+05 35901.14 1.396088e+05 1.544924e+05 2.023979e+05 2.806003e+04 1.696484e+05 1.755895e+05 1.435170e+05 4.882119e+04 1.509966e+05 1.299167e+05 2.657489e+05 26873.957 1.434709e+05 1.555832e+05 1.432692e+05 2.599948e+04 1.297740e+05 1.756119e+05 2.265954e+05 36768.09 1.401574e+05 1.847379e+05 2.080395e+05 3.432820e+04 1.001228e+05 1.470155e+05 1.708078e+05 2.981800e+04 1.370785e+05 1.857620e+05 2.678952e+05 1.057308e+04 9.978432e+04 1.710128e+05 1.490131e+05 5.795490e+04 4.862400e+05 4.746585e+05 1.270188e+05 9.244160e+04 7.749318e+04 1.592646e+05 5.337018e+04 1.749677e+05 1.259919e+05 1.111936e+05 2.018561e+05 1.785477e+05 4.944353e+04 1.807875e+05 5.701619e+05 8.901638e+04 5.963528e+05 9.347535e+04 6.000935e+04 7.036430e+04 6.796616e+04 1.047844e+05 1.307622e+05 2.017704e+05 1.099766e+05 6.681237e+04 1.225475e+05 4.828537e+05 7.318073e+04 6.190411e+04 6.603032e+04 7.926363e+04 1.343952e+05 7.036433e+05 4.019190e+05 1.216167e+05 2.969630e+05 6.206179e+04 7.648924e+04 4.627553e+05 8.709941e+04 3.788599e+05 9.018633e+04 7.264924e+04 2.811204e+05 3.806951e+05 2.269892e+05 6.713364e+04 8.092027e+04 1.020207e+05 1.547607e+05 3.727974e+05 7.046440e+04 9.035090e+04 1.258682e+05 2.562910e+05 2.256249e+05 8.416157e+04 1.831930e+05 8.658587e+04 1.828066e+05 9.614643e+04 8.302514e+04 7.003028e+04 9.792504e+04 8.830216e+04 7.714489e+04 2.236321e+05 7.146288e+04 1.086327e+05 4.865208e+05 5.931617e+04 7.726518e+05 1.269061e+05 8.216859e+04 7.970030e+04 1.164767e+05 3.972386e+05 1.613374e+05 1.000416e+05 2.023614e+05 2.107736e+05 4.993856e+04 5.636427e+04 6.602675e+04 1.557971e+05 4.015689e+06 2.402440e+05 6.799788e+04 7.125115e+04 1.176565e+05 4.659434e+04 9.610725e+04 1.739739e+05 1.029865e+05 2.212911e+06 6.611291e+04 7.218082e+04 6.965314e+04 1.793116e+05 3.318954e+05 4.268044e+05 7.875220e+04 2.181489e+05 1.194713e+05 1.622940e+05 2.173604e+05 7.996294e+04 1.512891e+05 5.044096e+05 8.208784e+04 3.734637e+05 1.129776e+05 1.550294e+05 4.669956e+04 1.134348e+05 4.453134e+05 4.987714e+05 1.180702e+05 1.299115e+05 1.329760e+05 1.222221e+05 7.244197e+04 5.720803e+04 7.238633e+04 6.381640e+04 1.084092e+05 1.075950e+05 1.637158e+05 1.568615e+05 7.862146e+04 8.153592e+04 7.116942e+05 7.596618e+04 1.047191e+05 8.310769e+04 5.738035e+05 8.297474e+05 3.956095e+05 1.608496e+05 1.706355e+05 7.280635e+04 1.107779e+05 3.048051e+05 1.183173e+05 8.926011e+04 8.300582e+04 8.576596e+04 2.724250e+05 1.551654e+05 1.908035e+05 1.155343e+06 5.987776e+05 1.138519e+05 1.412984e+05 1.251348e+05 2.640890e+05 4.357912e+05 9.427719e+04 1.809035e+05 8.865333e+04 1.187446e+06 1.447656e+05 1.200666e+05 1.317491e+05 5.116098e+04 1.059838e+05 6.884662e+04 8.149853e+04 1.656489e+05 4.566058e+05 2.083969e+05 1.373907e+05 1.404007e+05 6.498106e+04 1.376446e+05 5.581250e+05 1.108481e+05 5.739591e+04 9.147103e+04 1.076323e+05 2.100718e+05 8.571070e+04 1.004014e+05 6.962985e+04 7.504866e+05 1.144314e+06 1.043426e+05 8.381008e+04 1.917545e+06 1.739106e+05 1.257668e+05 1.063663e+05 9.206461e+04 5.992747e+05 1.230786e+05 9.417431e+05 8.930793e+04 4.663415e+05 4.949619e+05 1.462191e+05 2.264841e+05 4.295050e+05 1.716181e+05 8.615659e+04 3.878850e+05 1.774838e+05 4.965890e+05 5.864905e+04 3.822930e+05 1.243833e+05 1.840530e+05 2.747081e+05 C20 H39 N P2_1.96 1.851693e+04 6.965741e+05 6.447184e+05 6.655168e+05 1.539431e+04 9.280210e+05 7.228247e+05 8.652870e+05 19786.37 4.746601e+05 6.807313e+05 8.452978e+05 19754.96 6.725824e+05 7.794247e+05 6.737052e+05 3.358570e+05 7.459878e+05 6.792888e+05 5.838564e+05 4.667614e+04 7.680161e+05 8.241609e+05 8.112426e+05 26750.578 7.239714e+05 5.701585e+05 7.749234e+05 2.527246e+04 6.503492e+05 8.938261e+05 7.188836e+05 37752.35 5.996824e+05 5.674954e+05 9.575553e+05 3.145196e+04 7.696331e+05 6.446964e+05 4.373914e+05 2.775683e+04 5.248913e+05 1.293083e+06 9.543540e+05 1.119374e+04 4.143617e+05 6.373578e+05 6.716143e+05 6.745401e+05 9.369348e+05 1.176001e+05 6.691462e+05 3.453284e+05 4.922767e+05 4.247532e+05 4.207598e+05 6.627365e+05 4.313871e+05 7.743270e+05 1.180542e+06 1.026254e+06 6.082746e+05 7.754347e+05 1.212419e+06 1.036901e+06 1.349919e+06 8.152104e+05 7.878621e+05 9.003722e+05 8.335633e+05 1.003765e+06 1.155434e+06 1.106690e+06 1.149908e+06 9.504229e+05 6.952100e+05 8.976467e+05 6.167373e+05 5.712900e+04 1.152665e+06 5.197563e+05 7.872955e+05 9.517725e+05 7.547907e+05 7.566241e+05 8.490458e+05 8.036929e+05 4.391938e+05 8.605978e+05 8.949220e+05 1.610828e+06 5.328356e+05 1.005175e+06 6.159576e+05 1.461823e+06 8.732252e+05 1.509980e+06 2.140694e+05 6.377109e+05 5.760643e+05 6.168803e+05 1.060264e+06 3.713766e+05 6.990085e+05 1.347723e+06 1.222481e+06 7.296266e+05 1.311074e+06 5.462613e+05 4.241656e+05 5.934720e+05 1.920048e+06 9.943254e+05 6.279558e+05 5.105343e+05 4.625112e+05 5.216674e+05 6.404355e+05 4.803912e+05 1.561457e+06 4.636072e+05 3.806673e+05 3.822137e+05 6.498060e+05 5.101266e+05 4.339469e+05 1.088557e+06 5.234082e+05 4.763748e+05 5.865018e+05 7.709081e+05 1.924564e+05 6.844698e+05 6.133638e+05 8.355028e+05 7.295337e+05 1.291866e+06 1.123306e+06 7.961334e+05 1.216514e+06 2.787903e+05 1.094667e+06 1.036898e+06 3.058035e+05 2.958668e+05 6.967907e+05 8.368724e+05 1.044328e+06 7.138746e+05 2.019665e+06 1.312828e+06 2.597404e+06 1.280519e+06 7.735358e+05 6.344042e+05 6.813616e+05 1.860849e+06 1.831463e+06 2.984405e+06 6.601637e+05 1.401055e+06 1.123871e+06 2.839652e+05 3.074916e+05 1.065862e+06 5.489218e+05 3.778250e+05 5.285328e+05 5.474703e+05 4.534493e+05 3.855738e+05 4.676393e+05 8.553255e+05 4.201115e+05 8.076099e+05 6.433313e+05 1.017326e+06 9.943275e+05 1.307101e+06 8.507911e+05 2.689457e+06 3.674339e+05 5.040433e+05 1.856209e+06 3.102814e+05 4.496960e+05 5.234525e+05 7.348853e+05 2.012014e+06 5.606067e+05 4.012433e+06 4.987421e+05 4.564317e+05 1.102138e+06 3.263530e+06 2.162366e+05 2.511844e+06 2.800773e+06 6.634864e+05 3.364134e+06 2.824184e+06 3.476944e+06 5.236623e+05 3.951890e+05 5.131976e+05 5.591641e+05 4.452497e+05 2.688935e+05 1.364575e+06 7.249222e+05 5.512056e+05 5.886495e+05 5.099480e+05 6.677226e+05 4.397106e+05 6.718159e+05 4.987060e+06 1.127044e+06 6.846569e+05 5.331238e+05 8.585179e+05 4.353570e+05 3.242539e+05 5.294572e+05 6.363759e+05 8.416483e+05 8.872254e+05 5.482403e+05 6.372631e+05 4.592846e+05 6.133077e+05 1.421117e+06 6.994778e+05 5.414286e+05 9.549375e+05 6.934494e+05 8.862364e+05 4.795441e+05 5.326528e+05 4.077414e+05 1.376106e+06 7.490540e+05 1.437365e+06 1.402922e+06 6.737366e+05 9.805453e+05 2.134175e+06 1.295607e+06 1.408454e+06 1.845140e+06 1.090224e+06 5.785497e+05 8.327981e+05 5.671772e+05 2.433441e+06 3.156675e+05 3.290656e+05 5.018878e+05 3.016517e+05 9.361497e+05 1.477615e+06 1.023150e+06 C15 H33 N O9_1.96 5.166386e+04 2.650128e+05 2.736323e+05 2.124415e+05 3.524326e+04 1.288274e+05 2.488762e+05 2.609638e+05 31645.72 2.102326e+05 2.083166e+05 3.709229e+05 65305.59 1.617205e+05 1.920055e+05 2.229237e+05 2.762007e+04 2.587156e+05 9.571609e+04 3.314375e+05 4.890525e+04 2.080393e+05 2.280883e+05 3.399632e+05 33425.403 2.100476e+05 1.709821e+05 1.745609e+05 3.539171e+04 2.086036e+05 2.504162e+05 2.170298e+05 56879.85 3.155787e+05 2.116809e+05 1.832990e+05 5.553010e+04 2.748523e+05 1.514051e+05 4.339713e+05 4.887383e+04 2.489769e+05 2.737653e+05 2.707707e+05 1.804804e+04 1.835409e+05 2.254459e+05 2.254354e+05 1.784020e+05 1.477745e+05 7.818936e+04 1.296286e+05 9.254405e+04 3.004687e+05 5.724533e+04 1.503672e+05 7.932485e+04 7.100370e+04 1.233159e+05 1.577924e+05 1.302145e+05 1.314211e+05 1.261658e+05 2.156437e+05 1.677681e+05 1.607108e+06 7.225677e+04 2.763485e+05 1.026166e+05 1.175589e+05 9.041366e+04 7.465489e+04 1.006302e+05 1.613272e+05 8.390081e+05 1.972454e+05 4.270098e+05 4.005585e+05 5.057858e+04 1.650639e+06 2.216997e+05 1.681916e+05 3.793568e+05 2.305508e+05 2.765473e+05 9.469655e+05 4.526593e+05 1.106646e+05 5.187551e+05 5.274937e+05 2.728703e+05 6.189868e+05 9.576743e+04 7.807855e+04 1.890276e+05 1.019314e+05 1.456675e+05 1.290453e+05 1.281461e+05 1.014872e+05 1.306646e+05 1.553067e+05 7.404736e+04 2.113644e+05 1.371564e+05 2.456056e+05 1.324455e+05 1.710285e+05 7.793046e+04 8.322104e+04 4.037857e+05 1.194311e+05 2.775316e+05 1.153199e+05 1.848786e+05 9.565045e+04 5.574096e+05 1.919886e+05 1.133477e+05 2.177682e+05 8.012239e+04 8.459725e+04 7.343553e+04 1.152810e+05 8.951749e+04 1.291018e+05 1.477641e+05 8.160076e+04 1.288438e+05 2.280986e+05 1.493012e+05 8.868903e+04 1.781583e+05 1.455470e+05 1.198137e+05 1.084465e+05 2.283877e+05 1.590994e+05 1.436950e+05 1.464214e+05 1.297734e+05 9.940344e+04 7.834174e+04 2.066101e+05 2.243323e+05 1.065051e+05 1.938516e+05 1.046304e+05 7.396787e+04 2.068803e+05 2.278445e+05 4.908225e+05 4.084110e+05 1.061466e+05 7.937590e+04 1.325003e+05 1.278749e+05 8.565568e+04 1.887306e+05 1.161382e+05 1.007544e+05 1.716934e+05 6.667411e+04 2.507362e+05 8.399852e+05 2.578688e+05 1.903691e+05 2.934615e+05 2.038814e+05 3.918982e+05 3.952997e+05 1.380728e+05 1.695510e+05 1.409086e+05 2.899311e+05 2.277902e+05 8.906443e+04 2.341903e+05 7.878587e+04 7.986066e+04 2.867616e+05 8.090803e+05 1.254745e+05 7.105334e+05 1.056080e+05 1.301657e+05 2.334038e+05 1.342479e+05 2.319974e+05 3.166826e+05 9.782660e+05 1.982220e+05 1.538993e+05 1.284613e+05 9.503465e+05 1.216858e+05 5.507667e+05 1.162009e+06 5.018619e+05 1.122192e+06 5.045903e+05 9.170141e+05 1.973419e+05 5.333042e+05 4.285165e+05 1.149830e+05 1.600072e+05 8.139743e+04 7.079709e+05 3.437474e+05 1.173257e+05 1.115695e+05 4.457086e+05 9.295326e+05 1.308449e+05 5.772878e+05 2.490638e+06 2.750348e+05 3.577924e+05 3.168524e+05 3.251671e+05 5.350778e+05 1.183412e+05 2.084288e+05 8.367820e+04 1.426969e+05 2.658020e+05 1.315470e+05 1.782237e+05 1.778211e+05 1.735714e+05 4.201399e+05 3.924699e+05 9.001967e+04 1.773616e+05 2.695007e+05 5.347447e+05 1.095461e+05 1.174131e+05 1.223999e+05 3.577369e+06 1.452869e+05 2.547365e+05 2.048962e+05 1.865988e+05 3.235352e+05 9.886719e+04 9.599064e+04 3.135354e+05 2.230371e+05 1.799058e+05 2.795725e+05 8.096019e+04 1.927747e+05 4.905726e+05 1.891553e+05 4.952959e+05 1.531453e+05 1.900589e+05 2.806235e+05 2.055219e+05 1.122260e+05 C11 H21 N6 O3 P_1.96 4.250400e+05 6.510298e+05 4.450045e+05 4.258029e+05 7.567706e+04 3.768222e+05 6.640639e+05 4.699696e+05 65069.45 2.666904e+05 6.515922e+05 7.246880e+05 56612.49 3.696577e+05 5.242216e+05 4.759917e+05 6.033993e+04 4.347461e+05 4.794404e+05 5.194058e+05 1.283651e+05 3.872430e+05 4.961601e+05 5.538377e+05 78260.334 6.007413e+05 4.594565e+05 4.542794e+05 6.231311e+04 4.317185e+05 5.328611e+05 5.133281e+05 87703.46 5.607972e+05 5.688224e+05 4.723104e+05 8.074957e+04 3.200351e+05 5.559251e+05 4.086819e+05 7.135848e+04 5.752364e+05 5.835694e+05 4.700294e+05 2.854437e+04 4.868742e+05 6.011655e+05 3.901735e+05 3.321931e+05 3.118057e+05 3.279144e+05 4.865768e+05 4.083767e+05 2.407047e+05 4.279769e+05 1.026720e+06 1.921594e+05 5.772322e+05 2.713665e+05 4.324731e+05 2.913326e+06 2.523417e+06 5.343187e+05 6.017955e+05 8.339857e+05 5.498241e+05 2.987690e+05 1.903166e+06 4.218598e+05 4.698091e+05 8.699933e+05 1.287408e+06 6.654210e+05 6.382137e+05 3.390232e+05 5.534909e+05 5.696124e+05 6.248415e+05 1.050189e+06 6.911527e+05 3.046471e+05 3.229340e+05 3.810552e+05 3.579754e+05 1.375931e+06 1.947509e+05 3.542511e+05 1.731873e+05 3.262549e+05 7.123004e+05 4.813872e+05 3.582002e+05 1.780579e+05 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8.776366e+05 4.456379e+05 1.929116e+05 4.017743e+05 9.608960e+05 5.761158e+05 4.108694e+05 1.418903e+06 5.639237e+06 3.424398e+06 1.956437e+06 1.690312e+05 1.703421e+05 8.517736e+05 2.157037e+06 C25 H62 N9 O9 P_1.96 3.171593e+04 2.580951e+05 2.260050e+05 2.064738e+05 2.487297e+04 2.323209e+05 3.039079e+05 2.303839e+05 23585.46 2.351679e+05 2.830071e+05 2.414504e+05 26599.77 2.266406e+05 2.219812e+05 2.712435e+05 2.629659e+04 2.291230e+05 2.154316e+05 2.191970e+05 4.676718e+04 2.688577e+05 1.746429e+05 3.674221e+05 23157.206 2.209707e+05 1.832951e+05 2.479827e+05 2.151208e+04 3.490810e+05 1.477290e+05 2.363113e+05 36029.35 2.759657e+05 1.920959e+05 2.514563e+05 3.200660e+04 2.370972e+05 3.206253e+05 2.158168e+05 3.064911e+04 2.134546e+05 2.618617e+05 2.824708e+05 1.226242e+04 1.672401e+05 2.747164e+05 2.377379e+05 1.931251e+05 2.619496e+05 5.473382e+04 3.007277e+05 1.250945e+05 1.194017e+05 1.932152e+05 1.417245e+05 2.266427e+05 3.347666e+05 3.798822e+05 2.837295e+05 4.537644e+05 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2.625140e+05 2.577392e+05 1.078704e+05 4.647789e+05 2.788404e+05 1.060827e+05 1.549002e+05 3.101940e+05 3.270801e+05 2.837400e+05 3.351236e+05 5.334653e+05 4.313756e+05 5.428326e+05 2.882296e+05 3.591817e+05 2.308946e+05 1.983874e+05 4.780214e+05 3.835354e+05 5.608304e+05 3.045830e+05 3.571746e+05 3.183570e+05 2.310455e+05 8.322465e+04 2.272307e+05 1.804818e+05 1.441458e+05 1.118899e+05 1.292928e+05 1.804469e+05 1.380885e+05 1.604419e+05 1.942120e+05 1.417773e+05 2.752525e+05 1.829102e+05 4.649050e+05 5.110091e+05 3.763993e+05 3.277081e+05 1.142352e+06 1.106380e+05 2.163033e+05 7.629120e+05 1.178845e+05 1.413623e+05 1.802546e+05 2.364321e+05 5.417567e+05 1.193388e+05 5.336840e+05 2.183223e+05 2.712077e+05 2.714848e+05 9.795639e+05 1.168651e+05 5.704893e+05 5.060961e+05 1.522730e+05 9.924616e+05 7.449050e+05 8.511608e+05 1.105542e+05 1.773119e+05 2.169298e+05 1.654952e+05 1.752949e+05 1.259833e+05 3.695961e+05 1.019190e+05 2.289783e+05 2.138842e+05 1.667266e+05 2.204332e+05 2.063955e+05 2.331172e+05 1.021521e+06 3.510633e+05 1.978521e+05 1.994599e+05 2.773131e+05 1.548897e+05 6.772504e+04 2.554585e+05 3.325630e+05 3.955679e+05 2.674406e+05 4.256381e+05 3.746433e+05 1.375429e+05 2.958823e+05 6.253072e+05 3.004414e+05 2.690906e+05 3.012412e+05 3.489989e+05 3.857705e+05 2.954598e+05 1.935513e+05 1.080157e+05 6.113190e+05 2.068953e+05 2.727705e+05 4.373812e+05 2.078985e+05 2.118421e+05 3.490514e+05 2.166854e+05 3.246709e+05 5.146000e+05 3.196454e+05 2.402719e+05 3.678454e+05 1.425943e+05 6.003306e+05 1.691826e+05 9.630658e+04 1.611625e+05 7.982289e+04 2.241365e+05 2.988304e+05 3.087559e+05 C28 H6 N5 O8 P3 S_1.96 4.701724e+04 1.077437e+06 1.046682e+06 8.307636e+05 3.709967e+04 9.185867e+05 1.124003e+06 1.033924e+06 34383.82 7.608156e+05 1.048318e+06 1.228875e+06 33726.11 8.289973e+05 1.105214e+06 8.908271e+05 3.079250e+04 9.654101e+05 9.937802e+05 9.424543e+05 5.379472e+04 8.634950e+05 8.815250e+05 1.311908e+06 25755.065 9.601582e+05 9.496741e+05 1.041553e+06 2.231854e+04 8.266514e+05 9.549133e+05 1.208470e+06 32528.56 9.921223e+05 9.160114e+05 8.901756e+05 2.915432e+04 9.030487e+05 1.060558e+06 1.077774e+06 2.534980e+04 7.923897e+05 1.237932e+06 1.178434e+06 9.560137e+03 6.204962e+05 1.056027e+06 9.770898e+05 5.235736e+05 8.118411e+05 1.131781e+06 3.210913e+05 5.832650e+05 1.540434e+06 1.490124e+05 1.686923e+06 2.132984e+06 8.272539e+05 5.834646e+05 5.525912e+05 1.089192e+06 2.345424e+05 6.323488e+06 1.269752e+05 4.680984e+05 5.229866e+04 2.999293e+05 1.387939e+05 1.934573e+05 2.519558e+05 1.030687e+05 7.370338e+04 8.934987e+05 5.800366e+05 6.215145e+05 4.078351e+05 8.583578e+05 9.128535e+05 5.696034e+04 8.305319e+04 2.495281e+05 7.519283e+04 8.662774e+04 3.852849e+05 1.951244e+05 1.625431e+06 7.677679e+04 7.318474e+04 2.188504e+06 2.656726e+05 2.472176e+05 3.151754e+05 1.663040e+05 9.190210e+04 1.820370e+05 2.187004e+05 3.501358e+05 7.461205e+05 8.034054e+04 1.251518e+05 2.857373e+05 7.017359e+05 2.891789e+06 4.325771e+05 9.489247e+05 2.888385e+05 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1.594134e+05 7.035598e+05 7.506901e+06 6.450679e+06 1.133177e+06 1.005082e+06 9.904189e+05 6.280883e+04 7.739782e+05 5.788513e+04 1.520798e+06 2.655786e+05 3.242428e+06 1.020863e+05 4.542241e+05 4.993532e+05 9.881685e+04 4.142228e+05 1.217058e+05 3.886786e+06 2.330322e+06 3.420900e+06 3.698909e+06 9.926359e+05 3.684684e+05 1.058631e+05 1.138433e+06 2.040240e+06 1.404700e+07 1.806790e+06 1.041257e+06 5.964170e+04 2.436731e+05 2.062173e+05 8.542392e+04 7.961695e+05 1.315753e+05 5.560864e+05 7.531960e+05 4.067845e+05 6.328633e+04 2.094211e+06 1.178511e+05 3.905650e+06 5.262883e+06 1.097760e+06 2.754245e+05 3.982983e+06 2.151846e+05 3.179514e+06 5.247842e+05 8.396480e+04 3.310781e+05 1.200586e+06 8.741971e+05 2.012789e+06 4.681178e+05 3.522107e+06 1.140830e+06 1.919452e+06 2.826971e+06 3.383170e+06 4.715255e+06 3.446161e+06 2.140669e+05 3.981309e+06 9.930986e+05 2.238366e+06 2.672711e+05 8.958402e+04 1.139884e+06 1.072561e+06 2.472143e+06 8.143433e+04 6.440059e+04 6.054062e+05 2.112016e+05 8.732327e+05 2.034373e+06 C12 H25 N O9_1.961 1.178348e+05 6.552708e+05 8.098623e+05 7.993744e+05 3.447938e+04 3.204256e+05 2.695979e+05 6.425441e+05 35537.08 5.779200e+05 8.171718e+05 7.208083e+05 30057.37 5.166334e+05 5.344092e+05 7.278797e+05 2.739767e+04 5.969270e+05 5.804227e+05 5.452507e+05 5.184788e+04 5.197239e+05 6.671249e+05 6.505755e+05 30333.812 6.681869e+05 5.376065e+05 5.576027e+05 2.393316e+04 6.831330e+05 6.062924e+05 6.779526e+05 36943.46 5.716496e+05 6.413894e+05 5.977925e+05 3.603892e+04 5.779837e+05 5.877141e+05 4.512401e+05 3.356676e+04 5.910714e+05 8.883616e+05 6.414531e+05 1.297458e+04 5.189620e+05 5.817070e+05 5.997227e+05 1.057861e+05 1.044408e+05 9.864675e+04 5.385895e+05 6.001184e+04 1.434597e+05 1.914650e+05 1.321122e+05 8.990943e+05 1.924745e+05 1.098561e+05 9.122364e+04 1.870890e+05 1.736020e+05 8.703447e+04 1.352369e+05 7.923551e+04 6.144225e+05 8.697337e+04 8.846778e+04 2.222588e+05 6.597019e+04 2.052199e+05 9.353213e+04 2.818505e+07 8.806620e+04 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2.902161e+05 9.104568e+04 1.018284e+05 4.094746e+05 1.556518e+05 2.012325e+05 3.729325e+05 6.616291e+05 1.621792e+05 1.575398e+05 1.337279e+05 5.835436e+05 1.300863e+05 5.076684e+05 3.746031e+05 3.515089e+05 7.986742e+05 1.685079e+06 5.499084e+05 1.608753e+05 4.556373e+05 4.382562e+05 1.699879e+05 3.306715e+05 8.660593e+04 9.385701e+05 3.550695e+05 1.680988e+05 1.904894e+05 4.473796e+05 5.979660e+05 8.463741e+04 5.173113e+05 1.490409e+06 3.121523e+05 3.066326e+05 5.345393e+05 6.210856e+05 3.439977e+05 7.348376e+04 2.540362e+05 2.321425e+05 1.993469e+05 1.170193e+05 1.314930e+05 2.486773e+05 1.423373e+05 1.087911e+05 5.548855e+05 1.343592e+05 7.406276e+04 1.551539e+05 1.471670e+05 3.180757e+05 1.130806e+05 1.935354e+05 1.165637e+05 1.042083e+06 1.514256e+05 1.390364e+05 1.763576e+05 2.555618e+05 1.543893e+05 1.247936e+05 1.039924e+05 2.349632e+06 2.086223e+05 1.793444e+05 2.175840e+05 1.823353e+05 2.060823e+05 2.879912e+05 1.553800e+05 2.045848e+05 2.056804e+05 1.233413e+05 1.434646e+05 1.577835e+05 1.289398e+05 C16 H33 N O11_1.961 9.223660e+04 5.844127e+05 3.774490e+05 5.388467e+05 3.285256e+04 3.060177e+05 4.793872e+05 5.599824e+05 30285.48 2.867987e+05 5.926547e+05 5.043476e+05 26557.46 3.937259e+05 4.918353e+05 4.303600e+05 2.421990e+04 4.488861e+05 4.312118e+05 4.736187e+05 4.379250e+04 4.349275e+05 4.278415e+05 6.036034e+05 27370.791 4.915428e+05 3.857886e+05 4.042905e+05 2.436930e+04 4.233013e+05 4.801646e+05 5.725326e+05 37217.66 4.690967e+05 4.212872e+05 3.676818e+05 3.435396e+04 4.618849e+05 4.852519e+05 4.674891e+05 2.999916e+04 4.035311e+05 5.799519e+05 5.371632e+05 1.186938e+04 3.637135e+05 4.503194e+05 4.480412e+05 8.649749e+04 6.530847e+04 6.214136e+04 2.643309e+05 6.018538e+04 6.278252e+04 1.468007e+05 8.422081e+04 2.286470e+05 8.388583e+04 8.459337e+04 9.175167e+04 7.010002e+04 7.167300e+04 7.722528e+04 7.065245e+04 6.623283e+04 1.158066e+05 6.390567e+04 6.037346e+04 6.316091e+04 6.199879e+04 1.661211e+05 5.935247e+04 3.331501e+07 7.534843e+04 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6.092379e+05 1.816831e+05 1.012452e+05 1.041950e+05 9.326678e+04 9.902109e+04 8.210315e+04 1.286913e+05 6.182236e+04 5.952139e+04 5.806757e+04 5.029624e+04 6.829674e+04 1.902278e+06 6.800362e+04 9.610115e+04 1.139121e+05 5.536615e+04 8.493677e+04 5.661700e+05 1.320413e+05 7.656749e+04 7.506418e+04 7.383978e+04 1.104054e+05 8.723140e+04 6.455584e+04 6.881447e+04 6.587257e+04 8.031231e+04 1.536805e+05 8.651832e+04 1.752590e+05 7.941990e+04 7.488701e+04 7.531444e+04 1.995032e+05 8.529116e+04 9.319767e+04 1.682469e+05 8.227668e+04 6.763182e+04 7.496802e+04 8.775598e+04 6.232389e+04 2.524204e+05 1.209933e+05 7.595539e+04 1.035790e+05 6.659237e+05 1.390661e+05 6.800267e+04 1.271967e+05 1.187796e+05 7.757863e+04 7.060882e+04 9.590823e+04 6.753617e+04 1.498361e+05 7.464692e+04 6.842302e+04 1.121602e+05 1.043598e+05 5.931526e+04 1.274491e+05 1.224104e+05 1.062053e+05 1.219311e+05 9.255954e+04 1.544163e+05 1.162282e+05 1.136478e+05 8.506837e+04 9.917777e+04 9.251699e+04 1.516245e+05 6.170550e+04 1.170675e+05 8.445511e+04 7.464821e+04 1.243103e+05 8.181534e+04 6.254918e+04 7.885156e+04 6.075414e+04 2.049458e+05 7.102797e+04 7.194443e+04 7.283435e+04 1.227677e+05 8.090419e+04 8.412007e+04 1.235325e+05 7.261134e+04 7.536681e+04 9.675292e+04 1.126684e+05 1.548967e+07 1.241826e+05 8.223929e+04 7.430005e+04 7.102564e+04 1.205094e+05 1.169336e+05 5.254292e+05 1.951681e+05 5.710024e+04 1.019649e+05 7.898957e+04 7.246113e+04 7.408846e+04 C12 H27 N O8_1.962 1.855627e+05 1.220602e+06 1.361925e+06 1.425599e+06 2.930075e+04 7.154664e+05 1.130564e+06 1.183773e+06 51295.09 1.137845e+06 1.281992e+06 1.308168e+06 124914.22 1.199494e+06 1.025773e+06 1.192748e+06 4.667646e+05 1.276435e+06 1.090300e+06 1.148145e+06 5.260225e+04 1.208425e+06 1.168926e+06 1.253620e+06 31366.068 1.250411e+06 9.351752e+05 1.172988e+06 2.393167e+04 1.266020e+06 1.451826e+06 1.145833e+06 37737.33 1.170889e+06 1.020105e+06 1.141986e+06 9.446745e+04 1.193425e+06 1.275645e+06 9.612838e+05 3.809372e+04 1.189867e+06 1.406373e+06 1.336638e+06 2.488416e+04 1.021283e+06 1.153585e+06 1.175519e+06 1.761038e+05 2.208326e+05 9.229986e+04 1.989588e+05 1.076320e+05 2.909662e+05 3.512720e+05 6.649605e+04 4.832546e+06 1.444225e+05 1.211041e+05 1.897938e+05 2.207527e+05 1.627477e+05 1.696646e+05 1.147155e+05 1.127725e+05 9.991137e+05 9.337003e+04 1.268377e+05 2.185076e+05 1.546762e+05 4.660120e+05 8.244294e+04 2.097551e+06 4.685257e+05 4.563177e+05 2.033868e+05 4.586987e+05 5.200475e+06 5.328437e+04 8.128384e+05 2.890721e+05 4.076209e+05 3.154278e+05 2.913607e+05 3.099764e+05 7.765053e+05 1.277364e+06 2.623812e+05 5.980112e+05 2.030088e+06 3.871788e+05 5.195544e+05 1.480041e+05 1.929089e+05 4.784731e+06 1.615704e+05 1.056554e+05 1.573824e+05 3.073604e+05 1.225937e+05 9.161727e+04 2.118949e+05 2.264054e+05 3.032040e+05 1.615325e+05 2.746448e+05 8.545787e+04 2.250568e+05 1.818146e+05 1.566886e+05 1.771538e+05 7.633431e+04 1.031337e+05 2.285123e+05 1.928996e+05 2.061188e+05 6.484272e+07 8.791413e+05 2.461809e+05 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7.466674e+05 4.936550e+05 4.738559e+05 9.689190e+05 5.112232e+06 9.764880e+05 1.117357e+05 4.073841e+05 4.612093e+05 1.706826e+05 2.411480e+05 4.872822e+05 8.097681e+05 2.410213e+05 3.539223e+05 2.461202e+05 4.094592e+05 6.328014e+05 8.857818e+04 4.347533e+05 1.615425e+06 2.769108e+05 1.779098e+05 4.350375e+05 5.457073e+05 3.275374e+05 1.683030e+05 2.940342e+05 3.001904e+05 2.273353e+05 3.724991e+05 3.616474e+05 2.599519e+05 1.789400e+05 3.264667e+05 4.410034e+05 1.906647e+05 3.290070e+05 1.961481e+05 2.237598e+05 4.680515e+05 2.500473e+05 1.797944e+05 1.518988e+05 1.466965e+06 1.705774e+05 1.048939e+05 2.495387e+05 2.390670e+05 2.325090e+05 1.577569e+05 2.857329e+05 1.782245e+06 7.422100e+05 1.669139e+05 1.752368e+05 8.620025e+04 2.393650e+05 3.349994e+05 1.827902e+05 5.010700e+05 9.592874e+04 8.940020e+04 8.917044e+04 1.006832e+05 8.761151e+05 588.78541_1.962 4.463342e+04 1.892895e+06 1.422459e+06 1.308345e+06 3.622013e+04 6.301369e+05 1.723612e+06 1.506816e+06 41568.27 1.085298e+06 1.395117e+06 1.631877e+06 39388.85 1.263172e+06 1.087946e+06 1.591783e+06 3.309685e+04 1.235861e+06 1.654689e+06 1.230953e+06 5.575953e+04 1.273884e+06 1.324594e+06 1.207895e+06 30524.627 1.661319e+06 1.218194e+06 1.449406e+06 2.239123e+04 1.481276e+06 1.362211e+06 1.491835e+06 34070.03 1.418558e+06 1.059955e+06 1.219780e+06 3.007112e+04 1.433850e+06 1.591801e+06 1.426440e+06 2.646456e+04 1.270386e+06 1.379828e+06 1.683132e+06 9.998871e+03 9.965834e+05 1.435754e+06 1.378486e+06 1.792603e+06 5.658413e+05 7.585582e+05 3.034476e+06 2.182110e+06 8.534835e+05 2.105446e+06 2.887470e+06 9.924809e+05 2.916782e+06 1.278722e+06 1.291848e+06 2.459479e+06 2.158747e+06 1.386424e+06 8.793189e+05 3.878043e+06 2.871090e+06 1.781301e+06 2.735284e+06 1.369051e+06 1.149341e+06 3.854952e+06 2.489104e+06 1.594900e+06 3.470062e+06 1.244420e+06 3.945658e+06 1.495072e+06 2.158805e+06 6.365846e+04 2.449016e+06 2.838322e+06 1.981618e+06 8.031592e+05 2.071776e+06 2.440830e+06 1.405640e+06 1.397396e+06 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3.339703e+05 8.547995e+05 6.766582e+05 8.859686e+05 6.794595e+05 6.911927e+05 6.752557e+05 1.110339e+06 6.547972e+05 5.199384e+05 1.176027e+06 1.781358e+06 1.581817e+06 2.005404e+06 1.601045e+06 2.792954e+06 4.750389e+06 4.539785e+05 3.167945e+05 3.416471e+06 1.121912e+06 1.338972e+06 5.170199e+05 8.401571e+05 1.519455e+06 3.569160e+05 3.590767e+05 6.939006e+05 6.523843e+05 9.104569e+05 4.174353e+06 6.617339e+05 5.267183e+05 2.840340e+06 6.344344e+05 1.093568e+06 4.493954e+05 2.667885e+06 2.404962e+05 7.338197e+05 8.834124e+05 8.872118e+05 9.082722e+05 5.249183e+05 4.087325e+05 3.869572e+05 1.027868e+06 3.673542e+05 4.854852e+05 5.763481e+05 1.270148e+06 7.931380e+05 7.070216e+05 7.855203e+05 1.071382e+06 6.785520e+05 3.834581e+05 8.305530e+05 6.775164e+05 6.854753e+05 6.090346e+05 9.441896e+05 6.694263e+05 8.943816e+05 6.656305e+05 9.878924e+05 9.939418e+05 6.739040e+05 7.078441e+05 9.485676e+05 4.416573e+05 7.188608e+05 3.543538e+05 6.493668e+05 7.156723e+05 1.834995e+06 1.847503e+06 1.246973e+06 1.220271e+06 8.550642e+05 1.197755e+06 1.147626e+06 8.893012e+05 5.090892e+05 7.504036e+05 1.394348e+06 1.840754e+06 1.879374e+06 1.490925e+06 1.353423e+06 1.214125e+06 1.824209e+06 1.185299e+06 1.530733e+06 7.962802e+05 1.693766e+06 8.202890e+05 6.543181e+05 C11 H3 N4 O P_1.962 9.101614e+06 1.222655e+07 1.482330e+07 1.793197e+07 4.217099e+04 1.516874e+07 1.985564e+07 1.627370e+07 35561.26 1.408613e+07 1.664383e+07 1.566973e+07 84039.09 1.567925e+07 1.605317e+07 1.625339e+07 1.790499e+05 1.428504e+07 1.609236e+07 1.682095e+07 5.140503e+04 2.465069e+07 1.997848e+06 1.913724e+07 32915.490 1.550684e+07 1.758693e+07 1.764694e+07 2.200387e+04 1.291881e+07 1.456117e+07 1.459413e+07 27058.96 2.092473e+07 1.451814e+07 1.271631e+07 2.252673e+04 1.858905e+07 1.572789e+07 1.431309e+07 2.199767e+04 1.861690e+07 1.356544e+07 1.843074e+07 1.024726e+04 1.670741e+07 1.530209e+07 1.409204e+07 1.561578e+07 2.447475e+07 1.121400e+07 1.670645e+07 1.256516e+07 1.373996e+07 2.191569e+07 1.859804e+07 2.526333e+07 2.426198e+07 1.310660e+07 2.059161e+07 1.778692e+07 2.048307e+07 2.038103e+07 2.309560e+07 1.566341e+07 2.550719e+07 2.220261e+07 2.357085e+07 2.618229e+07 2.696583e+07 1.555558e+07 2.207994e+07 2.191475e+07 2.823824e+07 2.679834e+07 2.022090e+07 2.412098e+07 2.521914e+07 1.853250e+05 1.824933e+07 1.794634e+07 1.886911e+07 2.562262e+06 2.230550e+07 2.593499e+07 2.189487e+07 1.338840e+07 2.925999e+07 3.655785e+07 3.883397e+07 2.171219e+07 1.698110e+07 2.807610e+07 2.236222e+07 2.861288e+07 2.104922e+07 2.498438e+07 1.180291e+07 1.051753e+07 1.658876e+07 2.061853e+07 1.546008e+07 1.701417e+07 1.489852e+07 2.708373e+07 2.542615e+07 2.188539e+07 2.691290e+07 2.881799e+07 2.150824e+07 1.912124e+07 4.928423e+07 2.726245e+07 1.366781e+07 1.284871e+07 2.413566e+07 3.023868e+07 1.269261e+06 1.817399e+07 1.982333e+07 1.530530e+07 1.444690e+06 1.736497e+07 8.461722e+06 1.895303e+07 1.431748e+07 3.195510e+07 1.645013e+07 1.543222e+07 1.585331e+07 2.115884e+07 3.217142e+04 1.717670e+07 1.657988e+07 2.167781e+07 2.294321e+07 1.941964e+07 2.355494e+07 2.147955e+07 3.578035e+07 1.327238e+07 1.647590e+07 2.206201e+07 2.725068e+07 2.146293e+07 1.527082e+07 1.010203e+07 1.833419e+07 1.494309e+07 2.379022e+07 2.172653e+07 3.488182e+07 4.153147e+07 2.423402e+07 2.959187e+07 2.904581e+07 3.665940e+07 4.083649e+07 5.819096e+07 1.761049e+07 2.479460e+07 2.034041e+07 2.298321e+07 1.493551e+07 1.922030e+07 1.649871e+07 1.376216e+07 1.463679e+07 1.707077e+07 1.511644e+07 1.229947e+07 2.505221e+07 1.751773e+07 1.970356e+07 2.558899e+07 1.462316e+07 2.269124e+07 1.734148e+07 3.162347e+07 1.121502e+07 1.446905e+07 1.727667e+07 1.214361e+07 1.850367e+07 9.009283e+06 3.956826e+06 1.035091e+07 1.168886e+07 2.906497e+07 6.408709e+06 3.296216e+07 3.176761e+06 4.242160e+06 9.201868e+06 1.375044e+07 7.839653e+06 5.600694e+06 2.963345e+07 1.283967e+07 4.421750e+07 3.891898e+07 3.155907e+07 2.037066e+07 8.997314e+06 7.648184e+06 3.333226e+06 6.507185e+06 1.448790e+07 2.145497e+07 6.363232e+06 6.955965e+06 1.165802e+07 1.960198e+07 6.923107e+06 1.038620e+07 6.824890e+06 2.892441e+07 1.653722e+07 3.271474e+06 9.097313e+06 1.104764e+07 4.386584e+06 1.316357e+07 1.365082e+07 5.556081e+06 1.541624e+06 1.117098e+07 1.528599e+06 1.079481e+07 7.952032e+06 1.129992e+07 9.739687e+06 6.274965e+06 7.749718e+06 1.861698e+07 8.736879e+06 1.034770e+07 8.969414e+06 1.486589e+07 2.172621e+07 2.826966e+07 1.615295e+07 1.825551e+07 3.295657e+07 1.918031e+07 1.851856e+07 3.483508e+07 2.973240e+07 2.922882e+07 2.222306e+07 1.256956e+07 1.962997e+07 1.786259e+07 2.095665e+07 3.576336e+07 1.550190e+07 2.540194e+07 1.814248e+07 5.124314e+06 6.468755e+06 2.752598e+07 1.829897e+07 C26 H64 N9 O9 P_1.962 3.783344e+04 2.110337e+05 1.658206e+05 1.567903e+05 2.934537e+04 1.686619e+05 2.825392e+05 2.065153e+05 29466.83 1.161565e+05 2.077264e+05 2.637228e+05 29921.63 1.672824e+05 2.801413e+05 1.178798e+05 3.060264e+04 1.756610e+05 1.909628e+05 1.994822e+05 4.860916e+04 1.664046e+05 1.964911e+05 2.915809e+05 27431.490 1.805432e+05 1.116199e+05 1.929176e+05 2.446477e+04 2.047868e+05 1.860830e+05 2.038570e+05 39819.93 2.124285e+05 2.639624e+05 1.013899e+05 3.723061e+04 2.019355e+05 2.266629e+05 2.004613e+05 3.155301e+04 1.634879e+05 2.372965e+05 2.173850e+05 1.221731e+04 1.150228e+05 2.434979e+05 1.602186e+05 1.935993e+05 1.187780e+05 1.444814e+05 1.815763e+05 1.201064e+05 1.355849e+05 1.159569e+05 2.129340e+05 2.487016e+05 2.138680e+05 2.435110e+05 2.824004e+05 3.232676e+05 2.079457e+05 3.453779e+05 2.769396e+05 3.636898e+05 1.113909e+05 2.922711e+05 2.554435e+05 2.741093e+05 1.745417e+05 2.873153e+05 1.878510e+05 4.742438e+05 3.628291e+05 1.965978e+05 1.348306e+05 2.563667e+05 1.616147e+05 3.555134e+05 1.105583e+05 1.295573e+05 1.864049e+05 1.528460e+05 1.751591e+05 1.960686e+05 1.871064e+05 2.645592e+05 2.046152e+05 1.506429e+05 1.107435e+05 2.878133e+05 1.937287e+05 1.563462e+05 1.910704e+05 2.892678e+05 2.159188e+05 3.512541e+05 5.920732e+04 2.050202e+05 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1.436571e+05 5.630377e+05 1.167091e+05 8.656279e+04 1.608931e+05 1.328138e+05 1.739034e+05 1.911067e+05 2.517194e+05 C29 H68 N5 O6 P3_1.962 4.285781e+04 4.676671e+05 3.117958e+05 3.312454e+05 3.288016e+04 2.226615e+05 4.276749e+05 3.625728e+05 29606.61 2.743787e+05 4.836543e+05 3.848171e+05 27754.71 2.541379e+05 3.761509e+05 3.661458e+05 2.781688e+04 3.604622e+05 3.498669e+05 2.872870e+05 5.510464e+04 2.558926e+05 3.794548e+05 4.308129e+05 32163.071 4.740606e+05 2.318446e+05 2.734615e+05 2.868938e+04 4.530031e+05 3.733143e+05 3.480053e+05 46271.15 2.699456e+05 4.108907e+05 2.924649e+05 3.965011e+04 4.013984e+05 3.269820e+05 4.146489e+05 3.473703e+04 3.162345e+05 3.481950e+05 3.838414e+05 1.283736e+04 3.265128e+05 3.608851e+05 3.468195e+05 2.871953e+05 3.050219e+05 2.038079e+05 1.776707e+05 8.410563e+04 3.513834e+05 1.463014e+05 2.411025e+05 1.032513e+05 2.959522e+05 2.099202e+05 4.701817e+05 3.886116e+05 2.394829e+05 1.829685e+05 2.777743e+05 2.176975e+05 2.787187e+05 5.213111e+05 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1.569259e+05 1.738912e+05 1.512895e+05 1.654641e+05 2.188333e+05 2.728664e+05 1.745980e+05 3.537937e+05 2.079197e+05 5.470193e+05 3.913317e+05 5.217415e+05 5.696333e+05 4.996174e+05 5.529957e+05 3.599663e+05 4.155320e+05 3.410350e+05 3.188107e+05 2.589755e+05 6.408008e+05 2.608538e+05 2.005085e+05 3.310795e+05 4.083354e+05 3.677803e+05 2.754983e+05 3.093172e+05 4.129624e+05 3.705143e+05 4.107947e+05 3.506202e+05 3.020481e+05 2.420139e+05 2.319123e+05 1.340516e+05 7.864276e+05 3.395451e+05 3.010085e+05 6.090285e+05 3.631730e+05 4.783142e+05 4.744389e+05 3.508157e+05 4.355919e+05 2.807854e+05 4.003410e+05 2.015731e+05 2.505885e+05 4.072431e+05 8.413301e+05 2.987479e+05 3.397129e+05 6.740255e+05 3.666316e+05 5.478017e+05 3.696592e+05 7.512943e+05 3.553543e+05 2.228685e+05 3.807616e+05 3.239190e+05 3.927630e+05 2.497054e+05 5.445712e+05 2.812883e+05 4.818975e+05 4.310971e+05 2.555562e+05 6.550819e+05 3.224682e+05 5.352511e+05 5.459238e+05 7.103455e+05 5.471658e+05 5.000752e+05 3.467473e+05 2.521498e+05 2.656538e+05 4.028171e+05 6.101370e+05 7.739233e+05 6.014861e+05 5.784484e+05 6.491816e+05 2.855352e+05 6.188465e+05 7.207307e+05 2.680470e+05 4.115603e+05 5.380126e+05 3.062522e+05 3.056551e+05 2.680869e+05 3.905564e+05 2.620753e+05 5.473804e+05 7.106967e+05 9.582524e+05 1.051829e+06 4.056406e+05 4.062161e+05 1.147637e+06 5.740330e+05 7.740220e+05 1.079476e+06 6.590154e+05 1.500280e+05 6.581747e+05 3.620773e+05 2.054559e+06 2.750751e+05 1.572380e+05 1.273239e+05 1.431315e+05 8.342634e+05 6.754927e+05 6.395095e+05 C26 H58 N9 O P3_1.962 3.290492e+04 4.888545e+05 4.072933e+05 3.874896e+05 2.708150e+04 3.328482e+05 3.569303e+05 4.100385e+05 32290.80 3.508617e+05 3.263492e+05 5.531752e+05 28352.66 3.925775e+05 3.596187e+05 4.151481e+05 2.440900e+04 3.429344e+05 4.417029e+05 3.138335e+05 4.204979e+04 4.300366e+05 2.853551e+05 5.881872e+05 24576.395 4.324313e+05 2.833397e+05 3.878991e+05 2.172402e+04 4.208690e+05 3.959574e+05 3.932255e+05 35241.35 4.163985e+05 3.522730e+05 4.149752e+05 3.150630e+04 3.359713e+05 4.524085e+05 4.580072e+05 2.794950e+04 2.891520e+05 4.712697e+05 4.394223e+05 1.050942e+04 2.974490e+05 4.391606e+05 3.757889e+05 3.845118e+05 3.037571e+05 1.384428e+05 3.447739e+05 2.252010e+05 3.201918e+05 2.472630e+05 3.168733e+05 4.959795e+05 5.037919e+05 4.229044e+05 5.448243e+05 6.316044e+05 4.585158e+05 5.487511e+05 4.761349e+05 5.653062e+05 4.430189e+05 5.219981e+05 5.183045e+05 3.990693e+05 3.609958e+05 5.640269e+05 6.298061e+05 6.203649e+05 7.797740e+05 4.156606e+05 3.788148e+05 4.449666e+05 3.388339e+05 8.890735e+04 4.137943e+05 3.623000e+05 2.908590e+05 3.289983e+05 3.643065e+05 2.128533e+05 4.411866e+05 1.006151e+05 1.726518e+05 3.635060e+05 3.076846e+05 7.201315e+05 3.589438e+05 5.277701e+05 5.552748e+05 6.095430e+05 4.412683e+05 5.148673e+05 1.621426e+05 4.153523e+05 4.148111e+05 3.318175e+05 5.057374e+05 5.987504e+04 5.692999e+05 4.496552e+05 4.400695e+05 3.381881e+05 6.613443e+05 2.188226e+05 6.819458e+04 2.540051e+05 7.189518e+05 5.865979e+05 2.073382e+05 2.770094e+05 2.920318e+05 1.466782e+05 2.548528e+05 1.420278e+05 3.968357e+05 1.390783e+05 1.051795e+05 1.223276e+05 2.456531e+05 1.792956e+05 1.468127e+05 5.155394e+05 1.046220e+05 1.961362e+05 2.058978e+05 4.231011e+05 1.133075e+05 3.014711e+05 3.258877e+05 3.597785e+05 3.756191e+05 4.616472e+05 5.070951e+05 3.405220e+05 4.774422e+05 2.361675e+05 5.740434e+05 3.649200e+05 2.205251e+05 2.685785e+05 4.308059e+05 4.765007e+05 5.178137e+05 6.581051e+05 7.115798e+05 6.645715e+05 7.074120e+05 5.059258e+05 4.238004e+05 2.170407e+05 4.271203e+05 9.254637e+05 1.010715e+06 7.235015e+05 4.051718e+05 5.288379e+05 5.764149e+05 1.994060e+05 1.774528e+05 2.514517e+05 2.802711e+05 1.636038e+05 1.979290e+05 1.962175e+05 2.627496e+05 3.067393e+05 2.528645e+05 3.165218e+05 1.732804e+05 3.739780e+05 3.432566e+05 5.446176e+05 5.861095e+05 6.625138e+05 5.498429e+05 1.302418e+06 2.429508e+05 2.425145e+05 1.197614e+06 2.499083e+05 3.941252e+05 5.308550e+05 3.587715e+05 9.490498e+05 2.939095e+05 1.042593e+06 7.013231e+05 3.531441e+05 3.633025e+05 1.290773e+06 3.226513e+05 7.970404e+05 1.049601e+06 1.897016e+05 1.062872e+06 1.218471e+06 1.201923e+06 2.287049e+05 3.325502e+05 3.249138e+05 2.969051e+05 2.934291e+05 3.058399e+05 7.050351e+05 1.799787e+05 2.853867e+05 2.572945e+05 3.048960e+05 3.580638e+05 2.125469e+05 4.595054e+05 1.261978e+06 4.451097e+05 4.806446e+05 2.666440e+05 7.376168e+05 3.389490e+05 1.095170e+05 3.576690e+05 4.247394e+05 1.016944e+06 4.716809e+05 4.118593e+05 5.941082e+05 2.814758e+05 3.387076e+05 6.970761e+05 4.726643e+05 4.712823e+05 4.841140e+05 6.094081e+05 5.091423e+05 5.369114e+05 3.446620e+05 3.080803e+05 6.422292e+05 4.594017e+05 4.618690e+05 7.279606e+05 3.765013e+05 4.383952e+05 6.635048e+05 3.325540e+05 4.627613e+05 7.468508e+05 4.764214e+05 4.820954e+05 4.080715e+05 3.783177e+05 1.218340e+06 1.465966e+05 2.720006e+05 3.355562e+05 1.903742e+05 4.368019e+05 4.887021e+05 4.183853e+05 C H4 N5 O3 P S_1.962 7.343359e+04 1.194734e+07 1.563111e+07 1.758520e+07 4.397257e+04 1.511843e+07 2.041374e+07 1.593690e+07 36999.22 1.585185e+07 1.580232e+07 1.591366e+07 91061.87 1.596280e+07 1.586634e+07 1.660994e+07 2.895095e+04 1.446511e+07 1.637749e+07 1.672717e+07 5.709615e+04 2.492858e+07 1.992241e+06 1.995924e+07 34819.739 1.519644e+07 1.753284e+07 1.875757e+07 2.325806e+04 1.263788e+07 1.466392e+07 1.493868e+07 29154.38 2.104782e+07 1.476815e+07 1.303470e+07 2.463399e+04 1.815603e+07 1.625524e+07 1.386194e+07 2.386738e+04 1.840767e+07 1.499257e+07 1.852297e+07 1.103233e+04 1.683057e+07 1.565784e+07 1.369716e+07 1.582547e+07 2.487529e+07 1.206506e+07 1.699704e+07 1.268600e+07 1.370619e+07 2.227722e+07 1.940123e+07 2.540200e+07 2.459299e+07 1.450463e+07 2.101940e+07 1.776290e+07 1.897949e+07 2.047917e+07 2.363133e+07 1.598132e+07 2.541919e+07 2.251529e+07 2.418173e+07 2.654760e+07 2.656338e+07 1.532786e+07 2.225168e+07 2.243736e+07 2.885651e+07 2.851164e+07 1.991142e+07 2.453941e+07 2.543742e+07 1.885793e+05 1.863340e+07 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2.001232e+05 5.333602e+05 5.301497e+05 2.978552e+05 3.746056e+05 4.099755e+05 8.518035e+05 2.544432e+05 4.921399e+05 1.752882e+05 4.785883e+05 7.574646e+05 1.031556e+05 5.344473e+05 2.397988e+06 4.108319e+05 2.970275e+05 5.709266e+05 7.092224e+05 4.348391e+05 1.951363e+05 3.752167e+05 2.684761e+05 3.310479e+05 4.727629e+05 3.332346e+05 3.836725e+05 1.122054e+05 2.967644e+05 4.823347e+05 3.963753e+05 1.397547e+05 2.693310e+05 4.293639e+05 6.378601e+05 2.742820e+05 2.696248e+05 2.314338e+05 1.636237e+06 1.846715e+05 2.203814e+05 3.552836e+05 3.113496e+05 3.456895e+05 2.182649e+05 3.069351e+05 1.209081e+06 5.515164e+05 3.785087e+05 2.479309e+05 2.236516e+05 2.509190e+05 4.784620e+05 2.429834e+05 4.727926e+05 2.253916e+05 3.053077e+05 1.174261e+05 2.267657e+05 9.214843e+05 C6 H14 O3_1.962 5.032362e+05 2.492167e+06 3.295982e+06 3.125025e+06 1.120999e+05 2.163989e+06 2.728076e+06 2.941248e+06 111865.26 2.409375e+06 3.329952e+06 3.120455e+06 116171.93 2.573435e+06 2.573906e+06 2.732530e+06 1.443523e+05 2.713148e+06 2.962723e+06 2.736428e+06 1.134355e+05 2.261257e+06 3.011062e+06 3.330993e+06 271158.643 2.622448e+06 2.805255e+06 2.540341e+06 3.022148e+05 2.734094e+06 2.536281e+06 3.493240e+06 252948.22 2.643517e+06 2.722385e+06 2.661767e+06 2.372356e+05 2.600637e+06 3.073353e+06 2.799918e+06 1.824734e+05 2.330247e+06 3.040225e+06 3.244597e+06 1.993029e+05 2.661830e+06 2.586646e+06 2.745349e+06 3.130360e+06 3.241002e+06 1.883198e+06 2.708129e+06 1.417557e+06 2.496555e+06 2.193056e+06 2.451567e+06 3.061256e+06 3.840292e+06 3.244159e+06 3.642590e+06 3.493428e+06 3.054066e+06 3.538187e+06 3.642764e+06 3.210733e+06 2.599051e+06 2.360348e+06 2.454741e+06 3.125148e+06 2.651802e+06 3.603279e+06 3.247062e+06 3.509776e+06 3.960496e+06 2.140404e+06 2.274777e+06 2.610648e+06 2.898674e+06 4.137989e+05 2.215707e+06 2.188745e+06 4.809373e+06 2.209068e+06 3.173584e+06 2.150021e+06 2.719779e+06 1.284617e+06 1.865307e+06 2.514472e+06 4.067340e+06 1.330754e+07 2.044803e+06 2.616130e+06 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2.396935e+06 2.501152e+06 C30 H57 N O7 S_1.962 3.068071e+04 8.954988e+05 8.046487e+05 7.483899e+05 2.480890e+04 6.988051e+05 8.003290e+05 7.962028e+05 27822.10 6.767563e+05 7.741682e+05 9.166301e+05 25635.13 8.327264e+05 7.824464e+05 6.998907e+05 2.386777e+04 8.138553e+05 7.443778e+05 7.667430e+05 4.336170e+04 7.306233e+05 7.633474e+05 1.002658e+06 26163.393 8.275827e+05 6.037022e+05 7.930378e+05 2.243711e+04 7.909167e+05 8.079100e+05 9.332510e+05 35905.50 7.676292e+05 6.197501e+05 6.761876e+05 3.292754e+04 8.704987e+05 8.270887e+05 7.830845e+05 2.893130e+04 7.491429e+05 8.898333e+05 8.452875e+05 1.073261e+04 6.383761e+05 8.995184e+05 7.149131e+05 5.965105e+05 6.195619e+05 2.665318e+05 9.295437e+05 4.951904e+05 4.458560e+05 5.211653e+05 5.641432e+05 6.462834e+05 8.929872e+05 8.988830e+05 8.767650e+05 1.316223e+06 8.776895e+05 1.161285e+06 9.854511e+05 1.199866e+06 6.829440e+05 1.321746e+06 1.238971e+06 1.275766e+06 8.845633e+05 1.373214e+06 1.215496e+06 1.232632e+06 1.439638e+06 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7.943063e+05 4.887234e+05 8.255682e+05 1.434229e+06 9.590692e+05 6.810449e+05 9.662042e+05 9.005173e+05 1.044217e+06 1.056865e+06 6.106436e+05 5.246843e+05 1.550519e+06 8.293563e+05 1.054308e+06 1.331879e+06 6.163053e+05 7.094043e+05 1.256071e+06 7.282698e+05 8.484645e+05 1.238856e+06 7.286618e+05 7.046839e+05 8.934127e+05 5.258503e+05 2.137779e+06 3.592819e+05 4.328212e+05 6.170694e+05 3.372087e+05 8.672991e+05 8.641640e+05 8.449594e+05 C29 H57 N5 O9_1.962 3.047621e+04 5.628883e+05 5.245999e+05 4.003221e+05 2.457702e+04 3.630931e+05 4.092651e+05 6.282144e+05 26929.61 3.306758e+05 4.641069e+05 6.629744e+05 25941.22 3.437802e+05 4.726233e+05 4.502645e+05 2.570851e+04 4.424075e+05 4.623923e+05 4.586210e+05 4.773839e+04 3.908014e+05 4.467010e+05 6.202072e+05 26304.126 3.798469e+05 4.299155e+05 4.379828e+05 2.006280e+04 5.593361e+05 4.820277e+05 4.642097e+05 33263.41 4.875177e+05 4.087236e+05 4.292793e+05 3.299898e+04 4.157518e+05 4.414246e+05 5.431329e+05 2.911544e+04 5.020409e+05 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4.006842e+05 1.467719e+05 2.060450e+05 1.526522e+05 3.211960e+05 2.990783e+05 2.153390e+05 6.237011e+05 6.277579e+04 2.050166e+05 1.983693e+05 4.156031e+05 3.847962e+05 3.328019e+05 3.389851e+05 3.588344e+05 4.337724e+05 5.421877e+05 5.377576e+05 5.473046e+05 5.312601e+05 2.225140e+05 7.875290e+05 4.418284e+05 1.799958e+05 1.868832e+05 5.302393e+05 6.440624e+05 5.538514e+05 5.432395e+05 9.400366e+05 6.732095e+05 7.141902e+05 7.920281e+05 4.373426e+05 3.101060e+05 4.447407e+05 1.065083e+06 8.130666e+05 1.035236e+06 4.624767e+05 4.685045e+05 4.893547e+05 1.731011e+05 2.120347e+05 3.656431e+05 2.390075e+05 1.780123e+05 2.548272e+05 1.923655e+05 4.920803e+05 3.103013e+05 2.647765e+05 2.992548e+05 2.820563e+05 4.667988e+05 4.002886e+05 6.827162e+05 7.981738e+05 7.799126e+05 6.397068e+05 1.710939e+06 2.247053e+05 3.863623e+05 1.255074e+06 2.309635e+05 3.423952e+05 3.361102e+05 3.955010e+05 1.197063e+06 1.888846e+05 9.499756e+05 5.403265e+05 3.538383e+05 6.237825e+05 1.660527e+06 2.910415e+05 1.105212e+06 1.106449e+06 2.633758e+05 1.455799e+06 1.323737e+06 1.956423e+06 2.484547e+05 2.965675e+05 3.768964e+05 2.673506e+05 2.391001e+05 2.701612e+05 8.398833e+05 2.407981e+05 3.641719e+05 4.127356e+05 3.013924e+05 4.007450e+05 3.898432e+05 4.280275e+05 1.644493e+06 6.481233e+05 5.218382e+05 4.527450e+05 5.415973e+05 2.675173e+05 1.672576e+05 3.836179e+05 6.059694e+05 7.291677e+05 5.854981e+05 5.850261e+05 5.675623e+05 3.252984e+05 4.580639e+05 8.523239e+05 6.281980e+05 4.817548e+05 4.851173e+05 6.203426e+05 5.480668e+05 5.850591e+05 3.360682e+05 2.754570e+05 9.097850e+05 4.387653e+05 4.891119e+05 4.539220e+05 5.121106e+05 4.429696e+05 5.160865e+05 3.884023e+05 6.752618e+05 8.691428e+05 5.103632e+05 4.189056e+05 4.767295e+05 2.736172e+05 1.161636e+06 1.558437e+05 2.637912e+05 4.277257e+05 2.112781e+05 5.309248e+05 5.250997e+05 4.850402e+05 C10 H20 O7_1.963 2.656771e+05 1.018989e+06 1.187009e+06 1.305095e+06 5.835549e+04 6.174064e+05 8.926937e+05 1.114776e+06 86278.39 8.960153e+05 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2.818350e+06 3.548542e+06 4.085764e+06 3.117808e+06 6.584287e+06 6.845430e+06 6.524480e+06 C6 H12 O2_1.963 1.215785e+06 1.924250e+06 2.213200e+06 2.755092e+06 1.211709e+05 1.625362e+06 2.194018e+06 2.277021e+06 203109.12 1.885506e+06 2.477912e+06 2.213545e+06 107522.51 2.100545e+06 1.960274e+06 2.342673e+06 1.132819e+05 2.099310e+06 2.099753e+06 2.097519e+06 1.661555e+05 1.914412e+06 2.147952e+06 2.596470e+06 150159.403 2.160975e+06 1.957209e+06 2.209586e+06 1.428978e+05 1.896105e+06 2.155317e+06 2.630632e+06 203525.38 1.998151e+06 2.149290e+06 1.983113e+06 1.755158e+05 2.168274e+06 2.105628e+06 2.152551e+06 1.349171e+05 1.729327e+06 2.439719e+06 2.740246e+06 9.663009e+04 1.925636e+06 2.078332e+06 1.999155e+06 1.702304e+06 2.825733e+06 1.464346e+06 3.455787e+06 1.156905e+06 1.624626e+06 1.709919e+06 2.890354e+06 1.203996e+07 4.818368e+06 1.835572e+06 8.569455e+06 3.045414e+06 1.468213e+06 2.639928e+06 2.736621e+06 1.824190e+06 1.710774e+06 1.643717e+06 1.287451e+07 3.181097e+06 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4.062236e+06 4.451377e+06 3.843663e+06 2.820673e+06 6.892271e+06 4.756346e+06 3.416980e+06 5.160276e+06 3.438617e+06 5.277711e+06 3.378202e+06 4.560393e+06 1.450540e+07 6.507494e+06 6.211407e+06 3.796392e+06 7.198112e+06 4.109001e+06 2.245017e+06 4.064755e+06 4.576718e+06 8.852272e+06 4.793894e+06 4.600144e+06 5.025255e+06 3.457514e+06 4.869640e+06 8.264876e+06 5.665982e+06 4.446775e+06 5.327693e+06 5.722292e+06 5.960513e+06 4.769566e+06 4.928496e+06 3.362996e+06 7.338668e+06 5.558070e+06 6.317784e+06 7.155618e+06 4.443966e+06 4.464632e+06 6.964380e+06 4.950540e+06 7.008939e+06 9.070365e+06 5.292533e+06 3.802090e+06 5.515653e+06 4.035398e+06 1.217620e+07 2.357573e+06 3.158030e+06 3.442362e+06 2.748209e+06 5.736463e+06 5.890335e+06 5.851247e+06 C23 H52 N9 P3_1.963 3.240083e+04 3.777099e+05 3.828762e+05 4.344078e+05 2.667595e+04 3.087807e+05 2.840714e+05 3.965937e+05 31913.30 3.060363e+05 3.753003e+05 4.565250e+05 28547.47 3.093750e+05 3.620764e+05 3.845731e+05 2.488205e+04 3.791878e+05 3.187587e+05 3.256000e+05 4.501716e+04 3.612435e+05 3.754224e+05 4.894345e+05 27882.658 3.544998e+05 2.219612e+05 3.457457e+05 2.332691e+04 4.117331e+05 4.079378e+05 4.133274e+05 36535.48 3.617922e+05 2.641924e+05 3.367213e+05 3.391627e+04 3.933046e+05 3.866695e+05 3.165815e+05 2.990574e+04 3.644573e+05 4.638495e+05 4.309484e+05 1.105321e+04 2.199516e+05 3.589617e+05 3.865692e+05 3.357189e+05 3.621355e+05 1.649041e+05 3.748641e+05 1.742346e+05 2.211274e+05 1.453221e+05 2.768755e+05 4.192427e+05 3.676629e+05 4.927591e+05 4.476272e+05 4.526085e+05 3.912997e+05 4.277452e+05 4.343398e+05 5.676012e+05 3.980168e+05 4.927902e+05 4.984479e+05 3.446724e+05 3.456728e+05 5.555468e+05 5.653907e+05 5.174777e+05 6.674585e+05 4.283124e+05 3.079935e+05 5.003499e+05 3.056742e+05 8.438161e+04 3.150342e+05 3.236347e+05 2.727962e+05 3.497989e+05 3.854113e+05 3.119898e+05 2.591862e+05 6.214316e+04 1.774586e+05 3.709897e+05 3.624131e+05 6.396840e+05 4.297275e+05 5.533904e+05 4.453867e+05 4.831789e+05 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3.180639e+05 2.796939e+05 3.290048e+05 3.706796e+05 4.397150e+05 5.470513e+05 4.794319e+05 5.573997e+05 1.082261e+06 1.455895e+05 3.449060e+05 1.019161e+06 2.147170e+05 4.929188e+05 3.368564e+05 3.195225e+05 7.780209e+05 2.924607e+05 7.893565e+05 7.013790e+05 3.903581e+05 3.389214e+05 1.323561e+06 2.030739e+05 7.278240e+05 9.745708e+05 2.695929e+05 1.085628e+06 1.223488e+06 1.362406e+06 2.468631e+05 2.754663e+05 3.799496e+05 2.420860e+05 2.693269e+05 2.159613e+05 6.894359e+05 9.204965e+04 2.849361e+05 3.050190e+05 3.019778e+05 3.733447e+05 1.632968e+05 3.881054e+05 1.317389e+06 4.927504e+05 3.822262e+05 2.681159e+05 6.833666e+05 2.752414e+05 1.566231e+05 3.323309e+05 4.454902e+05 9.219118e+05 5.424502e+05 4.055758e+05 5.068298e+05 3.331330e+05 4.539195e+05 7.331379e+05 5.840800e+05 4.256452e+05 5.446579e+05 5.113830e+05 4.644361e+05 4.915071e+05 3.793750e+05 2.635743e+05 8.042310e+05 4.479354e+05 6.204291e+05 6.561316e+05 4.429393e+05 2.338356e+05 5.153947e+05 3.307425e+05 5.731367e+05 7.462353e+05 5.622907e+05 3.640049e+05 3.868095e+05 3.220546e+05 1.260878e+06 1.463688e+05 3.164266e+05 3.030568e+05 2.194105e+05 5.389596e+05 4.477410e+05 3.595520e+05 C14 H31 N O9_1.963 2.029798e+05 1.863095e+06 1.637465e+06 2.133638e+06 3.201810e+04 8.177034e+05 1.694487e+06 1.743993e+06 49751.99 1.467171e+06 1.844169e+06 1.794117e+06 111874.09 1.528783e+06 1.602770e+06 1.693240e+06 3.700457e+05 1.590530e+06 1.625598e+06 1.529660e+06 4.965322e+04 1.508457e+06 1.787227e+06 1.788951e+06 29409.443 1.812659e+06 1.332460e+06 1.647916e+06 2.354190e+04 1.528828e+06 1.862640e+06 1.917629e+06 35351.26 1.538884e+06 1.386102e+06 1.526552e+06 3.876369e+04 1.547757e+06 1.959386e+06 1.544251e+06 3.008689e+04 1.594883e+06 1.845239e+06 1.800121e+06 2.317414e+04 1.422701e+06 1.500360e+06 1.728108e+06 9.052434e+04 1.784718e+05 5.639831e+04 1.385150e+05 5.707946e+04 9.938018e+04 7.354713e+05 1.110821e+05 3.560125e+06 7.316269e+04 9.847621e+04 1.644228e+05 1.071416e+05 1.194265e+05 8.913570e+04 8.480236e+04 6.424619e+04 5.289784e+05 8.572486e+04 7.995319e+04 1.078829e+05 1.347883e+05 1.674420e+05 6.872912e+04 5.491753e+06 8.403664e+04 3.270528e+05 2.219335e+05 2.812051e+05 7.130540e+06 5.172838e+04 5.344530e+05 1.737233e+05 2.949976e+05 2.428819e+05 1.031700e+05 1.361641e+05 3.432015e+05 1.598103e+06 1.851266e+05 4.084240e+05 1.704589e+06 2.459769e+05 3.917151e+05 1.644274e+05 7.398935e+04 7.692433e+06 1.510155e+05 1.019563e+05 1.189471e+05 7.254205e+04 1.460065e+05 7.741217e+04 2.490849e+05 2.158212e+05 3.241221e+05 1.038654e+05 2.986771e+05 1.215562e+05 2.430782e+05 8.337051e+04 2.259492e+05 7.468989e+04 1.905599e+05 1.567363e+05 1.278302e+05 9.614781e+04 7.319817e+04 1.178368e+08 7.664304e+05 2.958683e+05 9.199807e+04 1.371472e+05 7.445234e+05 1.053867e+05 1.072772e+05 7.390887e+04 1.434289e+05 2.977514e+05 6.027308e+04 7.058684e+04 2.545664e+05 1.243350e+05 4.600992e+04 1.307918e+05 1.298553e+05 8.351921e+04 3.213159e+05 9.965717e+04 2.060275e+06 1.750168e+05 9.536560e+04 4.937172e+04 4.058387e+05 7.170119e+04 1.747664e+05 1.105544e+05 6.184393e+04 1.224649e+05 8.173568e+04 1.367135e+05 1.422692e+05 2.634526e+05 1.507676e+05 3.095243e+05 1.093065e+05 1.331162e+06 3.523795e+05 7.889793e+04 1.735223e+05 7.036503e+05 1.057488e+05 1.265613e+05 2.030541e+05 5.716820e+04 1.984013e+05 8.326330e+06 1.112318e+05 1.704077e+05 6.813735e+05 1.553938e+05 1.421205e+05 2.056965e+06 1.408655e+06 9.832570e+04 1.705242e+05 2.678592e+05 1.168552e+05 1.323866e+05 8.949534e+04 9.762682e+04 1.529344e+05 9.581057e+04 2.557802e+05 1.397021e+05 3.521391e+05 1.182398e+05 1.731651e+05 1.741910e+05 2.308890e+05 1.581874e+05 2.083636e+05 3.629992e+05 1.365037e+05 1.052583e+05 1.624848e+05 5.621892e+05 9.328626e+04 8.810913e+05 2.765746e+05 2.650649e+05 5.031320e+05 4.853953e+06 5.930900e+05 1.271893e+05 2.077572e+05 1.604317e+05 1.022177e+05 1.283250e+05 3.457990e+05 4.022916e+05 8.274044e+04 2.758001e+05 2.058027e+05 1.989072e+05 3.185015e+05 6.228657e+04 2.698592e+05 1.038827e+06 1.395461e+05 2.301849e+05 1.952465e+05 4.911904e+05 1.347774e+05 2.186026e+05 2.402005e+05 1.175503e+05 1.750073e+05 2.739231e+05 2.056596e+05 1.412647e+05 1.617974e+05 2.172053e+05 1.798052e+05 1.264632e+05 1.131687e+05 1.253156e+05 1.203232e+05 2.747108e+05 1.145339e+05 2.691917e+05 1.018248e+05 9.779949e+05 8.782540e+04 9.727903e+04 2.043437e+05 1.003911e+05 1.417263e+05 9.647711e+04 4.484617e+05 4.760498e+06 1.049792e+06 1.423261e+05 1.204644e+05 1.152921e+05 1.299626e+05 2.915455e+05 1.917083e+05 5.468289e+05 9.820850e+04 1.006941e+05 7.874846e+04 9.927072e+04 4.241829e+05 C11 H10 N2 O5 S_1.963 9.347305e+04 7.063902e+06 5.123169e+06 4.492206e+06 5.561752e+04 5.806147e+06 7.338323e+06 6.772306e+06 46774.22 5.367863e+06 6.163254e+06 6.268834e+06 43745.63 6.161147e+06 5.710012e+06 6.720227e+06 3.495120e+04 4.715049e+06 6.103381e+06 4.833541e+06 6.171307e+04 7.367405e+06 6.374641e+06 5.730334e+06 35279.084 5.929326e+06 6.310376e+06 6.552498e+06 2.654033e+04 4.919967e+06 5.560333e+06 5.770556e+06 36108.80 7.952949e+06 4.444637e+06 5.398950e+06 3.227020e+04 7.817943e+06 6.997784e+06 5.910866e+06 3.441295e+04 3.003594e+06 6.257375e+06 7.412751e+06 1.441868e+04 6.642187e+06 6.543411e+06 4.670066e+06 6.447625e+06 9.542479e+06 5.097762e+06 8.005872e+06 4.753390e+06 5.321549e+06 9.559446e+06 8.030566e+06 8.168372e+06 8.608618e+06 5.089650e+06 7.737450e+06 7.438068e+06 8.762015e+06 7.522372e+06 9.674578e+06 7.248725e+06 9.314367e+06 8.447943e+06 9.996634e+06 1.106615e+07 8.825001e+06 6.032314e+06 7.135384e+06 7.886551e+06 8.367181e+06 7.777067e+06 6.787860e+06 9.137264e+06 7.872808e+06 6.756992e+04 8.017318e+06 6.921080e+06 6.947284e+06 1.275824e+07 9.934135e+06 1.007943e+07 7.482884e+06 5.984001e+06 1.145660e+07 1.168011e+07 1.227573e+07 8.197041e+06 6.402181e+06 9.029044e+06 1.001949e+07 1.302859e+07 7.743749e+06 9.749920e+06 4.911918e+06 3.912723e+06 6.588515e+06 8.731166e+06 5.846421e+06 4.534440e+06 5.810494e+06 1.049519e+07 7.493393e+06 9.104185e+06 9.753111e+06 1.008175e+07 8.405987e+06 7.548291e+06 1.665669e+07 9.219637e+06 6.040635e+06 4.470802e+06 9.670015e+06 7.946282e+06 5.049856e+06 7.123123e+06 7.947478e+06 6.596876e+06 5.644172e+06 7.462464e+06 2.029696e+06 7.708535e+06 6.280000e+06 1.458483e+07 7.679146e+06 6.567024e+06 6.876880e+06 6.902357e+06 4.547522e+04 6.023220e+06 5.794003e+06 9.092968e+06 7.899620e+06 7.097352e+06 7.608933e+06 7.270015e+06 1.108611e+07 5.946334e+06 3.389733e+06 8.802811e+06 8.154083e+06 7.319831e+06 6.260950e+06 4.474903e+06 7.017282e+06 3.053087e+06 9.880822e+06 8.954132e+06 1.361023e+07 1.388237e+07 8.686360e+06 1.046359e+07 1.068188e+07 1.342415e+07 1.404648e+07 1.988433e+07 5.936911e+06 1.011909e+07 8.036665e+06 7.649667e+06 5.443385e+06 8.148399e+06 6.823655e+06 6.188054e+06 6.631516e+06 7.679654e+06 6.587444e+06 4.471227e+06 7.401390e+06 7.965054e+06 6.635505e+06 9.555998e+06 6.983794e+06 7.696749e+06 7.800165e+06 1.288984e+07 3.561507e+06 5.906062e+06 1.840725e+06 4.821270e+06 7.224443e+06 8.744617e+05 1.600456e+06 4.319624e+06 4.576072e+06 1.064257e+07 2.500594e+06 1.223559e+07 6.683727e+05 1.757361e+06 3.623054e+06 5.427044e+06 2.724686e+06 7.418315e+06 6.924080e+06 4.457726e+06 1.328066e+07 1.677735e+07 7.949347e+06 8.188059e+06 3.074929e+06 1.949317e+06 1.146601e+06 2.172749e+06 4.492746e+06 5.312660e+06 2.714858e+06 2.503000e+06 3.063181e+06 5.913151e+06 2.448990e+06 2.349952e+06 2.461829e+06 1.106871e+07 8.305800e+06 9.801034e+05 2.805298e+06 4.359241e+06 1.614390e+06 3.879055e+06 5.904536e+06 1.883552e+06 4.287974e+06 5.422670e+06 1.341289e+06 3.987911e+06 2.869631e+06 3.019471e+06 2.636099e+06 1.615537e+06 2.986006e+06 4.869393e+06 2.960071e+06 4.238446e+06 1.730831e+06 6.326680e+06 7.707242e+06 8.785167e+06 5.846746e+06 5.727612e+06 1.187246e+07 6.649118e+06 8.447314e+06 1.183918e+07 1.252195e+07 1.140388e+07 9.320826e+06 4.874249e+06 7.579534e+06 6.496520e+06 8.097131e+06 1.582051e+07 4.672588e+06 9.806906e+06 8.124293e+06 1.392717e+06 1.341978e+06 1.067918e+07 6.213615e+06 C18 H38 O9_1.963 6.683382e+04 3.900460e+06 3.248830e+06 2.954504e+06 5.413859e+04 2.899962e+06 3.293434e+06 3.567179e+06 61693.95 2.807147e+06 3.433577e+06 3.772398e+06 71266.45 2.793432e+06 3.363875e+06 2.985416e+06 1.290670e+05 3.532157e+06 3.338731e+06 3.058247e+06 9.488732e+04 2.930310e+06 3.232753e+06 3.939136e+06 57018.410 3.502476e+06 2.595702e+06 3.431513e+06 4.788342e+04 3.197590e+06 3.351600e+06 3.630709e+06 75721.04 3.121940e+06 3.105988e+06 2.926365e+06 7.075604e+04 3.124225e+06 3.692353e+06 3.235676e+06 6.131069e+04 3.070031e+06 3.582512e+06 3.700091e+06 2.596253e+04 2.687920e+06 3.301710e+06 3.247167e+06 2.983773e+06 3.218854e+06 1.045036e+06 2.975337e+06 1.778796e+06 2.251755e+06 2.201583e+06 2.369730e+06 2.559726e+06 2.973682e+06 3.224702e+06 3.595407e+06 4.247922e+06 3.211560e+06 3.523507e+06 3.704093e+06 3.759585e+06 3.840960e+06 3.858618e+06 3.337857e+06 3.520604e+06 3.242273e+06 4.337594e+06 4.297020e+06 5.013077e+06 5.036489e+06 3.024494e+06 2.827026e+06 3.308653e+06 3.278994e+06 7.816780e+05 3.082927e+06 2.902613e+06 2.607532e+06 2.556802e+06 2.926228e+06 2.435232e+06 3.148738e+06 1.907943e+06 1.439966e+06 2.703225e+06 2.687580e+06 4.715210e+06 3.148543e+06 3.489134e+06 3.194279e+06 4.956643e+06 3.054360e+06 4.383168e+06 1.723757e+06 2.723008e+06 3.144196e+06 2.546141e+06 4.317460e+06 1.339883e+06 3.978997e+06 3.287526e+06 3.274612e+06 2.382603e+06 3.946395e+06 1.756558e+06 1.491558e+06 2.102841e+06 4.886564e+06 3.397637e+06 2.243376e+06 2.116683e+06 2.017767e+06 1.303473e+07 2.465979e+06 1.635841e+06 3.108534e+06 1.450396e+06 1.648872e+06 1.364693e+06 2.404264e+06 1.682276e+06 1.908617e+06 3.693081e+06 2.311153e+06 1.873943e+06 2.455355e+06 3.090749e+06 6.510084e+05 2.511418e+06 2.329806e+06 2.525066e+06 2.977464e+06 3.637284e+06 3.556401e+06 3.148370e+06 3.593444e+06 1.875285e+06 4.176343e+06 3.296322e+06 1.478154e+06 2.107229e+06 3.308437e+06 4.100517e+06 4.057779e+06 4.936299e+06 5.143975e+06 4.807026e+06 4.816929e+06 4.563130e+06 2.816981e+06 2.267979e+06 2.863127e+06 5.654931e+06 5.621787e+06 6.463934e+06 3.265085e+06 3.285107e+06 3.929609e+06 1.522872e+06 1.675016e+06 3.775153e+06 2.186920e+06 1.630807e+06 2.152835e+06 2.071466e+06 2.229350e+06 2.314818e+06 2.210926e+06 2.662670e+06 2.199487e+06 3.578527e+06 3.042869e+06 3.479921e+06 4.013111e+06 5.114467e+06 3.806407e+06 8.627034e+06 2.126698e+06 2.432842e+06 7.399785e+06 2.057735e+06 2.857928e+06 2.895688e+06 2.958130e+06 6.169360e+06 2.511631e+06 5.485322e+06 4.173988e+06 2.544608e+06 3.246777e+06 9.403820e+06 2.034853e+06 6.648042e+06 6.893245e+06 2.007722e+06 7.220210e+06 9.327577e+06 8.895150e+06 1.922746e+06 2.334384e+06 2.796200e+06 2.478499e+06 2.505312e+06 1.715540e+06 4.604922e+06 1.930224e+06 2.168815e+06 2.692869e+06 2.355339e+06 2.971865e+06 2.420489e+06 3.035266e+06 8.673901e+06 3.907282e+06 3.814452e+06 2.687304e+06 4.756850e+06 2.682215e+06 1.292377e+06 2.811464e+06 3.233077e+06 5.527025e+06 3.344017e+06 3.136231e+06 3.190750e+06 2.392952e+06 3.219448e+06 5.786069e+06 3.785836e+06 2.855328e+06 3.169787e+06 3.710755e+06 3.839311e+06 3.672760e+06 3.097179e+06 2.334441e+06 4.678204e+06 3.473482e+06 4.614401e+06 4.331746e+06 3.183099e+06 3.386371e+06 4.237238e+06 2.949744e+06 4.322616e+06 5.658543e+06 3.559970e+06 2.628967e+06 3.464121e+06 2.491259e+06 7.846505e+06 1.767689e+06 2.188252e+06 2.441713e+06 1.771905e+06 3.775954e+06 3.383262e+06 3.808093e+06 Indole-3-carboxilic acid-O-sulphate (3)_1.963 1.373565e+05 2.286541e+07 2.555088e+07 2.614997e+07 1.019104e+05 2.498125e+07 3.066019e+07 2.851975e+07 109213.92 2.385352e+07 2.685872e+07 2.610499e+07 103419.49 2.785001e+07 2.536898e+07 2.745754e+07 6.326245e+04 2.214713e+07 2.582817e+07 2.215588e+07 1.142912e+05 3.400697e+07 2.640795e+07 2.738070e+07 69440.856 2.300594e+07 2.514828e+07 2.980882e+07 5.134701e+04 2.129731e+07 2.452717e+07 2.752342e+07 67006.60 3.153548e+07 2.386664e+07 2.236366e+07 5.854941e+04 2.902751e+07 2.619487e+07 2.264998e+07 5.809831e+04 3.215772e+07 2.279437e+07 2.960946e+07 4.095970e+04 2.612537e+07 2.566072e+07 2.465493e+07 3.003441e+07 3.862516e+07 1.977487e+07 3.194034e+07 1.927523e+07 2.063061e+07 3.436659e+07 2.934506e+07 3.302687e+07 3.679231e+07 2.546608e+07 3.223430e+07 3.073109e+07 3.920308e+07 2.899141e+07 4.309666e+07 3.064239e+07 4.008641e+07 3.651600e+07 3.848992e+07 3.805201e+07 4.231955e+07 2.623521e+07 3.328233e+07 3.840500e+07 4.056937e+07 4.007295e+07 3.178605e+07 4.043849e+07 3.704168e+07 1.262963e+05 3.434848e+07 2.759892e+07 2.753529e+07 5.105260e+07 3.918094e+07 3.627726e+07 3.834922e+07 2.403601e+07 5.258711e+07 5.309098e+07 5.211116e+07 3.840090e+07 2.902202e+07 3.945311e+07 3.947525e+07 5.554121e+07 3.015200e+07 4.568688e+07 1.938249e+07 1.677823e+07 2.500176e+07 3.561953e+07 2.468347e+07 2.151919e+07 2.663631e+07 4.558267e+07 3.641126e+07 3.532485e+07 4.539488e+07 4.798649e+07 3.583595e+07 3.277569e+07 7.517566e+07 3.848405e+07 2.225895e+07 2.146037e+07 4.275998e+07 3.417090e+07 1.907699e+07 3.290673e+07 3.565741e+07 2.751309e+07 2.543500e+07 2.834592e+07 1.006798e+07 3.484967e+07 2.594654e+07 5.236298e+07 3.072051e+07 2.783899e+07 2.803009e+07 2.965572e+07 8.302125e+04 2.721026e+07 2.851404e+07 3.728357e+07 3.033451e+07 3.498891e+07 3.146945e+07 3.003109e+07 4.718638e+07 2.507450e+07 1.795165e+07 3.741051e+07 3.739652e+07 2.933894e+07 2.413469e+07 1.660049e+07 3.115355e+07 1.296776e+07 4.357087e+07 3.676982e+07 5.834905e+07 6.089694e+07 3.750651e+07 4.453012e+07 4.427937e+07 6.462541e+07 6.209569e+07 5.756218e+07 2.891823e+07 4.432469e+07 3.240515e+07 2.835489e+07 2.390018e+07 3.484756e+07 2.560209e+07 2.277436e+07 2.519985e+07 3.278584e+07 2.436575e+07 2.030019e+07 3.567559e+07 2.913612e+07 3.199295e+07 3.983302e+07 2.557633e+07 3.879058e+07 3.159980e+07 4.848929e+07 1.776969e+07 2.613565e+07 8.986583e+06 2.112204e+07 3.410548e+07 3.783789e+06 7.045867e+06 1.794195e+07 2.107147e+07 4.432288e+07 1.264856e+07 4.871575e+07 2.423473e+06 7.769001e+06 1.641744e+07 2.184965e+07 1.258153e+07 4.017460e+07 3.180438e+07 2.124818e+07 6.364860e+07 5.490112e+07 4.285338e+07 3.255991e+07 1.375714e+07 1.100095e+07 5.400363e+06 1.057654e+07 2.251116e+07 2.950334e+07 1.136328e+07 1.287138e+07 1.478521e+07 2.888115e+07 1.194984e+07 1.015090e+07 9.862589e+06 4.695149e+07 3.307084e+07 5.366555e+06 1.273349e+07 1.795202e+07 7.059889e+06 2.010615e+07 2.683964e+07 8.764366e+06 1.824985e+07 2.170201e+07 7.711071e+06 1.696236e+07 1.211162e+07 1.404408e+07 1.168022e+07 7.177092e+06 1.249530e+07 2.128228e+07 1.200095e+07 1.827046e+07 8.231297e+06 2.332927e+07 3.805397e+07 3.976285e+07 2.602798e+07 2.770411e+07 5.441776e+07 3.034650e+07 3.166680e+07 4.751269e+07 5.243218e+07 4.866042e+07 3.523325e+07 2.208521e+07 3.105628e+07 2.742399e+07 3.233905e+07 5.299698e+07 2.172472e+07 4.452812e+07 3.132719e+07 8.669180e+06 5.526431e+06 4.851494e+07 3.137356e+07 974.67109_1.963 3.188823e+04 2.411100e+06 1.994801e+06 2.308036e+06 2.509036e+04 1.147937e+06 1.968533e+06 2.259042e+06 24404.52 1.646283e+06 2.350622e+06 2.364324e+06 22636.66 1.877736e+06 1.852820e+06 1.977002e+06 1.444055e+05 1.934351e+06 1.845282e+06 1.928171e+06 4.267094e+04 2.107203e+06 1.760685e+06 2.319085e+06 26133.925 2.267631e+06 1.773645e+06 2.001520e+06 2.238506e+04 1.899486e+06 2.199788e+06 1.985865e+06 36253.89 2.077566e+06 1.983601e+06 1.605050e+06 3.378102e+04 1.945390e+06 2.124593e+06 2.254193e+06 2.597709e+04 1.776820e+06 2.235259e+06 2.387903e+06 1.229826e+04 1.567132e+06 2.244293e+06 1.726305e+06 1.484706e+06 1.636695e+06 4.702791e+05 1.702773e+06 1.105518e+06 1.282631e+06 1.626894e+06 1.955515e+06 1.772839e+06 2.157649e+06 2.006862e+06 2.183189e+06 3.232981e+06 2.033747e+06 2.313619e+06 2.359972e+06 2.461935e+06 2.297585e+06 2.771787e+06 2.618528e+06 2.456902e+06 2.323851e+06 3.285819e+06 2.710627e+06 3.822679e+06 3.629053e+06 1.818979e+06 1.900690e+06 2.163371e+06 2.038261e+06 1.572426e+06 2.197373e+06 1.780500e+06 1.629733e+06 1.765452e+06 1.993545e+06 1.348994e+06 1.719284e+06 1.137536e+06 8.322650e+05 1.664977e+06 1.547749e+06 2.840127e+06 1.592093e+06 2.458342e+06 1.918184e+06 3.005251e+06 1.739185e+06 2.850679e+06 8.610464e+05 2.032799e+06 1.423483e+06 1.590762e+06 3.070290e+06 7.864319e+05 2.743930e+06 2.234423e+06 2.091786e+06 1.634013e+06 2.503852e+06 1.127194e+06 8.788375e+05 1.141161e+06 3.410511e+06 2.404231e+06 1.385368e+06 1.355378e+06 1.201217e+06 1.563991e+06 1.324431e+06 9.559844e+05 2.030659e+06 9.128834e+05 7.921506e+05 6.637319e+05 1.477489e+06 1.049496e+06 1.018899e+06 2.794419e+06 1.255725e+06 1.119658e+06 1.604771e+06 1.906454e+06 2.260473e+06 1.715806e+06 1.458251e+06 1.576220e+06 1.866427e+06 2.276367e+06 2.087583e+06 1.770709e+06 2.339429e+06 1.093442e+06 3.003923e+06 2.040035e+06 8.815103e+05 1.462909e+06 1.893068e+06 2.412271e+06 2.351773e+06 2.878566e+06 3.179788e+06 2.646210e+06 3.166892e+06 2.818529e+06 1.715692e+06 1.185445e+06 1.507047e+06 3.311093e+06 2.628191e+06 3.283697e+06 1.564120e+06 1.979265e+06 2.000557e+06 8.961483e+05 1.067673e+06 1.918662e+06 9.855298e+05 9.774883e+05 1.380529e+06 1.152446e+06 1.245564e+06 1.062242e+06 1.212152e+06 1.401222e+06 1.029544e+06 2.249665e+06 1.856659e+06 2.611353e+06 2.635889e+06 2.907738e+06 2.866867e+06 6.769543e+06 1.349781e+06 1.316694e+06 5.369027e+06 1.246488e+06 1.333468e+06 1.568238e+06 2.002902e+06 4.450325e+06 1.164789e+06 4.090001e+06 2.136902e+06 1.263407e+06 1.992562e+06 6.657501e+06 9.896437e+05 5.039654e+06 5.450655e+06 9.133768e+05 5.284716e+06 5.805473e+06 6.283421e+06 1.166805e+06 9.853253e+05 1.695190e+06 1.207102e+06 1.430735e+06 7.426924e+05 2.808638e+06 2.005507e+06 1.610126e+06 1.613233e+06 1.211063e+06 1.625539e+06 1.570308e+06 1.944760e+06 7.228731e+06 2.318153e+06 2.224726e+06 1.430024e+06 2.245814e+06 1.362797e+06 6.848028e+05 1.378306e+06 1.737095e+06 2.701428e+06 2.001779e+06 1.615348e+06 1.957570e+06 1.432815e+06 1.816801e+06 3.260280e+06 2.170516e+06 1.714205e+06 2.220720e+06 1.927537e+06 2.736833e+06 2.119013e+06 1.679866e+06 1.252465e+06 4.234565e+06 1.866082e+06 2.512966e+06 2.545154e+06 1.547180e+06 1.761610e+06 2.649352e+06 1.823068e+06 2.257342e+06 3.238728e+06 1.904695e+06 1.588090e+06 1.947565e+06 1.558361e+06 4.608731e+06 1.027513e+06 1.239229e+06 1.532548e+06 9.520221e+05 2.037754e+06 2.117249e+06 2.611755e+06 C24 H47 N5 O7_1.963 3.292620e+04 1.727570e+06 1.268144e+06 1.260700e+06 2.644545e+04 1.203619e+06 1.503225e+06 1.413880e+06 29131.01 1.250850e+06 1.531275e+06 1.538632e+06 27985.99 1.229523e+06 1.459945e+06 1.245437e+06 4.337652e+04 1.428874e+06 1.424330e+06 1.263425e+06 4.576018e+04 1.311832e+06 1.285847e+06 1.708783e+06 26694.988 1.611024e+06 1.094787e+06 1.395124e+06 2.261413e+04 1.280043e+06 1.497982e+06 1.638188e+06 35679.85 1.384317e+06 1.076362e+06 1.156081e+06 3.247291e+04 1.387359e+06 1.774072e+06 1.333114e+06 2.522460e+04 1.251104e+06 1.561301e+06 1.634044e+06 1.166199e+04 9.914033e+05 1.524624e+06 1.319761e+06 1.229085e+06 1.274160e+06 4.690203e+05 1.309438e+06 7.574494e+05 9.337308e+05 1.145712e+06 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6.773935e+06 6.012775e+06 7.216186e+06 1.323237e+05 3.393685e+06 6.363740e+06 6.010249e+06 166358.38 5.479792e+06 6.683608e+06 6.076085e+06 140201.19 5.811163e+06 5.546053e+06 5.988480e+06 6.534467e+05 6.099858e+06 6.200967e+06 5.724078e+06 2.766242e+05 5.711523e+06 5.725888e+06 6.396534e+06 126371.418 6.270652e+06 5.452115e+06 6.037587e+06 1.062737e+05 6.110158e+06 5.993171e+06 6.335317e+06 156431.17 5.852437e+06 5.739712e+06 5.613807e+06 1.588940e+05 5.850774e+06 6.026700e+06 5.541839e+06 1.266195e+05 5.957501e+06 6.643123e+06 6.623302e+06 1.636082e+05 5.572570e+06 6.087197e+06 5.435238e+06 6.035792e+06 6.854333e+06 2.738971e+06 3.766699e+06 3.056573e+06 5.681968e+06 3.681724e+06 3.077588e+06 4.071982e+06 4.595714e+06 3.939407e+06 6.593967e+06 7.179428e+06 4.795476e+06 5.952835e+06 6.023145e+06 6.633641e+06 7.791783e+06 6.316214e+06 6.847590e+06 6.428504e+06 5.649901e+06 7.217930e+06 7.015326e+06 5.997297e+06 8.565785e+06 6.010267e+06 5.690194e+06 7.168461e+06 6.022596e+06 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5.691376e+06 9.947560e+06 1.083869e+07 1.243969e+07 5.406815e+06 7.521812e+06 6.593521e+06 3.063056e+06 3.613015e+06 5.929505e+06 4.763075e+06 4.126810e+06 4.041627e+06 4.489259e+06 4.788280e+06 4.706347e+06 4.043264e+06 6.423574e+06 5.494424e+06 9.000014e+06 6.627740e+06 5.290231e+06 7.191068e+06 8.101569e+06 5.614044e+06 1.189032e+07 4.545305e+06 6.236769e+06 1.145918e+07 4.257707e+06 4.868410e+06 5.527041e+06 6.529493e+06 1.271124e+07 5.783608e+06 1.228452e+07 5.545849e+06 3.600127e+06 5.592221e+06 1.511206e+07 3.514214e+06 1.320023e+07 1.025581e+07 4.948500e+06 1.605552e+07 1.750698e+07 1.260429e+07 4.490962e+06 5.538977e+06 5.139840e+06 4.431236e+06 6.192705e+06 3.286045e+06 9.096695e+06 4.685246e+06 4.050012e+06 6.083200e+06 5.315711e+06 7.009541e+06 5.542322e+06 6.690387e+06 1.646979e+07 6.938612e+06 6.348810e+06 4.919960e+06 1.010882e+07 5.756278e+06 2.596913e+06 4.863774e+06 5.631181e+06 1.048229e+07 6.667515e+06 4.924260e+06 5.808116e+06 4.847359e+06 5.237864e+06 9.889150e+06 6.632443e+06 4.990821e+06 6.744022e+06 7.477598e+06 8.196010e+06 6.130630e+06 7.106592e+06 4.051490e+06 6.935385e+06 7.753745e+06 7.768169e+06 8.881852e+06 6.517212e+06 9.130241e+06 8.223691e+06 7.267165e+06 7.611958e+06 9.263674e+06 7.467414e+06 5.476007e+06 7.192943e+06 4.102739e+06 1.440329e+07 2.682232e+06 4.401571e+06 4.030122e+06 3.726080e+06 7.419198e+06 8.956207e+06 7.139388e+06 C16 H35 N O10_1.964 1.738070e+05 1.770646e+06 1.660741e+06 1.772059e+06 2.841459e+04 9.550186e+05 1.625894e+06 1.467440e+06 50330.14 1.169170e+06 2.243316e+06 1.526082e+06 86379.85 1.423031e+06 1.322004e+06 1.888736e+06 2.493522e+05 1.429947e+06 1.538962e+06 1.419933e+06 4.205430e+04 1.573089e+06 1.515158e+06 1.707563e+06 26402.680 1.595984e+06 1.449133e+06 1.608811e+06 2.150721e+04 1.413656e+06 1.628466e+06 1.601774e+06 31786.88 1.657742e+06 1.408103e+06 1.307293e+06 2.776356e+04 1.616352e+06 1.755122e+06 1.513185e+06 2.192016e+04 1.557467e+06 1.594594e+06 1.822062e+06 1.032795e+04 1.246611e+06 1.597844e+06 1.513599e+06 2.287974e+05 2.810801e+05 1.587330e+05 8.223721e+05 2.735839e+05 4.496293e+05 1.159090e+06 4.996353e+05 2.361411e+06 3.381711e+05 4.108993e+05 2.985735e+05 3.188044e+05 5.473407e+05 4.415613e+05 4.886763e+05 3.184542e+05 6.014109e+05 1.271576e+05 4.954192e+05 4.540441e+05 6.633146e+05 2.730607e+05 5.189012e+05 7.864367e+06 3.322346e+05 7.434067e+05 5.627845e+05 5.358495e+05 5.734904e+06 6.876690e+05 7.837953e+05 2.381248e+05 5.241290e+05 3.738996e+05 3.361648e+05 2.624148e+05 3.987330e+05 2.039478e+06 6.939345e+05 4.649958e+05 1.277601e+06 3.606590e+05 3.160016e+05 5.572424e+05 2.274192e+05 7.323377e+06 1.660163e+05 3.320325e+05 1.899724e+05 1.339862e+05 8.312439e+04 5.513431e+05 5.753576e+05 2.794171e+05 5.688921e+05 5.373799e+05 5.968401e+05 8.274991e+04 8.149657e+05 2.547407e+05 4.699607e+05 4.960359e+05 4.731736e+05 6.156750e+05 2.406645e+05 2.687804e+05 4.500051e+05 1.165385e+08 7.712267e+05 6.517026e+05 2.411522e+05 4.883680e+05 7.973672e+05 3.138240e+05 3.993337e+05 4.723125e+05 4.385475e+05 2.299453e+05 1.989816e+05 3.080393e+05 1.104535e+05 2.835282e+05 4.102638e+04 2.313602e+05 7.211003e+05 3.141737e+05 3.148628e+05 3.682703e+05 2.157476e+06 2.921447e+05 3.667494e+05 4.598032e+05 5.642092e+05 3.295537e+05 5.033752e+05 2.569653e+05 2.996310e+05 2.281140e+05 4.000370e+05 1.676468e+05 3.964813e+05 2.257944e+05 6.416653e+05 4.799982e+05 4.446432e+05 1.056877e+06 4.973717e+05 4.701654e+05 1.807405e+05 7.902166e+05 2.066119e+05 1.655253e+05 5.276480e+05 5.205610e+05 3.517447e+05 8.827674e+06 2.685013e+05 4.102677e+05 6.110216e+05 4.553306e+05 3.025252e+05 1.420790e+06 1.465464e+06 3.389995e+05 5.778649e+05 1.741467e+05 2.465580e+05 8.148280e+05 4.068250e+05 2.486852e+05 2.247808e+05 2.319276e+05 7.612049e+05 3.769090e+05 9.217002e+04 2.503564e+05 1.373954e+05 4.893437e+05 6.097069e+05 9.202864e+05 5.612925e+05 4.675404e+05 1.332493e+05 4.278573e+05 1.656741e+05 4.371759e+05 7.056234e+04 8.708677e+05 3.304453e+05 3.605182e+05 8.811154e+05 3.956184e+06 6.724122e+05 2.574237e+05 1.687336e+05 2.936736e+05 7.283007e+04 2.758785e+05 5.149167e+05 5.252342e+05 1.276329e+05 5.946891e+05 2.061674e+05 4.533771e+05 2.774505e+05 7.330267e+05 1.057446e+05 7.875692e+05 5.246343e+05 1.590884e+05 4.040037e+05 6.450713e+05 1.500986e+05 6.643362e+05 1.276518e+05 2.220745e+05 2.232424e+05 5.740491e+05 4.976678e+05 3.435540e+05 1.752753e+05 1.776673e+05 3.137836e+05 1.116262e+05 2.417829e+05 4.468503e+05 3.218868e+05 5.494222e+05 6.029420e+05 3.291695e+05 2.924694e+05 6.445785e+05 2.098851e+05 1.220623e+05 3.125831e+05 6.866865e+04 1.589479e+05 1.987787e+05 8.900487e+05 6.553376e+06 1.464528e+06 1.275393e+05 3.956507e+05 1.094368e+05 4.466765e+05 1.689452e+05 2.993049e+05 9.299628e+05 4.108750e+05 4.012846e+05 2.488850e+05 5.095999e+05 5.802610e+05 1202.67339_1.964 2.947606e+04 1.541468e+06 1.444719e+06 1.588233e+06 2.004323e+04 8.424478e+05 1.346399e+06 1.495271e+06 36668.61 1.228234e+06 1.611779e+06 1.466298e+06 74879.20 1.256454e+06 1.298914e+06 1.401390e+06 2.059250e+05 1.346845e+06 1.349773e+06 1.180376e+06 3.254590e+04 1.516400e+06 1.313601e+06 1.733441e+06 20647.828 1.328882e+06 1.193872e+06 1.298592e+06 1.784817e+04 1.349168e+06 1.448736e+06 1.432722e+06 27464.11 1.467797e+06 1.249449e+06 1.215372e+06 2.300575e+04 1.349067e+06 1.613592e+06 1.124721e+06 2.018987e+04 1.492896e+06 1.412942e+06 1.678184e+06 9.563934e+03 1.148182e+06 1.369098e+06 1.316761e+06 5.345021e+04 4.497704e+05 6.086316e+04 2.387094e+05 2.453600e+05 1.942374e+05 1.023672e+06 1.683908e+05 1.951811e+06 4.148964e+05 4.344091e+04 5.683267e+05 3.199181e+05 1.720421e+05 5.500693e+05 2.616428e+05 3.137356e+05 9.608527e+04 3.824185e+05 3.600970e+05 4.448876e+05 6.910341e+05 4.956485e+05 6.659364e+05 7.656592e+06 6.871646e+05 2.718821e+05 5.176741e+05 5.072756e+05 4.733808e+06 2.570362e+04 5.177978e+05 4.333797e+05 9.216826e+05 4.884313e+04 3.891046e+05 3.206939e+05 1.927586e+05 1.330456e+06 6.692656e+05 5.567777e+05 1.177740e+06 1.164122e+06 3.901044e+05 1.199283e+05 5.769636e+05 6.400122e+06 3.439290e+05 5.764204e+04 1.390056e+05 3.230981e+05 3.666272e+05 3.884847e+05 3.178588e+05 2.347768e+05 4.780964e+05 2.203002e+05 2.730791e+05 1.067306e+05 3.907156e+05 1.464984e+05 2.457568e+05 2.124250e+05 2.042480e+05 3.022978e+05 2.112856e+05 3.439900e+05 3.305015e+05 8.793685e+07 4.167258e+05 1.383492e+05 2.149019e+05 8.526530e+04 5.033378e+05 6.174980e+04 1.547990e+05 9.328044e+04 1.336962e+05 3.786295e+05 4.786406e+04 2.066444e+06 3.471280e+05 3.303831e+05 3.430321e+04 4.709349e+04 1.919120e+05 5.372108e+05 4.919946e+05 5.166358e+04 1.956688e+06 2.471722e+05 3.516152e+05 1.113045e+05 7.306794e+05 3.699449e+05 2.735397e+05 1.818347e+05 2.012444e+05 2.037835e+05 1.804776e+05 4.029650e+05 1.463847e+05 5.484901e+05 3.368626e+05 4.603085e+05 3.079766e+05 1.006642e+06 7.429293e+05 2.490781e+05 6.608069e+05 9.210972e+05 4.545168e+05 1.689456e+05 6.358086e+05 2.316362e+05 1.382507e+05 7.770414e+06 3.556835e+05 4.157525e+04 4.954840e+05 1.335440e+05 6.216703e+04 1.321558e+06 1.201170e+06 1.546492e+05 3.521712e+05 2.007734e+05 6.804710e+05 2.868936e+05 8.594071e+04 7.437685e+05 3.047187e+05 6.002665e+05 8.564547e+04 2.467265e+05 6.331527e+05 2.225987e+05 1.881232e+05 3.500551e+05 9.438890e+04 4.702446e+05 5.512508e+04 6.094743e+04 1.847284e+05 8.622662e+04 6.831646e+04 8.559175e+05 2.740516e+05 6.213748e+05 4.808408e+05 2.634927e+05 6.685223e+05 3.015953e+06 9.858524e+05 4.988126e+04 4.436641e+05 2.354731e+05 2.700003e+05 2.424820e+05 6.201364e+05 5.703447e+05 1.578478e+05 1.914784e+05 1.664018e+05 1.554200e+05 5.045422e+04 1.047686e+05 4.018188e+05 6.419067e+05 9.052574e+04 2.776538e+05 2.403005e+05 5.034727e+05 2.543530e+05 3.284813e+05 1.029777e+05 3.680670e+05 1.200976e+06 5.021485e+04 1.253646e+05 7.137921e+05 2.750403e+05 4.760111e+05 5.756058e+04 2.158196e+05 2.737491e+05 3.943994e+05 4.207985e+04 4.248979e+05 3.225716e+05 6.606473e+05 3.671576e+05 6.380925e+05 3.479609e+05 2.878955e+05 3.856365e+05 4.228947e+05 6.059441e+04 7.349510e+05 1.737140e+05 5.299898e+06 1.081665e+06 2.324282e+05 3.846548e+05 3.330177e+05 4.864596e+05 7.114060e+05 3.570191e+05 1.016985e+06 1.159648e+05 5.165726e+05 1.971324e+05 3.190302e+05 5.089483e+05 C9 H18 O4_1.964 4.540319e+04 3.297566e+05 2.549251e+05 3.419218e+05 3.645898e+04 1.427946e+05 2.828664e+05 3.312482e+05 41506.81 2.172241e+05 3.372987e+05 2.812739e+05 45216.62 2.239022e+05 2.574468e+05 3.287726e+05 3.369149e+04 2.117179e+05 3.021295e+05 2.885890e+05 5.998581e+04 2.326403e+05 2.645835e+05 3.100184e+05 35728.736 2.877438e+05 2.658354e+05 2.872066e+05 3.227478e+04 2.517144e+05 3.139681e+05 3.100821e+05 56401.33 1.874443e+05 2.233624e+05 2.418319e+05 4.849123e+04 3.282266e+05 3.070636e+05 2.799322e+05 4.380886e+04 2.542711e+05 3.339693e+05 2.953460e+05 1.891160e+04 1.669956e+05 3.105447e+05 2.703482e+05 2.825597e+05 2.759709e+05 9.931433e+04 2.465668e+05 1.218460e+05 3.711409e+05 2.157740e+05 1.457586e+05 2.193304e+05 2.011996e+05 1.387941e+05 2.432544e+05 3.056059e+05 2.309357e+05 2.833122e+05 2.922351e+05 2.977624e+05 2.383888e+05 2.376317e+05 3.011349e+05 2.599109e+05 1.886261e+05 3.085018e+05 2.652202e+05 3.508677e+05 3.521675e+05 1.264944e+05 1.535132e+05 1.099627e+05 1.775049e+05 2.061897e+06 1.557119e+05 2.373542e+05 1.508308e+05 1.735305e+05 2.067261e+05 1.667110e+05 2.288274e+05 1.526468e+05 1.611045e+05 2.036586e+05 2.496029e+05 3.366391e+05 1.655983e+05 2.671948e+05 2.956975e+05 4.799377e+05 1.329957e+05 3.344331e+05 8.439203e+04 2.519320e+05 2.519839e+05 2.162864e+05 2.280095e+05 7.656375e+04 2.336662e+05 3.901808e+05 3.344490e+05 2.395700e+05 3.750377e+05 1.289708e+05 7.959814e+04 1.310022e+05 5.226683e+05 3.515764e+05 1.194222e+05 3.678333e+05 8.439551e+04 2.961757e+05 2.018043e+05 7.772601e+04 3.297789e+05 7.515748e+04 8.143630e+04 1.004071e+05 1.592010e+05 8.781037e+04 1.108453e+05 2.345638e+05 1.166470e+05 8.799933e+04 1.415100e+05 2.142693e+05 3.044063e+05 1.836922e+05 2.557047e+05 2.244025e+05 2.103987e+05 4.227937e+05 3.412995e+05 2.338271e+05 3.308793e+05 3.627426e+05 3.795511e+05 2.904130e+05 3.873749e+05 4.680851e+05 7.364060e+05 6.533588e+05 9.112603e+05 1.081680e+06 1.471488e+06 1.120317e+06 5.306788e+05 3.756286e+05 2.772947e+05 1.324210e+05 2.852813e+05 4.330216e+05 5.059443e+05 5.612869e+05 1.766244e+05 2.998141e+05 2.850289e+05 1.742332e+05 2.666978e+05 5.299461e+05 3.102438e+05 9.921904e+04 2.954224e+05 2.683665e+05 3.672575e+05 3.574881e+05 1.267196e+05 3.539120e+05 3.503033e+05 6.275095e+05 4.462618e+05 3.260750e+05 2.267884e+05 3.719860e+05 2.262687e+05 7.767312e+05 1.474828e+05 1.564277e+05 6.481405e+05 3.131679e+05 1.891498e+05 1.291150e+05 2.077819e+05 7.640006e+05 1.541706e+05 8.200721e+05 1.676310e+05 1.390273e+05 2.536286e+05 7.651194e+05 1.318960e+05 8.907420e+05 6.897614e+05 1.505628e+05 7.544380e+05 9.490401e+05 4.561078e+05 2.141439e+05 1.775190e+05 2.362990e+05 1.110373e+05 2.173522e+05 3.045065e+05 3.300611e+05 2.004509e+05 1.633859e+05 1.981952e+05 1.720208e+05 2.425207e+05 4.868133e+05 1.493778e+05 1.082325e+06 2.379782e+05 2.046610e+05 7.536315e+05 1.873141e+05 1.553288e+05 9.334499e+04 2.333921e+05 2.058923e+05 3.167395e+05 2.998765e+05 1.862197e+05 1.980634e+05 2.976270e+05 1.932885e+05 2.757475e+05 1.722258e+05 1.468478e+05 2.158444e+05 2.108350e+05 1.701987e+05 2.202345e+05 1.321097e+05 1.906988e+05 7.465088e+05 3.271613e+05 2.520847e+05 3.849157e+05 2.117252e+05 2.999614e+05 3.558356e+05 3.349611e+05 3.076019e+05 4.662477e+05 3.138619e+05 3.398363e+05 2.267871e+05 2.376822e+05 6.203463e+05 2.981853e+05 3.627152e+05 2.384903e+05 1.788288e+05 3.315834e+05 4.328162e+05 2.638232e+05 C7 H10_1.964 1.672207e+05 2.884967e+05 1.925204e+05 3.179637e+05 8.787073e+04 2.659939e+05 3.727953e+05 3.375393e+05 78187.99 2.874344e+05 2.292576e+05 2.979407e+05 61195.94 2.693819e+05 2.055450e+05 3.271628e+05 8.867263e+04 3.609645e+05 2.495125e+05 2.490307e+05 5.448173e+04 3.105554e+05 2.270198e+05 3.932986e+05 51510.454 2.470817e+05 2.646231e+05 3.753636e+05 4.732785e+04 2.286162e+05 2.177994e+05 3.725444e+05 77014.43 2.746382e+05 2.585213e+05 3.371380e+05 4.960088e+04 2.342446e+05 2.764319e+05 3.464152e+05 4.294515e+04 1.987862e+05 2.618333e+05 4.172278e+05 3.199639e+04 2.538096e+05 2.544956e+05 2.780797e+05 1.161663e+05 2.571241e+05 1.809039e+05 1.936021e+05 2.174682e+05 3.586361e+05 1.186605e+05 2.088673e+05 2.824696e+05 2.090417e+05 2.154729e+05 2.062166e+05 2.098745e+05 3.243751e+05 1.842634e+05 2.929357e+05 2.780173e+05 1.648080e+05 1.867664e+05 2.074162e+05 2.932199e+05 2.448488e+05 2.314155e+05 2.490593e+05 2.525330e+05 1.486461e+05 1.887868e+05 1.865422e+05 2.163920e+05 2.105015e+05 4.352390e+06 1.084869e+05 1.776963e+05 1.237948e+05 1.290642e+05 1.807386e+05 2.013614e+05 2.970383e+05 6.552004e+04 1.226370e+05 8.422682e+04 2.277710e+05 1.647705e+05 8.523432e+04 2.855386e+05 2.290929e+05 5.563964e+05 1.625436e+05 3.648057e+05 7.741267e+04 2.173590e+05 1.321487e+05 1.463675e+05 2.209552e+05 1.301456e+05 1.777719e+05 2.746295e+05 2.750473e+05 2.647529e+05 4.853871e+05 9.769605e+04 1.227324e+05 1.836531e+05 7.474016e+05 3.797880e+05 7.926735e+04 1.588686e+05 1.960516e+05 1.016598e+05 1.396404e+05 1.888911e+05 3.083824e+05 9.292549e+04 6.339078e+04 2.200128e+05 1.529420e+05 2.010793e+05 1.683549e+05 2.197290e+05 2.030669e+05 9.292194e+04 1.723658e+05 3.917084e+05 1.042777e+06 3.417520e+05 1.739812e+05 2.213365e+05 1.685594e+05 4.046821e+05 2.650185e+05 2.176618e+05 2.906566e+05 3.593798e+05 2.385372e+05 1.760962e+05 5.190224e+05 4.058989e+05 4.071002e+05 5.717736e+05 7.733652e+05 5.580564e+05 1.294913e+06 9.285957e+05 4.360268e+05 3.997855e+05 2.049036e+05 1.340369e+05 1.947500e+05 3.375810e+05 4.079808e+05 4.107394e+05 1.999191e+05 2.019364e+05 2.017087e+05 1.646295e+05 2.882201e+05 5.477214e+05 2.167780e+05 1.477633e+05 3.629400e+05 3.133804e+05 3.265390e+05 3.785551e+05 2.165085e+05 3.442422e+05 4.193539e+05 4.924452e+05 2.484541e+05 2.014250e+05 2.073542e+05 3.305956e+05 1.319255e+05 1.479349e+06 1.474351e+05 2.175286e+05 1.648447e+06 1.850109e+05 7.692999e+04 2.009042e+05 2.023834e+05 2.452345e+06 1.324516e+05 2.531933e+06 1.728903e+05 1.860029e+05 2.945059e+05 1.367291e+06 2.431736e+05 2.798033e+06 2.380814e+06 1.192291e+05 3.301820e+06 4.567721e+06 2.179125e+06 2.016420e+05 2.578932e+05 1.985389e+05 2.294385e+05 2.051801e+05 2.821210e+05 2.245438e+05 1.442306e+05 1.252966e+05 1.692863e+05 1.758250e+05 1.562707e+05 2.417500e+05 2.112965e+05 4.682082e+06 2.729013e+05 1.060465e+05 3.778830e+05 2.379086e+05 1.424941e+05 1.041607e+05 2.605810e+05 1.544559e+05 2.599777e+05 2.274082e+05 2.216386e+05 1.923066e+05 3.856926e+05 1.090217e+05 1.918841e+05 1.308107e+05 1.841338e+05 1.465418e+05 2.257203e+05 2.034513e+05 1.691338e+05 1.053004e+05 1.864959e+05 4.720400e+05 2.317806e+05 2.202260e+05 5.484809e+05 3.086066e+05 3.447330e+05 4.074401e+05 3.564899e+05 4.407899e+05 4.251920e+05 3.230460e+05 2.416626e+05 2.795679e+05 3.065331e+05 4.571465e+05 4.803426e+05 2.948952e+05 3.523775e+05 2.740250e+05 2.353556e+05 3.751070e+05 2.864136e+05 Dambonitol_1.964 1.225460e+05 1.079465e+06 8.632063e+05 1.085236e+06 5.857797e+04 5.643113e+05 7.716714e+05 8.937316e+05 80169.25 8.202132e+05 1.025498e+06 1.082513e+06 85367.57 7.865589e+05 8.365716e+05 9.932545e+05 1.513255e+05 7.156883e+05 9.268661e+05 8.148576e+05 1.082888e+05 8.524474e+05 9.040402e+05 9.843187e+05 58603.275 9.186664e+05 8.010900e+05 9.255965e+05 4.507901e+04 9.052111e+05 8.663826e+05 8.571446e+05 68887.65 1.025102e+06 8.527700e+05 7.306090e+05 6.492188e+04 9.248714e+05 8.533026e+05 1.000096e+06 5.181646e+04 8.319752e+05 9.441212e+05 1.029178e+06 2.569897e+04 7.481587e+05 8.687214e+05 8.858196e+05 6.870298e+05 7.542235e+05 3.254982e+05 5.843482e+05 3.796087e+05 8.205471e+05 5.036734e+05 4.690977e+05 5.928822e+06 6.477425e+05 4.221886e+05 5.709381e+05 4.818337e+05 4.896484e+05 6.099791e+05 6.698966e+05 4.049094e+05 2.661183e+06 5.683468e+05 4.856694e+05 7.198734e+05 4.004038e+05 3.582466e+05 4.985881e+05 6.736437e+05 4.637567e+05 1.464720e+06 6.366419e+05 1.796984e+06 1.955326e+06 2.382128e+05 2.130666e+06 9.475558e+05 7.370018e+05 1.173569e+06 8.803576e+05 1.197405e+06 2.438281e+06 1.236311e+06 6.128093e+05 1.908380e+06 2.492245e+06 1.095307e+06 1.613789e+06 7.008182e+05 5.471090e+05 1.135578e+06 6.392646e+05 6.130642e+05 3.865138e+05 2.891729e+05 5.810651e+05 5.356001e+05 3.762245e+05 3.504993e+05 5.460927e+05 5.281049e+05 7.057946e+05 5.170593e+05 5.558446e+05 6.752009e+05 4.571546e+05 7.090007e+05 8.340617e+05 3.887516e+05 4.942752e+05 4.081344e+05 2.904308e+05 6.514384e+06 7.579468e+05 5.023616e+05 7.048225e+05 3.124600e+05 7.809785e+05 2.886867e+05 4.624487e+05 4.063677e+05 5.141298e+05 1.118597e+06 2.479715e+05 4.101114e+05 6.202399e+05 6.518927e+05 9.177912e+04 7.499816e+05 8.138083e+05 5.633654e+05 6.482190e+05 6.857295e+05 9.146928e+05 6.248236e+05 8.295793e+05 3.948056e+05 7.032613e+05 6.034852e+05 6.922788e+05 2.494768e+05 5.042622e+05 6.161315e+05 4.169053e+05 5.523267e+05 1.194784e+06 2.209245e+06 1.818494e+06 1.380121e+06 7.140787e+05 2.431860e+06 4.622727e+05 1.034470e+06 1.090162e+06 1.277191e+06 4.855937e+05 6.452818e+05 6.958033e+05 8.567014e+05 9.578619e+05 2.154337e+06 1.256894e+06 4.270888e+05 1.119960e+06 8.866331e+05 8.798477e+05 2.253529e+06 8.098439e+05 9.067005e+05 9.611703e+05 1.457750e+06 8.784803e+05 4.838216e+05 4.429864e+05 6.519187e+05 2.915577e+05 7.942302e+05 1.385447e+06 8.038970e+05 1.539179e+06 3.213402e+05 4.004791e+05 1.190611e+06 6.500892e+05 1.228314e+06 1.126337e+06 2.741508e+06 4.546327e+05 7.752476e+05 4.214224e+05 1.450703e+06 5.135857e+05 1.381823e+06 1.544983e+06 1.299812e+06 3.716128e+06 3.736421e+06 2.543632e+06 5.940262e+05 1.373562e+06 1.058653e+06 4.421604e+05 7.898305e+05 6.886164e+05 2.087371e+06 3.693966e+05 6.299296e+05 5.204022e+05 1.380229e+06 1.580269e+06 2.859789e+05 1.247437e+06 6.045098e+06 9.992102e+05 6.411692e+05 8.091694e+05 1.623184e+06 7.833316e+05 3.435264e+05 9.358433e+05 5.341982e+05 8.690462e+05 7.984536e+05 6.428968e+05 7.930615e+05 3.615100e+05 4.145837e+05 1.293103e+06 6.493021e+05 3.818419e+05 6.496695e+05 1.011074e+06 1.193517e+06 5.363854e+05 7.962023e+05 6.047548e+05 3.430305e+06 6.137396e+05 4.421472e+05 1.383883e+06 9.107508e+05 8.496884e+05 7.184615e+05 5.794690e+05 2.211857e+06 1.229914e+06 8.683442e+05 7.424493e+05 5.703309e+05 6.586491e+05 1.239257e+06 5.782459e+05 1.001847e+06 6.403450e+05 7.294697e+05 3.311371e+05 7.370078e+05 2.317680e+06 C26 H51 N5 O8_1.964 3.215406e+04 7.970560e+05 7.828461e+05 7.225401e+05 2.601873e+04 7.092907e+05 8.074526e+05 7.587347e+05 29753.27 6.197422e+05 7.957322e+05 8.805176e+05 31012.03 7.481596e+05 6.652382e+05 7.286637e+05 2.494278e+04 7.681805e+05 8.332529e+05 7.072836e+05 4.487022e+04 6.708834e+05 7.761649e+05 9.087080e+05 27448.662 7.022172e+05 6.665809e+05 8.523900e+05 2.283857e+04 7.926782e+05 5.510053e+05 8.871261e+05 34673.32 8.018626e+05 6.616474e+05 5.998330e+05 2.991032e+04 8.916167e+05 8.017275e+05 7.581562e+05 2.323556e+04 6.516492e+05 9.607033e+05 8.736896e+05 1.049219e+04 4.552967e+05 7.840636e+05 7.814441e+05 7.572339e+05 5.591958e+05 2.294473e+05 6.561080e+05 4.156745e+05 4.836237e+05 5.184673e+05 5.119681e+05 9.078518e+05 8.035524e+05 8.295267e+05 9.551036e+05 1.216675e+06 7.492948e+05 9.464299e+05 7.916426e+05 9.505911e+05 7.872999e+05 1.093736e+06 8.561728e+05 1.067803e+06 8.819081e+05 1.141797e+06 1.138892e+06 1.060658e+06 1.909926e+06 7.960024e+05 7.719214e+05 9.352975e+05 7.614582e+05 4.268162e+05 7.821058e+05 6.682415e+05 5.987783e+05 5.293135e+05 6.784017e+05 5.937700e+05 7.503554e+05 2.840039e+05 3.949949e+05 6.761554e+05 6.683098e+05 1.302799e+06 6.389357e+05 1.072143e+06 8.542541e+05 1.052035e+06 7.565612e+05 9.515661e+05 3.805656e+05 5.537599e+05 7.383136e+05 5.623597e+05 1.123501e+06 3.020827e+05 8.873036e+05 7.193684e+05 1.008673e+06 6.513526e+05 1.246156e+06 4.838987e+05 4.084303e+05 5.913136e+05 1.361648e+06 9.179408e+05 4.943770e+05 5.635306e+05 4.105673e+05 3.718237e+05 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2.213931e+06 5.359637e+05 1.455680e+06 1.722573e+06 6.177771e+05 1.833141e+06 2.185498e+06 2.537928e+06 3.907595e+05 3.556919e+05 6.687429e+05 4.623203e+05 5.496685e+05 4.336368e+05 1.138286e+06 2.870092e+05 6.634080e+05 5.110235e+05 7.739404e+05 8.992242e+05 5.855505e+05 7.625066e+05 2.279523e+06 9.066284e+05 7.522120e+05 8.464281e+05 1.140279e+06 4.871247e+05 4.083977e+05 6.735515e+05 8.833544e+05 1.623179e+06 9.882552e+05 8.388688e+05 9.114943e+05 4.773599e+05 9.595210e+05 1.251846e+06 9.030541e+05 6.803973e+05 9.026881e+05 9.893530e+05 1.147946e+06 8.996949e+05 8.879749e+05 6.195475e+05 1.387558e+06 8.517327e+05 1.043401e+06 1.432286e+06 7.499952e+05 8.531784e+05 1.105522e+06 7.391253e+05 1.026479e+06 1.593044e+06 1.040153e+06 8.660462e+05 9.024010e+05 6.481696e+05 2.218996e+06 3.886065e+05 4.743362e+05 6.374367e+05 3.783176e+05 7.059406e+05 9.394281e+05 9.536997e+05 C12 H24 O8_1.964 2.762525e+05 1.443812e+06 1.546586e+06 1.811848e+06 9.107550e+04 1.037379e+06 1.456140e+06 1.493761e+06 126289.06 1.340366e+06 1.577369e+06 1.634538e+06 209614.30 1.435479e+06 1.308564e+06 1.474105e+06 5.477327e+05 1.492948e+06 1.478711e+06 1.405907e+06 1.921443e+05 1.429613e+06 1.520926e+06 1.515400e+06 101958.860 1.515762e+06 1.211188e+06 1.416570e+06 7.872870e+04 1.556031e+06 1.780928e+06 1.467911e+06 122855.56 1.392927e+06 1.302887e+06 1.452828e+06 1.731305e+05 1.411314e+06 1.574410e+06 1.231245e+06 1.101753e+05 1.502352e+06 1.681535e+06 1.653487e+06 5.623310e+04 1.282208e+06 1.393856e+06 1.477073e+06 3.424091e+05 3.902824e+05 2.404136e+05 3.528425e+05 2.496765e+05 4.396548e+05 5.312050e+05 2.174896e+05 6.430459e+06 3.110702e+05 2.663964e+05 4.379653e+05 3.547693e+05 3.093443e+05 3.694815e+05 2.908923e+05 2.826039e+05 1.199191e+06 2.712604e+05 2.636044e+05 3.827394e+05 2.785230e+05 2.991183e+05 2.589450e+05 2.638879e+06 2.966195e+05 6.303366e+05 3.706984e+05 6.451218e+05 8.039608e+06 1.692651e+05 9.800295e+05 4.324737e+05 5.744338e+05 4.932173e+05 4.704625e+05 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2.920243e+05 2.740099e+05 5.534096e+05 8.446627e+06 4.334611e+05 3.420382e+05 9.875684e+05 4.319272e+05 4.521982e+05 2.248185e+06 1.266116e+06 4.741183e+05 4.968427e+05 6.324192e+05 3.646817e+05 2.393872e+05 2.369287e+05 3.457919e+05 3.328966e+05 4.387198e+05 6.501968e+05 3.372117e+05 7.754446e+05 2.688760e+05 3.356675e+05 5.122218e+05 4.967128e+05 4.554713e+05 4.784067e+05 7.416075e+05 4.116990e+05 3.784009e+05 3.999559e+05 1.278515e+06 3.465275e+05 1.005004e+06 6.784709e+05 6.161938e+05 1.189784e+06 6.346153e+06 1.249013e+06 2.920265e+05 7.423087e+05 6.358500e+05 3.857773e+05 4.141365e+05 6.245588e+05 1.058608e+06 4.026324e+05 6.364396e+05 4.258053e+05 5.458654e+05 9.295889e+05 2.366698e+05 6.378002e+05 1.979715e+06 4.538868e+05 4.392460e+05 6.156495e+05 7.219999e+05 5.169650e+05 3.103501e+05 4.659515e+05 4.931745e+05 4.617020e+05 5.588183e+05 5.707721e+05 4.680119e+05 3.437520e+05 5.790326e+05 6.449934e+05 3.495918e+05 3.040057e+05 3.843920e+05 3.716877e+05 7.371595e+05 4.308742e+05 3.893853e+05 3.131311e+05 1.694134e+06 3.603012e+05 3.177313e+05 4.715045e+05 4.277689e+05 4.193434e+05 3.057544e+05 4.486149e+05 2.106209e+06 1.011245e+06 3.987312e+05 3.150534e+05 2.704294e+05 3.873085e+05 6.570013e+05 3.912275e+05 6.480297e+05 2.499973e+05 2.532714e+05 2.708257e+05 2.656464e+05 1.108033e+06 C23 H34 N5 O P3_1.964 4.119335e+05 3.846119e+05 2.182034e+05 1.962358e+05 3.850900e+04 2.578590e+05 3.536135e+05 3.487328e+05 37771.66 2.081546e+05 2.692100e+05 3.875959e+05 37364.71 2.507084e+05 2.547200e+05 2.815250e+05 3.211995e+04 2.876048e+05 2.849660e+05 2.290389e+05 6.034421e+04 2.362837e+05 3.901139e+05 2.615797e+05 37264.583 3.913341e+05 2.815808e+05 1.546828e+05 3.791854e+04 3.150706e+05 1.504195e+05 4.287891e+05 55375.24 3.125784e+05 3.135232e+05 2.245218e+05 4.898674e+04 2.650821e+05 2.856354e+05 2.873930e+05 4.272442e+04 8.786992e+04 2.902997e+05 4.538371e+05 1.648468e+04 1.421749e+05 2.885292e+05 2.800842e+05 1.765031e+05 8.374786e+04 1.149471e+05 3.764044e+05 2.291887e+05 2.230866e+05 7.756171e+05 8.242692e+04 9.201098e+04 9.051480e+04 1.055969e+06 9.350419e+05 2.070002e+06 8.007071e+05 5.262511e+05 6.482158e+05 9.466514e+04 3.056386e+05 1.386918e+05 1.160113e+05 8.485593e+04 1.788986e+05 1.717645e+05 3.919379e+05 2.606733e+05 2.574203e+05 1.927371e+05 1.029020e+05 3.260297e+05 1.203612e+05 8.773534e+04 1.481760e+05 4.240920e+05 4.555772e+05 3.682686e+05 5.499278e+05 8.190715e+04 1.436091e+05 1.817571e+05 2.044038e+05 7.913620e+04 1.108481e+05 2.558055e+05 8.392930e+04 1.976533e+05 7.543858e+04 1.581381e+05 1.968253e+05 1.518186e+05 8.006053e+04 2.814552e+05 1.217501e+05 2.158446e+05 2.522156e+05 1.766223e+05 4.923834e+05 9.824226e+04 1.594743e+05 1.922730e+05 2.210742e+05 1.357951e+05 1.284077e+05 1.324139e+05 1.539309e+05 2.320581e+05 7.627166e+04 1.328424e+05 9.360131e+04 1.109798e+05 1.102409e+05 3.812482e+05 1.546603e+06 2.395088e+05 5.581888e+05 1.822178e+05 1.582264e+05 8.012491e+04 1.296324e+05 1.055435e+05 4.216737e+05 4.870368e+05 1.235101e+05 1.190285e+05 9.780661e+04 1.216563e+05 1.008104e+05 2.173559e+05 2.266296e+05 4.031582e+05 1.481105e+05 6.429824e+05 3.190803e+05 1.279174e+05 1.143765e+05 2.284534e+05 1.554534e+05 1.679510e+05 1.260162e+05 7.913574e+04 1.666204e+05 3.206813e+05 1.469352e+05 1.815930e+05 1.839534e+05 9.097077e+04 2.053045e+05 4.046591e+05 1.369491e+05 1.179356e+05 9.684595e+04 8.758501e+04 4.531541e+05 1.145177e+05 1.037167e+05 1.847542e+05 1.049565e+05 1.499496e+05 1.350154e+05 1.460198e+05 3.759675e+05 1.989313e+05 1.830916e+05 5.604497e+05 1.454511e+05 1.154845e+05 2.891729e+05 4.471772e+05 5.275554e+05 4.370076e+05 5.682820e+05 4.549138e+05 8.800057e+04 1.875124e+05 7.842079e+04 1.447645e+05 1.329040e+05 1.303140e+05 1.464102e+05 1.760601e+05 1.824485e+05 5.941087e+05 1.952300e+05 1.104850e+05 1.010813e+05 1.513553e+05 1.070969e+05 2.151802e+05 7.611506e+04 9.927838e+05 3.229234e+05 2.102768e+05 1.854652e+05 1.377299e+05 5.292123e+05 1.869569e+05 1.354633e+05 1.052590e+05 1.014696e+05 1.159033e+05 7.544974e+04 2.139111e+05 1.915636e+05 2.614170e+05 9.204531e+04 2.336070e+05 2.141582e+05 3.410112e+05 1.064146e+05 2.294879e+05 1.968825e+05 1.089177e+05 4.058032e+05 1.375755e+05 3.244789e+05 1.420766e+05 1.006011e+05 1.427220e+05 1.215281e+05 1.252574e+05 8.687941e+04 1.265274e+05 9.781129e+04 2.951714e+05 1.301239e+05 2.585146e+05 4.000696e+05 1.581553e+05 2.094457e+05 2.704351e+05 5.320300e+05 8.387357e+04 1.173482e+05 3.978703e+05 6.865596e+05 1.227981e+05 1.976341e+05 1.657022e+05 1.847664e+05 4.621354e+05 2.725367e+05 4.005627e+05 1.774607e+05 8.965885e+04 1.780448e+06 3.506031e+05 1.227561e+05 3.980900e+05 9.216524e+04 7.884901e+04 1.645070e+05 2.880622e+05 1.026907e+05 3.470403e+05 1.801319e+05 C14 H6 N O14 P3_1.965 9.746742e+04 1.186283e+07 1.061294e+07 1.077745e+07 7.901741e+04 8.973059e+06 1.277757e+07 1.303361e+07 95908.69 8.143887e+06 1.108798e+07 1.179974e+07 110811.88 9.676267e+06 1.029170e+07 1.152766e+07 8.694206e+04 1.047231e+07 1.144130e+07 1.059206e+07 1.551621e+05 9.825573e+06 1.078193e+07 1.216541e+07 87217.218 1.137503e+07 9.825115e+06 1.125621e+07 6.896122e+04 1.032616e+07 1.069319e+07 1.230058e+07 104099.81 1.137869e+07 9.358378e+06 1.051183e+07 9.640604e+04 1.063634e+07 1.161247e+07 1.093256e+07 7.590435e+04 9.468391e+06 1.191992e+07 1.344503e+07 3.278414e+04 8.377774e+06 1.097538e+07 1.075544e+07 9.486066e+06 5.173415e+06 1.751261e+06 6.132631e+06 4.893813e+06 5.796103e+06 3.609497e+06 4.431796e+06 3.613772e+06 4.458356e+06 2.932936e+06 8.705607e+06 4.996232e+06 3.643361e+06 5.157979e+06 2.429094e+06 8.335311e+06 5.805643e+06 6.139887e+06 4.283895e+06 3.464464e+06 4.023355e+06 7.507055e+06 3.659291e+06 4.129553e+06 6.572452e+06 3.126459e+06 7.519688e+06 3.629816e+06 4.168629e+06 3.316137e+05 4.734457e+06 5.200350e+06 4.617759e+06 2.367219e+06 4.596584e+06 3.779803e+06 2.692501e+06 2.045397e+06 2.001168e+06 2.831858e+06 1.497059e+06 6.224463e+06 6.304585e+06 5.041936e+06 5.383319e+06 4.626090e+06 7.280873e+06 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9.844938e+05 9.184304e+05 1.383994e+06 9.558038e+05 3.797009e+05 9.090220e+05 1.043258e+06 1.712439e+06 1.106416e+06 8.370742e+05 1.016616e+06 6.558389e+05 9.094334e+05 1.676118e+06 1.257755e+06 8.650653e+05 9.609490e+05 1.359067e+06 1.469986e+06 1.090830e+06 1.034985e+06 5.850372e+05 1.429488e+06 8.449725e+05 1.219057e+06 1.378297e+06 9.115884e+05 8.705115e+05 1.271827e+06 8.943689e+05 1.264723e+06 1.671205e+06 1.260031e+06 8.094087e+05 9.462098e+05 7.948068e+05 2.393039e+06 5.060933e+05 6.429250e+05 7.412547e+05 4.396796e+05 1.049212e+06 1.078141e+06 9.403266e+05 C17 H33 N P2_1.965 3.329070e+04 2.894609e+06 2.301321e+06 2.324368e+06 2.729146e+04 1.975398e+06 2.284293e+06 2.682803e+06 34401.89 1.915089e+06 2.500239e+06 2.565431e+06 38909.64 2.327193e+06 2.220425e+06 2.025535e+06 2.721124e+04 2.637253e+06 2.803457e+06 2.021434e+06 4.952415e+04 2.136749e+06 2.335788e+06 2.655890e+06 28611.715 2.657055e+06 2.007004e+06 2.238755e+06 2.340803e+04 2.411116e+06 2.537869e+06 2.586567e+06 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340.23616_1.965 3.571101e+04 1.192441e+06 1.215267e+06 1.285877e+06 2.811318e+04 7.771729e+05 1.151010e+06 1.235892e+06 29582.64 1.132107e+06 1.293660e+06 1.331043e+06 30940.21 9.803645e+05 1.056767e+06 1.211030e+06 2.775122e+04 1.048447e+06 1.116503e+06 1.147116e+06 5.390638e+04 1.061994e+06 1.197418e+06 1.257383e+06 32598.802 1.224704e+06 1.156265e+06 9.527793e+05 2.777993e+04 1.082109e+06 1.202364e+06 1.339851e+06 42640.25 1.217575e+06 1.103940e+06 9.401781e+05 4.107131e+04 1.131588e+06 1.122290e+06 1.081531e+06 3.175558e+04 1.123501e+06 1.369623e+06 1.321796e+06 1.493755e+04 1.022192e+06 1.277453e+06 9.203997e+05 9.335757e+05 1.121991e+06 5.721357e+05 8.152937e+05 5.114616e+05 9.218230e+05 7.280984e+05 9.077080e+05 9.516066e+05 9.139842e+05 9.843719e+05 1.264043e+06 1.598568e+06 8.936385e+05 1.088343e+06 1.280523e+06 1.325406e+06 1.392082e+06 1.691692e+06 1.003278e+06 1.349167e+06 1.384972e+06 1.509519e+06 1.416545e+06 1.667978e+06 1.900259e+06 1.068496e+06 9.934202e+05 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1.012492e+06 7.713021e+05 7.549329e+05 1.911902e+06 1.309392e+06 2.145062e+06 9.115968e+05 1.085596e+06 1.418264e+06 5.362135e+05 8.334432e+05 1.188494e+06 5.687594e+05 6.743629e+05 6.258310e+05 5.946037e+05 7.197092e+05 8.073635e+05 7.418278e+05 8.726994e+05 6.928900e+05 1.451273e+06 9.970784e+05 1.049270e+06 1.204321e+06 1.433671e+06 1.357775e+06 2.950348e+06 7.957643e+05 7.829231e+05 2.467982e+06 9.645737e+05 6.828226e+05 8.306186e+05 1.157823e+06 2.419496e+06 7.903132e+05 2.267200e+06 1.228370e+06 5.487390e+05 1.068403e+06 3.556942e+06 5.402617e+05 2.877042e+06 8.731026e+04 6.241233e+05 2.621728e+06 2.621894e+06 3.171215e+06 5.981190e+05 6.587960e+05 9.254053e+05 7.491451e+05 1.064939e+06 4.830882e+05 1.422709e+06 1.212791e+06 7.788959e+05 9.973255e+05 8.019698e+05 1.383016e+06 9.265922e+05 1.398375e+06 3.280690e+06 1.509611e+06 1.492891e+06 7.888845e+05 1.527534e+06 8.342808e+05 3.916133e+05 5.855684e+05 1.108464e+06 1.818936e+06 1.318558e+06 9.052894e+05 1.037773e+06 9.800183e+05 1.307892e+06 1.732670e+06 1.117618e+06 9.244204e+05 1.162394e+06 1.255304e+06 1.753335e+06 1.030969e+06 9.970030e+05 6.029066e+05 1.772548e+06 1.139271e+06 1.675191e+06 1.576743e+06 1.145764e+06 1.313092e+06 1.586753e+06 1.210652e+06 1.481267e+06 1.953613e+06 1.030614e+06 7.910796e+05 1.316206e+06 7.141910e+05 2.624992e+06 4.879153e+05 5.595804e+05 7.565252e+05 6.504594e+05 1.347851e+06 1.346129e+06 1.803947e+06 C8 H16 N10_1.965 1.302856e+05 6.820594e+06 5.373774e+06 6.092487e+06 8.024956e+04 3.933496e+06 6.276728e+06 5.898861e+06 119213.80 5.025950e+06 6.213485e+06 6.072950e+06 177119.45 5.175242e+06 5.373403e+06 5.733214e+06 2.214102e+06 5.795183e+06 5.748824e+06 5.361713e+06 3.064282e+05 5.555712e+06 5.440560e+06 6.188414e+06 84218.603 6.207830e+06 4.974759e+06 5.954490e+06 2.043395e+05 5.462409e+06 5.918339e+06 5.788079e+06 107357.75 5.741679e+06 5.406494e+06 5.223890e+06 1.291179e+05 5.851711e+06 5.905123e+06 5.182115e+06 8.400350e+04 5.903606e+06 6.241877e+06 6.226949e+06 1.111362e+05 4.463669e+06 6.072517e+06 5.587900e+06 5.661239e+06 6.686879e+06 1.897682e+06 3.865246e+06 2.837754e+06 4.866696e+06 3.247521e+06 3.801505e+06 5.617930e+06 4.457305e+06 4.109036e+06 6.145615e+06 6.487830e+06 4.784904e+06 5.708741e+06 5.022354e+06 5.820718e+06 6.897747e+06 6.650286e+06 5.800782e+06 5.704924e+06 5.043930e+06 6.790189e+06 6.694940e+06 5.924111e+06 7.607034e+06 5.197696e+06 5.354998e+06 6.625281e+06 5.329262e+06 7.444536e+05 6.700817e+06 4.881240e+06 4.520927e+06 6.187506e+06 5.122631e+06 5.653061e+06 7.047054e+06 3.413822e+06 3.635807e+06 6.435321e+06 6.060996e+06 7.118586e+06 5.577931e+06 5.969086e+06 5.909954e+06 6.834368e+06 4.848192e+06 8.254578e+06 3.663765e+06 4.931767e+06 4.985157e+06 4.890546e+06 5.911710e+06 2.992252e+06 6.765532e+06 6.623837e+06 6.263736e+06 4.994821e+06 6.795317e+06 4.506636e+06 2.948374e+06 4.527159e+06 9.633979e+06 6.136212e+06 4.248755e+06 4.441084e+06 4.139248e+06 2.038754e+06 4.517845e+06 3.412162e+06 6.150875e+06 3.422060e+06 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4.339942e+06 1.364146e+07 1.669156e+07 1.226759e+07 4.512606e+06 5.699602e+06 5.393962e+06 5.357608e+06 5.561925e+06 3.206823e+06 8.947270e+06 4.038237e+06 4.216552e+06 5.838494e+06 4.596588e+06 5.874128e+06 4.423831e+06 6.399031e+06 1.762687e+07 8.083968e+06 6.658085e+06 4.736212e+06 9.129139e+06 5.913023e+06 2.545234e+06 5.419573e+06 5.261808e+06 1.050375e+07 6.611172e+06 5.842743e+06 5.505400e+06 4.337299e+06 4.937141e+06 1.042993e+07 6.504545e+06 5.342285e+06 5.994523e+06 6.416032e+06 6.581432e+06 5.345749e+06 6.082865e+06 3.582993e+06 6.515157e+06 8.452092e+06 7.819691e+06 1.010066e+07 6.857250e+06 8.356516e+06 8.664028e+06 7.277649e+06 8.952958e+06 1.093784e+07 8.348224e+06 4.581055e+06 7.545224e+06 3.910288e+06 1.566154e+07 2.525430e+06 3.949232e+06 4.292598e+06 3.875551e+06 8.455413e+06 8.688430e+06 7.620717e+06 C9 H12 O3_1.965 8.512983e+04 1.071087e+06 1.011728e+06 1.090890e+06 9.481415e+04 1.048671e+06 1.259330e+06 1.148723e+06 96872.72 9.808036e+05 1.023126e+06 1.379671e+06 75402.16 8.156240e+05 9.741798e+05 1.040040e+06 1.250642e+05 1.098557e+06 1.270919e+06 8.586788e+05 9.509350e+04 1.038534e+06 1.123642e+06 1.439384e+06 55672.644 9.705916e+05 9.956657e+05 1.133061e+06 4.913352e+04 9.316069e+05 1.003546e+06 1.210351e+06 89056.30 1.096425e+06 8.908534e+05 1.276244e+06 6.542928e+04 1.053992e+06 1.098024e+06 1.077444e+06 5.435795e+04 9.537470e+05 1.202824e+06 1.269678e+06 3.762061e+04 8.297651e+05 1.027277e+06 1.147652e+06 6.226222e+05 5.956187e+05 2.521917e+05 3.668919e+05 3.119990e+05 1.001857e+06 3.481368e+05 2.869520e+05 3.358797e+05 4.377471e+05 4.057581e+05 5.530536e+05 6.899212e+05 5.516475e+05 7.437160e+05 7.335738e+05 5.585300e+05 5.180933e+05 4.717698e+05 7.267323e+05 5.939930e+05 4.281449e+05 5.397364e+05 7.435031e+05 7.010638e+05 5.553877e+05 4.737203e+05 3.119753e+05 4.178256e+05 3.755805e+05 1.580358e+07 3.242602e+05 4.027768e+05 3.187886e+05 3.736565e+05 4.403801e+05 3.368491e+05 3.887296e+05 2.161394e+05 4.063135e+05 3.549076e+05 4.642150e+05 9.049109e+05 3.188644e+05 6.803930e+05 9.099161e+05 1.479288e+06 4.034190e+05 1.067150e+06 2.181218e+05 4.223477e+05 5.012940e+05 4.852160e+05 5.415315e+05 1.932581e+05 6.110798e+05 9.502855e+05 7.997933e+05 5.888747e+05 1.620360e+06 4.397543e+05 1.417052e+05 2.304705e+05 2.621866e+06 1.469263e+06 1.990684e+05 2.396339e+05 2.749087e+05 2.570849e+05 2.159601e+05 3.851469e+05 9.556985e+05 1.948403e+05 2.670720e+05 2.178459e+05 1.915420e+05 2.751372e+05 2.318093e+05 4.352579e+05 2.489035e+05 2.312158e+05 4.419060e+05 5.967289e+05 3.837316e+06 6.461213e+05 5.032412e+05 6.460795e+05 3.376516e+05 9.205525e+05 6.883196e+05 7.750309e+05 8.340063e+05 7.804026e+05 7.708542e+05 5.256399e+05 9.683065e+05 6.567094e+05 1.870837e+06 1.437437e+06 2.419511e+06 2.795527e+06 4.578247e+06 3.497209e+06 1.363951e+06 9.713533e+05 3.523618e+05 3.603143e+05 3.501612e+05 9.390176e+05 1.267660e+06 9.252028e+05 4.427043e+05 4.025823e+05 4.610685e+05 3.032942e+05 3.572194e+05 8.929756e+05 6.377387e+05 2.790946e+05 7.007031e+05 7.249232e+05 5.507811e+05 5.541646e+05 3.440311e+05 7.339799e+05 8.192769e+05 1.551188e+06 1.080415e+06 7.702535e+05 6.371344e+05 6.698734e+05 3.163622e+05 1.353937e+07 2.287139e+05 5.136146e+05 1.258549e+07 3.732661e+05 3.150490e+05 4.019412e+05 4.927596e+05 2.134949e+07 3.569849e+05 1.885611e+07 3.477574e+05 4.202730e+05 4.366311e+05 1.117035e+07 3.739922e+05 1.802355e+07 1.538416e+07 3.541823e+05 2.017346e+07 2.770434e+07 1.586100e+07 4.015884e+05 3.622972e+05 3.261671e+05 1.894952e+05 2.133678e+05 3.139042e+05 4.159487e+05 3.422036e+05 3.221858e+05 4.132610e+05 4.089372e+05 3.902422e+05 5.497311e+05 3.770935e+05 2.776429e+07 4.925804e+05 3.600258e+05 7.979690e+05 6.132308e+05 2.962728e+05 2.079609e+05 4.042835e+05 3.042824e+05 6.904826e+05 5.439354e+05 2.082009e+05 4.424837e+05 1.258797e+06 3.720876e+05 3.931219e+05 3.343524e+05 3.824725e+05 4.156915e+05 4.395588e+05 5.869791e+05 3.861220e+05 2.169516e+05 3.318024e+05 1.323727e+06 8.941699e+05 6.541198e+05 1.435587e+06 7.170905e+05 9.791076e+05 1.467491e+06 1.213453e+06 1.284065e+06 1.472462e+06 1.009216e+06 7.094319e+05 1.097969e+06 4.739827e+05 1.671337e+06 6.854148e+05 6.974141e+05 5.661998e+05 3.368546e+05 4.449069e+05 1.777055e+06 8.203517e+05 C23 H48 N3 P3_1.965 5.588316e+04 1.919421e+06 1.517466e+06 1.530286e+06 2.686316e+04 1.218146e+06 1.521831e+06 1.687125e+06 30328.63 1.385967e+06 1.668461e+06 1.685044e+06 31760.01 1.404484e+06 1.587963e+06 1.549013e+06 4.990646e+04 1.569329e+06 1.512475e+06 1.601019e+06 4.789737e+04 1.443307e+06 1.470808e+06 1.839461e+06 28244.887 1.567252e+06 1.267295e+06 1.545695e+06 2.246607e+04 1.625201e+06 1.783776e+06 1.538061e+06 34669.37 1.456329e+06 1.548756e+06 1.352068e+06 3.209589e+04 1.545254e+06 1.795472e+06 1.482344e+06 2.592218e+04 1.367742e+06 1.786252e+06 1.905912e+06 1.187017e+04 1.143223e+06 1.563897e+06 1.544387e+06 1.464500e+06 1.525457e+06 6.113611e+05 1.484526e+06 7.993435e+05 1.032138e+06 1.029526e+06 1.325088e+06 1.401420e+06 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1.256989e+06 1.530101e+06 1.788800e+06 1.630687e+06 1.750455e+06 1.726594e+06 8.863584e+05 2.089102e+06 1.558329e+06 6.876102e+05 1.063089e+06 1.606263e+06 1.948458e+06 1.988467e+06 2.190876e+06 2.590429e+06 2.181398e+06 2.333877e+06 2.208651e+06 1.831293e+06 1.197910e+06 1.578587e+06 2.738101e+06 2.783449e+06 3.107995e+06 1.968248e+06 1.458850e+06 1.943465e+06 9.683931e+05 8.582022e+05 1.642968e+06 9.696360e+05 8.985510e+05 9.885810e+05 9.320532e+05 1.015443e+06 1.172934e+06 1.081214e+06 1.148652e+06 1.376132e+06 1.839260e+06 1.484107e+06 1.598312e+06 1.918384e+06 2.179640e+06 1.956799e+06 3.923015e+06 1.092455e+06 1.364452e+06 3.888000e+06 1.042892e+06 2.097197e+06 1.261209e+06 1.352050e+06 3.066936e+06 1.197912e+06 2.778418e+06 2.074030e+06 1.378939e+06 1.685147e+06 4.417677e+06 9.623312e+05 3.232156e+06 3.031662e+06 9.730660e+05 3.805330e+06 4.437853e+06 4.376356e+06 9.770216e+05 1.023017e+06 1.267488e+06 1.241783e+06 1.309313e+06 1.114820e+06 2.699296e+06 1.032092e+06 1.220159e+06 1.185722e+06 1.304623e+06 1.639320e+06 1.115872e+06 1.697044e+06 5.253066e+06 2.131467e+06 1.927714e+06 1.365772e+06 2.524585e+06 1.245500e+06 6.508731e+05 1.370555e+06 1.817151e+06 2.920172e+06 1.920787e+06 1.626692e+06 1.682701e+06 1.272380e+06 1.422996e+06 3.037976e+06 1.767771e+06 1.621370e+06 1.760472e+06 2.003352e+06 1.881166e+06 1.711730e+06 1.752698e+06 1.311968e+06 2.631058e+06 1.709418e+06 2.173731e+06 2.416967e+06 1.465699e+06 1.935646e+06 2.124585e+06 1.525147e+06 2.385963e+06 2.815497e+06 1.937830e+06 1.259576e+06 1.780843e+06 1.424293e+06 4.979064e+06 7.846247e+05 1.306453e+06 1.258088e+06 8.569592e+05 2.008561e+06 1.994440e+06 1.659269e+06 C13 H28 O7_1.965 8.811541e+04 3.780711e+06 3.121803e+06 3.242978e+06 7.701515e+04 2.568099e+06 3.236988e+06 3.672343e+06 91197.71 2.655504e+06 3.352595e+06 3.458379e+06 95674.42 3.074211e+06 3.057715e+06 2.766907e+06 7.495056e+04 3.534875e+06 3.763300e+06 2.791315e+06 1.385785e+05 2.960034e+06 3.156770e+06 3.783352e+06 81151.443 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2.288315e+06 1.994988e+06 1.977287e+06 5.108524e+06 3.881484e+06 3.930167e+06 C24 H45 Cl N O2 P_1.965 4.610272e+04 3.575124e+05 3.971134e+05 3.912685e+05 3.740027e+04 2.678714e+05 3.362134e+05 4.196851e+05 44017.99 2.559112e+05 3.535332e+05 4.009446e+05 87270.26 2.949946e+05 3.722886e+05 3.319824e+05 2.372064e+05 3.962146e+05 3.347153e+05 3.468695e+05 5.590977e+04 3.388673e+05 3.151203e+05 4.300725e+05 33371.552 3.266698e+05 3.347335e+05 3.293136e+05 2.726626e+04 3.512506e+05 3.629145e+05 3.847569e+05 42777.33 3.582585e+05 3.574643e+05 2.751733e+05 4.233185e+04 3.641353e+05 3.853694e+05 2.943101e+05 3.863958e+04 2.929630e+05 4.363334e+05 4.444798e+05 1.387526e+04 2.635903e+05 3.629786e+05 3.311063e+05 1.904357e+05 4.613016e+05 1.116301e+05 3.373660e+05 2.114338e+05 2.545114e+05 1.998591e+05 2.316743e+05 2.994988e+05 2.665537e+05 3.127297e+05 3.486430e+05 5.331299e+05 3.284169e+05 3.694202e+05 3.649608e+05 4.381149e+05 4.352083e+05 4.048606e+05 3.354685e+05 3.984311e+05 3.387299e+05 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4.867632e+05 8.806745e+05 4.666937e+05 3.458325e+05 3.605602e+05 2.592208e+05 3.766429e+05 5.865132e+05 5.746858e+05 3.148146e+05 4.789184e+05 6.321289e+05 5.843940e+05 5.584612e+05 7.602203e+05 2.700755e+05 6.983959e+05 5.079114e+05 3.765381e+05 7.141294e+05 4.340241e+05 3.269450e+05 6.934112e+05 3.447674e+05 5.065243e+05 7.077276e+05 4.477526e+05 3.980146e+05 4.375529e+05 3.570138e+05 1.201988e+06 1.457348e+05 2.252476e+05 2.835031e+05 2.119158e+05 5.179651e+05 4.963288e+05 3.964855e+05 C10 H32 N9 O3 P_1.965 3.393239e+04 1.827691e+06 1.539769e+06 1.614824e+06 2.774242e+04 1.138748e+06 1.553974e+06 1.599395e+06 34557.60 1.407428e+06 1.611918e+06 1.738612e+06 63000.98 1.402737e+06 1.426529e+06 1.505959e+06 3.212003e+05 1.562448e+06 1.598584e+06 1.643648e+06 4.825616e+04 1.349594e+06 1.526946e+06 1.717035e+06 28369.253 1.585364e+06 1.290314e+06 1.533847e+06 2.297518e+04 1.526895e+06 1.796247e+06 1.624242e+06 36510.93 1.472970e+06 1.321344e+06 1.493261e+06 3.505133e+04 1.512633e+06 1.606987e+06 1.470998e+06 2.797647e+04 1.482765e+06 1.785938e+06 1.654564e+06 1.298714e+04 1.296961e+06 1.683556e+06 1.415722e+06 1.405778e+06 1.680717e+06 6.386191e+05 1.280542e+06 7.920451e+05 1.133763e+06 9.692097e+05 1.111600e+06 1.366644e+06 1.380060e+06 1.298849e+06 1.578338e+06 1.758402e+06 1.397737e+06 1.654723e+06 1.419170e+06 1.880493e+06 1.835975e+06 1.678026e+06 1.704052e+06 1.449561e+06 1.461744e+06 1.945422e+06 1.690293e+06 1.999820e+06 2.232806e+06 1.393268e+06 1.302829e+06 1.704012e+06 1.609649e+06 2.406131e+05 1.662529e+06 1.278865e+06 1.242308e+06 1.364420e+06 1.411287e+06 1.242194e+06 1.451050e+06 8.657695e+05 7.700442e+05 1.234533e+06 1.447628e+06 1.913775e+06 1.567667e+06 1.589818e+06 1.597151e+06 1.813570e+06 1.240169e+06 2.057395e+06 8.444634e+05 1.149068e+06 1.336761e+06 1.461875e+06 1.818908e+06 7.031565e+05 2.066937e+06 1.649840e+06 1.899914e+06 1.097724e+06 1.731196e+06 9.109539e+05 7.220429e+05 1.053734e+06 2.384012e+06 1.685232e+06 1.243210e+06 1.112377e+06 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1.586775e+06 1.742025e+06 4.154686e+06 1.061569e+06 3.416539e+06 2.607550e+06 1.159510e+06 3.839879e+06 4.255711e+06 3.497654e+06 1.167942e+06 1.301064e+06 1.402764e+06 1.175472e+06 1.306927e+06 9.343679e+05 2.463376e+06 1.121493e+06 1.224234e+06 1.207401e+06 1.295774e+06 1.724888e+06 1.184988e+06 1.567791e+06 4.681382e+06 2.208126e+06 1.919553e+06 1.326745e+06 2.562704e+06 1.874445e+06 6.881581e+05 1.473712e+06 1.638417e+06 3.386023e+06 2.018295e+06 1.801730e+06 2.052404e+06 1.129675e+06 1.328197e+06 3.012622e+06 2.068578e+06 1.446598e+06 1.593417e+06 2.240022e+06 2.223902e+06 1.958960e+06 1.690221e+06 1.096307e+06 2.287039e+06 1.817758e+06 2.414907e+06 2.460012e+06 1.617730e+06 1.839010e+06 2.364440e+06 1.440071e+06 2.230030e+06 3.148138e+06 2.079728e+06 1.279236e+06 1.912625e+06 1.186226e+06 3.711852e+06 7.084933e+05 1.046648e+06 1.179739e+06 8.826243e+05 2.124365e+06 1.895848e+06 1.894810e+06 C19 H35 N5 O7_1.965 9.544770e+04 8.280905e+05 6.846889e+05 6.893162e+05 2.712676e+04 4.939059e+05 5.474209e+05 6.915887e+05 33007.42 5.716630e+05 8.154951e+05 8.072555e+05 45661.41 6.413768e+05 5.422310e+05 6.212807e+05 1.774303e+05 6.743176e+05 6.043289e+05 6.444829e+05 4.664423e+04 7.019970e+05 6.475016e+05 7.752605e+05 25814.499 7.160779e+05 5.366327e+05 6.051535e+05 2.099296e+04 7.215951e+05 6.466507e+05 8.363721e+05 33311.80 6.697598e+05 5.710630e+05 5.980867e+05 3.372417e+04 5.844004e+05 6.889191e+05 6.339216e+05 2.668856e+04 7.273308e+05 7.378308e+05 8.121209e+05 1.251019e+04 4.411420e+05 7.297947e+05 6.285185e+05 6.653781e+04 7.457796e+04 5.221564e+04 7.892154e+04 5.493348e+04 5.895107e+04 7.792685e+05 8.755862e+04 8.871032e+05 8.598583e+04 9.611512e+04 8.180801e+04 6.160853e+04 8.556794e+04 8.912318e+04 7.086064e+04 5.935208e+04 9.202048e+04 6.829340e+04 5.588448e+04 6.833514e+04 7.461715e+04 1.322385e+05 6.081843e+04 5.681027e+06 7.502782e+04 5.393118e+04 8.074574e+04 9.154888e+04 2.807539e+06 5.172472e+04 2.207840e+05 8.139449e+04 2.246037e+05 7.604257e+04 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1.221041e+05 1.709273e+05 6.554772e+04 2.354371e+05 8.177666e+04 7.656220e+04 9.606024e+04 1.155964e+05 8.390159e+04 6.114801e+04 2.674248e+05 4.482918e+06 5.095183e+05 7.973198e+04 5.256487e+04 7.290390e+04 8.418880e+04 1.947657e+05 7.316064e+04 3.031595e+05 5.763522e+04 6.160763e+04 6.934292e+04 1.226900e+05 1.325212e+05 C11 H18 N2 O4_1.965 1.233797e+06 1.390346e+06 1.253104e+06 1.403799e+06 1.910439e+04 9.611315e+05 1.451220e+06 1.545134e+06 21859.50 1.057293e+06 1.704982e+06 1.310235e+06 25459.19 1.002085e+06 1.276598e+06 1.328708e+06 2.423644e+04 1.124678e+06 1.429599e+06 1.484219e+06 4.846271e+04 1.038505e+06 1.456521e+06 1.491092e+06 29904.192 1.048134e+06 1.344867e+06 1.330421e+06 2.267987e+04 9.746284e+05 1.242611e+06 2.163133e+06 37859.35 9.995137e+05 1.379022e+06 1.293678e+06 3.515187e+04 9.380146e+05 1.331710e+06 1.156199e+06 3.030836e+04 9.642012e+05 1.822917e+06 1.640724e+06 1.306015e+04 7.649293e+05 1.902026e+06 8.614401e+05 1.220785e+06 1.933990e+06 1.382368e+06 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8.116223e+05 1.570718e+06 6.839545e+05 1.861915e+06 9.452176e+04 2.232296e+06 1.764920e+06 1.437343e+06 1.074396e+06 8.043258e+05 1.291556e+06 2.022323e+06 1.713698e+06 1.140041e+06 1.224915e+06 1.988115e+06 1.271281e+06 6.485650e+05 6.795664e+05 1.081620e+06 1.910456e+06 1.426988e+06 6.163878e+05 1.168841e+06 1.045806e+06 1.636404e+06 1.554063e+06 8.783128e+05 8.923426e+05 2.561882e+06 2.610874e+06 1.466637e+06 1.032251e+06 1.922549e+06 1.121442e+06 1.399418e+06 1.251029e+06 1.302039e+06 1.946574e+06 1.166202e+06 2.795358e+06 1.731166e+06 2.054816e+06 2.131095e+06 1.404220e+06 1.687689e+06 1.707795e+06 1.360231e+06 8.939172e+05 3.022434e+06 8.557541e+05 1.157138e+06 1.122616e+06 1.062456e+06 1.229272e+06 1.584610e+06 2.222892e+06 C19 H35 N3 O4 P2 S_1.965 1.802853e+06 9.406541e+05 9.318929e+05 9.090372e+05 3.203357e+04 6.669361e+05 1.165140e+06 1.119202e+06 29192.61 8.084912e+05 1.038350e+06 9.706452e+05 29857.58 7.729969e+05 9.735413e+05 9.232734e+05 2.541098e+04 9.122111e+05 8.286775e+05 1.008974e+06 4.668548e+04 7.415948e+05 1.023791e+06 1.368808e+06 28525.014 7.874042e+05 7.253429e+05 9.592525e+05 2.729146e+04 8.726324e+05 9.811051e+05 1.167632e+06 47326.43 8.362278e+05 8.405164e+05 9.069472e+05 4.467519e+04 7.500103e+05 1.002355e+06 1.027450e+06 3.079456e+04 7.447662e+05 1.233517e+06 1.137580e+06 1.273401e+04 6.005824e+05 9.075062e+05 9.703320e+05 6.794747e+05 1.125671e+05 3.995141e+05 7.990478e+05 1.109280e+06 8.936503e+05 8.812406e+05 2.326286e+05 8.101998e+04 6.577111e+04 3.313933e+06 2.964816e+05 1.797411e+06 1.014988e+06 1.346573e+06 9.599542e+05 3.006106e+05 6.438731e+04 2.820950e+05 3.004889e+05 1.258746e+05 1.350720e+05 1.407206e+05 1.013742e+06 1.409430e+06 9.256945e+05 7.039421e+05 1.787860e+05 1.157499e+06 3.815331e+05 2.190185e+05 6.577007e+05 1.696159e+06 3.046919e+06 9.609617e+05 3.129141e+05 6.347633e+04 4.757794e+05 7.909802e+05 3.575511e+05 1.017865e+06 5.362037e+05 8.385110e+05 1.065730e+06 8.563854e+05 7.519444e+05 2.741226e+05 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1.089358e+05 8.411274e+05 5.619669e+05 2.600020e+06 1.168988e+06 1.194121e+06 1.836658e+06 6.865525e+05 9.523838e+04 3.961991e+05 1.880642e+06 2.134240e+06 2.020273e+05 7.951652e+05 2.699177e+05 2.299895e+05 2.340635e+06 3.605414e+05 7.904601e+04 6.303806e+05 2.683533e+05 3.987031e+05 3.712603e+05 1.172858e+05 4.176397e+06 1.370413e+06 7.434011e+05 1.713381e+06 1.320466e+06 2.974223e+06 8.408051e+05 8.873071e+05 1.989280e+06 1.496631e+06 1.015329e+06 1.112025e+05 3.676295e+05 4.377675e+05 9.622705e+05 6.778858e+04 1.698334e+06 9.178265e+04 1.652941e+06 1.608778e+05 1.840029e+05 8.189698e+05 2.505722e+05 6.327265e+05 5.537614e+05 6.097968e+05 1.019983e+05 5.206403e+05 1.305848e+06 3.414541e+05 2.078821e+05 1.682583e+05 3.147563e+05 3.030285e+05 9.080974e+05 1.601426e+05 6.085911e+05 1.519501e+06 1.099086e+05 4.598272e+05 8.077417e+05 2.600148e+06 3.622781e+05 7.604228e+04 1.467609e+06 1.213515e+06 2.272760e+05 1.665538e+06 1.088453e+06 3.478118e+05 1.909012e+06 4.883142e+05 1.693279e+06 1.076960e+06 1.704511e+05 7.746259e+06 6.418956e+04 5.898473e+04 5.390200e+05 2.646427e+05 1.313257e+06 5.046907e+05 1.121726e+06 2.088716e+05 1.167011e+06 3.502806e+05 C20 H40 N3 O P S_1.966 4.006266e+04 1.008164e+06 7.465961e+05 1.013939e+06 3.215912e+04 5.120373e+05 8.171354e+05 9.293598e+05 36330.83 7.846877e+05 8.849369e+05 9.009805e+05 90085.29 7.812300e+05 8.152103e+05 6.919425e+05 2.671719e+05 8.852411e+05 8.421724e+05 7.676140e+05 4.982810e+04 9.108968e+05 7.978424e+05 9.200237e+05 29471.595 9.607342e+05 6.262903e+05 8.521416e+05 2.485914e+04 7.811213e+05 9.492537e+05 8.360493e+05 38901.06 9.177914e+05 6.916087e+05 7.655906e+05 3.618000e+04 7.788502e+05 9.726465e+05 8.319292e+05 2.830236e+04 7.478848e+05 9.274063e+05 9.991770e+05 1.323148e+04 6.490473e+05 8.307431e+05 8.237821e+05 7.159489e+05 9.079869e+05 2.888723e+05 7.276105e+05 3.808541e+05 5.919224e+05 5.670528e+05 6.440828e+05 6.903619e+05 6.775128e+05 7.940554e+05 9.631668e+05 1.092223e+06 7.692630e+05 8.970535e+05 7.589558e+05 9.239155e+05 9.710677e+05 8.700972e+05 8.787667e+05 7.603548e+05 6.244055e+05 1.102028e+06 1.067515e+06 1.066628e+06 1.152369e+06 8.576450e+05 8.170837e+05 9.062210e+05 8.356573e+05 2.001284e+05 7.207286e+05 7.339836e+05 5.551941e+05 6.429375e+05 7.113823e+05 6.330349e+05 7.430295e+05 3.870527e+05 4.247217e+05 6.547123e+05 7.085005e+05 1.304220e+06 7.722703e+05 1.049194e+06 7.949385e+05 1.043533e+06 7.348255e+05 8.645961e+05 4.713629e+05 5.538003e+05 7.233111e+05 6.647375e+05 1.042012e+06 3.301893e+05 1.091704e+06 9.080399e+05 9.054525e+05 6.442155e+05 1.214284e+06 4.629092e+05 3.705086e+05 6.406677e+05 1.309086e+06 9.711588e+05 5.312747e+05 5.727671e+05 4.241539e+05 8.377894e+05 6.812795e+05 3.761356e+05 7.179998e+05 3.808801e+05 3.832991e+05 3.188454e+05 5.366886e+05 4.158054e+05 4.538812e+05 1.094672e+06 2.051358e+05 4.854574e+05 5.450860e+05 8.829926e+05 1.283521e+05 5.841102e+05 6.243898e+05 7.164242e+05 9.138176e+05 1.047871e+06 8.531422e+05 8.215057e+05 1.018456e+06 4.323748e+05 1.138952e+06 9.118901e+05 3.797853e+05 4.667631e+05 8.399171e+05 1.011361e+06 9.855614e+05 1.089079e+06 1.287276e+06 1.253685e+06 1.173951e+06 9.635910e+05 8.635285e+05 6.082240e+05 9.114640e+05 1.829403e+06 1.478876e+06 1.871488e+06 7.351423e+05 9.517679e+05 9.614375e+05 5.272179e+05 4.069520e+05 8.259915e+05 5.988918e+05 4.858332e+05 5.280099e+05 5.434744e+05 6.453423e+05 5.853258e+05 5.724986e+05 6.529106e+05 6.020537e+05 9.750389e+05 7.990256e+05 9.004688e+05 1.001490e+06 1.131425e+06 8.794597e+05 2.339482e+06 5.461508e+05 7.254293e+05 1.855925e+06 4.779911e+05 7.007856e+05 8.616739e+05 7.677912e+05 1.777759e+06 7.037693e+05 1.669111e+06 1.330301e+06 9.489235e+05 8.809522e+05 2.380869e+06 5.528789e+05 1.655788e+06 1.547661e+06 5.433139e+05 2.254782e+06 2.511652e+06 2.067724e+06 5.950266e+05 5.115025e+05 6.278090e+05 5.188225e+05 6.759277e+05 5.089843e+05 1.442745e+06 7.565091e+05 6.331595e+05 7.884836e+05 6.564112e+05 8.974108e+05 6.247681e+05 6.010210e+05 2.546086e+06 1.138360e+06 9.894300e+05 8.976720e+05 1.405265e+06 9.664402e+05 3.766775e+05 9.610282e+05 1.019544e+06 1.731520e+06 1.116176e+06 8.456858e+05 1.143882e+06 6.623695e+05 8.886262e+05 1.576796e+06 1.260379e+06 8.523661e+05 9.540136e+05 1.370411e+06 1.507451e+06 1.105913e+06 1.045704e+06 5.908046e+05 1.470103e+06 8.538488e+05 1.199691e+06 1.398295e+06 9.202502e+05 9.556211e+05 1.236261e+06 8.825753e+05 1.249680e+06 1.778101e+06 1.258355e+06 8.101363e+05 9.566505e+05 8.031950e+05 2.417174e+06 5.056260e+05 6.495514e+05 7.471857e+05 4.411253e+05 1.057702e+06 1.077999e+06 9.336175e+05 C7 H13 N O3_1.966 8.635138e+05 1.722067e+06 1.847537e+06 1.982402e+06 6.059862e+04 1.102493e+06 1.624952e+06 1.673135e+06 101323.81 1.623504e+06 1.814221e+06 1.879689e+06 78772.20 1.502118e+06 1.701428e+06 1.726857e+06 1.377407e+05 1.505523e+06 1.722803e+06 1.850640e+06 9.948676e+04 1.384134e+06 1.634237e+06 1.887328e+06 68369.060 1.660138e+06 1.539696e+06 1.898531e+06 5.021063e+04 1.575140e+06 1.618063e+06 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1.937471e+06 1.256053e+06 1.309845e+06 4.649968e+06 1.494944e+06 1.969306e+06 1.277245e+06 7.731301e+05 2.047665e+06 1.407105e+06 1.393181e+06 2.149092e+06 1.230988e+06 2.216570e+06 1.532671e+06 2.279066e+06 1.121352e+06 1.671056e+06 1.649461e+06 C11 H21 N4 P3 S_1.966 4.506479e+04 7.078507e+05 7.644074e+05 1.406499e+06 4.483982e+04 7.853144e+05 1.223772e+06 1.213069e+06 38500.27 6.890262e+05 9.364002e+05 1.038415e+06 34611.85 1.027735e+06 9.284432e+05 8.931785e+05 2.555888e+04 8.862097e+05 9.440352e+05 8.662823e+05 4.298792e+04 1.327791e+06 9.531320e+05 1.001134e+06 26389.568 8.459890e+05 1.006551e+06 1.025189e+06 2.017199e+04 8.519848e+05 8.609425e+05 7.271702e+05 25410.59 1.347810e+06 1.006220e+06 7.294484e+05 1.949534e+04 1.282181e+06 8.962145e+05 8.690065e+05 1.869458e+04 1.069570e+06 7.785126e+05 1.226911e+06 9.650619e+03 9.743514e+05 9.783456e+05 8.690764e+05 1.024146e+06 1.577401e+06 3.555446e+05 9.830595e+05 6.956628e+05 7.812922e+05 1.234866e+06 1.169466e+06 1.268642e+06 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8.460819e+05 7.219992e+05 7.562603e+05 7.101872e+05 8.870322e+05 1.163571e+06 4.929098e+05 9.720932e+05 8.436997e+05 7.830361e+05 5.015345e+05 5.436896e+05 3.398096e+05 7.982429e+05 3.894794e+05 8.999503e+05 1.089831e+06 1.829676e+06 1.399968e+06 1.213937e+06 1.421481e+06 1.660793e+06 1.927674e+06 2.793565e+06 3.258453e+06 1.099031e+06 1.460755e+06 2.786256e+06 1.029936e+06 9.201207e+05 1.876137e+06 1.012439e+06 9.029282e+05 7.507576e+05 1.085937e+06 8.392748e+05 6.694725e+05 1.081772e+06 1.116687e+06 1.075340e+06 1.250177e+06 1.103441e+06 1.621573e+06 1.526553e+06 1.995552e+06 5.888142e+05 1.263944e+06 3.476145e+05 1.048536e+06 1.445203e+06 1.640455e+05 2.937871e+05 7.957078e+05 7.024781e+05 2.122306e+06 5.626714e+05 2.551732e+06 1.243344e+05 2.403333e+05 7.899463e+05 1.394503e+06 4.689566e+05 1.560298e+06 1.576786e+06 1.007048e+06 2.775140e+06 4.729198e+06 1.559989e+06 1.395519e+06 5.539749e+05 4.970335e+05 2.187811e+05 4.142162e+05 1.150495e+06 1.410887e+06 1.971673e+05 5.146176e+05 6.808820e+05 1.179319e+06 5.249847e+05 3.683297e+05 4.538526e+05 2.462525e+06 1.241414e+06 1.362745e+05 5.037972e+05 9.563105e+05 2.930823e+05 6.587487e+05 1.156289e+06 4.089970e+05 2.788716e+06 8.550900e+05 7.180984e+05 1.009107e+06 3.548947e+05 4.681627e+05 6.367964e+05 3.781323e+05 4.105416e+05 1.219284e+06 4.215207e+05 8.586576e+05 3.463573e+05 1.183002e+06 9.347609e+05 1.464896e+06 7.934035e+05 9.087384e+05 1.711494e+06 9.618781e+05 8.704473e+05 4.393824e+06 1.312620e+06 1.415985e+06 1.263895e+06 6.555695e+05 1.026060e+06 8.861553e+05 1.059178e+06 2.898039e+06 5.572493e+05 2.184751e+06 1.060605e+06 4.727267e+05 2.419593e+05 1.530864e+06 9.782500e+05 C16 H39 N7 O10_1.966 3.987609e+04 2.938012e+05 3.185574e+05 3.298998e+05 2.906569e+04 1.982663e+05 3.887103e+05 3.090789e+05 32095.57 2.539063e+05 3.224002e+05 3.442135e+05 56121.06 2.503458e+05 3.059252e+05 3.420063e+05 9.895571e+04 2.521299e+05 2.853736e+05 2.157694e+05 4.651263e+04 3.192079e+05 3.416869e+05 3.823186e+05 25478.799 2.777362e+05 2.666187e+05 3.021167e+05 2.173947e+04 2.553314e+05 3.463482e+05 3.286903e+05 36294.13 3.414937e+05 2.268733e+05 2.435915e+05 3.715854e+04 2.988173e+05 3.637969e+05 2.795359e+05 2.815993e+04 1.987327e+05 4.183661e+05 3.453718e+05 1.204878e+04 2.510527e+05 3.068778e+05 2.756910e+05 6.366877e+04 7.407667e+04 6.220103e+04 1.000827e+05 6.044098e+04 8.249170e+04 5.450755e+05 6.227605e+04 2.947167e+05 6.684036e+04 6.468810e+04 8.105490e+04 8.314014e+04 7.110649e+04 8.767140e+04 7.727619e+04 6.395241e+04 6.414234e+04 6.828097e+04 6.179837e+04 6.824200e+04 5.170652e+04 8.165930e+04 6.079389e+04 2.721359e+06 7.383173e+04 1.324676e+05 8.768193e+04 6.715431e+04 1.335108e+06 3.963829e+04 1.148244e+05 6.353516e+04 6.426526e+04 7.236955e+04 7.834212e+04 6.429617e+04 7.088170e+04 3.142707e+05 1.063243e+05 1.050312e+05 8.202747e+04 1.072369e+05 1.263077e+05 5.989100e+04 7.060841e+04 2.660774e+06 6.840681e+04 7.309731e+04 8.206807e+04 6.967439e+04 7.781809e+04 7.494466e+04 1.229753e+05 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7.129436e+04 8.531058e+04 5.291500e+04 6.543288e+04 8.173149e+04 5.892066e+04 7.260021e+04 6.796689e+04 6.809090e+04 8.516486e+04 5.764618e+04 6.716795e+04 8.821995e+04 1.152933e+05 1.460643e+05 1.036026e+05 6.550454e+04 2.202178e+05 6.800928e+04 7.521952e+04 1.095318e+05 5.267850e+05 1.219850e+05 7.403634e+04 1.783797e+05 1.484525e+05 7.674665e+04 6.324229e+04 1.087126e+05 6.067249e+04 7.465325e+04 7.861353e+04 6.175863e+04 4.544838e+04 1.224380e+05 5.385257e+04 8.489845e+04 2.038864e+05 7.014593e+04 8.786239e+04 6.379908e+04 1.119434e+05 7.970966e+04 5.092120e+04 6.014645e+04 5.985138e+04 1.014208e+05 9.184838e+04 6.383827e+04 1.713481e+05 7.774285e+04 1.303923e+05 1.049249e+05 6.677369e+04 6.656573e+04 7.030325e+04 6.604962e+04 8.835801e+04 1.484045e+05 1.999881e+05 6.178164e+04 8.888346e+04 7.926527e+04 7.644187e+04 9.463298e+04 1.221088e+05 7.150207e+04 6.249712e+04 1.414192e+05 3.094421e+06 2.591864e+05 1.023253e+05 5.563563e+04 7.173875e+04 6.376448e+04 1.725899e+05 6.729026e+04 1.479643e+05 6.260405e+04 9.136415e+04 7.522201e+04 6.538640e+04 1.426653e+05 C23 H43 N2 O2 P3_1.966 9.424338e+04 4.241614e+05 4.395002e+05 4.646820e+05 8.403654e+04 3.492414e+05 5.196435e+05 4.451097e+05 94844.02 3.719356e+05 4.685469e+05 4.771137e+05 120659.55 3.838815e+05 4.490426e+05 4.655241e+05 1.498967e+05 3.714819e+05 4.175897e+05 3.560221e+05 1.417486e+05 4.614160e+05 4.775438e+05 5.221742e+05 81181.254 4.003665e+05 3.933278e+05 4.400564e+05 6.848513e+04 3.866839e+05 4.740384e+05 4.696963e+05 110866.11 4.859020e+05 3.465296e+05 3.764794e+05 1.071696e+05 4.363654e+05 4.958680e+05 4.152597e+05 8.619141e+04 3.283163e+05 5.637318e+05 4.783722e+05 3.781646e+04 3.618068e+05 4.633248e+05 3.996490e+05 1.985711e+05 2.177680e+05 1.686212e+05 2.347006e+05 1.826179e+05 2.123549e+05 6.394217e+05 1.780355e+05 4.341308e+05 2.015070e+05 1.915510e+05 2.382883e+05 2.223810e+05 1.549611e+05 2.500584e+05 2.303773e+05 1.928826e+05 1.964688e+05 2.051819e+05 1.854127e+05 2.041897e+05 1.647319e+05 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8.229270e+05 1.102726e+06 1.381695e+06 64412.98 9.608890e+05 1.391562e+06 1.340218e+06 63992.84 1.189613e+06 9.244945e+05 1.395522e+06 5.065847e+04 1.028299e+06 1.422095e+06 1.209330e+06 9.345545e+04 1.043167e+06 1.176462e+06 1.504721e+06 57255.587 1.161715e+06 9.830474e+05 9.734664e+05 4.554870e+04 1.270875e+06 1.433140e+06 1.306713e+06 67282.91 1.317568e+06 1.070238e+06 1.041533e+06 6.004507e+04 1.130459e+06 1.366199e+06 1.222118e+06 5.082632e+04 1.007924e+06 1.420232e+06 1.526461e+06 2.108499e+04 7.337065e+05 1.231561e+06 1.260115e+06 1.675399e+06 5.564800e+05 4.643487e+05 2.251350e+06 1.580673e+06 5.135252e+05 1.118058e+06 1.690157e+06 6.718598e+05 1.995829e+06 5.653559e+05 1.037592e+06 1.579738e+06 1.125256e+06 1.047933e+06 4.030361e+05 3.433674e+06 1.736364e+06 1.785763e+06 1.159952e+06 7.647395e+05 8.509730e+05 2.945252e+06 1.297763e+06 1.128284e+06 2.451217e+06 9.126564e+05 3.190494e+06 1.111058e+06 1.476434e+06 7.466491e+04 1.627148e+06 2.470301e+06 1.687235e+06 4.814430e+05 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5.699468e+05 4.543578e+05 9.305827e+05 2.130167e+06 1.125995e+06 1.341321e+06 5.037354e+05 1.247663e+06 1.129241e+06 9.893967e+05 2.426256e+05 3.131360e+05 1.125934e+06 1.592262e+06 9.814733e+05 1.173523e+06 5.367879e+05 1.125434e+06 2.455759e+06 1.279383e+06 6.443753e+05 3.352223e+05 1.910313e+06 5.267109e+05 3.661172e+05 Paracetamol-cysteine_1.967 1.231820e+06 1.683529e+06 1.937332e+06 2.531251e+06 4.277559e+04 9.287227e+05 2.044096e+06 2.094384e+06 37624.61 1.866349e+06 1.768153e+06 1.647147e+06 34626.85 2.192285e+06 1.800180e+06 1.899669e+06 2.688932e+04 1.599446e+06 1.706288e+06 1.957075e+06 4.844765e+04 2.159346e+06 1.876321e+06 2.136051e+06 69053.351 1.537384e+06 1.803639e+06 2.007437e+06 2.599705e+04 1.463522e+06 1.562036e+06 2.106400e+06 33492.74 2.151123e+06 1.860562e+06 1.768919e+06 2.644451e+04 1.781218e+06 1.903353e+06 2.045117e+06 2.459946e+04 1.710465e+06 1.544223e+06 2.379005e+06 1.262699e+04 1.873907e+06 1.640220e+06 1.811055e+06 1.475989e+06 2.583272e+06 1.381206e+06 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8.939603e+05 2.039347e+06 2.728420e+06 3.283095e+06 1.572180e+06 1.495861e+06 2.278790e+06 2.373067e+06 1.735566e+06 1.790627e+06 1.923486e+06 2.158557e+06 2.825326e+06 9.719125e+05 1.753869e+06 2.826014e+06 1.542162e+06 1.335432e+06 1.918696e+06 2.124169e+06 6.599432e+06 2.289524e+06 2.942898e+06 2.905074e+06 1.927167e+06 1.726205e+06 2.296438e+06 1.384201e+06 1.308556e+06 2.615368e+06 1.623770e+06 2.568314e+06 1.633897e+06 2.281710e+06 2.002269e+06 1.830678e+06 1.373354e+06 1.290297e+06 2.336552e+06 1.335308e+06 1.154511e+06 5.276879e+06 1.479719e+06 1.962793e+06 1.311082e+06 8.437172e+05 2.183917e+06 1.492904e+06 1.772401e+06 2.664117e+06 1.073483e+06 2.137672e+06 1.692603e+06 8.644733e+05 1.444518e+06 1.735272e+06 1.506790e+06 C26 H30 N4 O4_1.967 1.035933e+06 2.149367e+06 1.582565e+06 1.599524e+06 3.115192e+04 1.441226e+06 1.790838e+06 1.879553e+06 33888.35 1.463637e+06 1.837386e+06 2.027725e+06 35521.51 1.628421e+06 1.631101e+06 1.744197e+06 2.799392e+04 1.605753e+06 1.580304e+06 1.823116e+06 5.649120e+04 1.506452e+06 1.845699e+06 2.193232e+06 30460.488 1.496540e+06 1.689077e+06 1.665248e+06 2.700991e+04 1.569761e+06 1.762836e+06 2.053610e+06 43634.42 1.633711e+06 1.522701e+06 1.766189e+06 4.040692e+04 1.475188e+06 1.849795e+06 1.808059e+06 3.049995e+04 1.464627e+06 2.106224e+06 1.908252e+06 1.361945e+04 1.403852e+06 1.711343e+06 1.709697e+06 1.022931e+06 5.397030e+06 5.602430e+04 3.730715e+06 2.956751e+05 5.879795e+05 4.419312e+06 2.285667e+05 5.177107e+06 9.905215e+06 2.135566e+06 2.807350e+06 2.032687e+05 4.063732e+06 2.923595e+06 5.061799e+06 1.097222e+05 1.154454e+06 7.680128e+05 8.953829e+05 3.849997e+06 4.743691e+05 7.491050e+05 4.560691e+06 3.715092e+06 1.720453e+05 1.879188e+06 1.608476e+06 1.227458e+06 2.292721e+06 1.320562e+07 1.859397e+06 4.031211e+06 1.522756e+06 2.026339e+06 2.431861e+06 3.315413e+05 1.618781e+05 6.193855e+05 8.475463e+05 1.275388e+06 5.321961e+05 4.477002e+06 4.430177e+05 3.598475e+06 4.679981e+05 3.720417e+05 1.000054e+06 1.537858e+06 1.552596e+06 1.739339e+06 6.030280e+04 3.604122e+05 1.527163e+06 1.552690e+06 1.680478e+06 1.237173e+06 7.241698e+05 3.904998e+05 5.333201e+05 2.272993e+06 1.597688e+06 1.572175e+06 4.354119e+05 7.105592e+05 5.202623e+05 2.802888e+05 4.751104e+06 1.104820e+06 2.965232e+06 1.304915e+05 1.130340e+06 2.625617e+06 1.254506e+07 4.590764e+06 3.378651e+06 2.675899e+06 3.665399e+05 4.132288e+06 3.180175e+05 2.114077e+05 1.370947e+06 1.689593e+06 1.140614e+06 1.166506e+06 2.480670e+06 1.417718e+06 7.298069e+06 2.547817e+06 1.881790e+06 1.285275e+06 1.048869e+06 5.313009e+06 6.854338e+05 6.005078e+06 2.856291e+06 4.495167e+06 2.025295e+06 6.203063e+05 2.994088e+05 7.978281e+05 1.541204e+06 2.843147e+06 7.514317e+05 2.672861e+06 7.088251e+05 1.538138e+06 6.870766e+04 7.844134e+06 3.483758e+05 3.373677e+06 7.201835e+04 4.087251e+05 2.065178e+06 2.387575e+06 4.336056e+05 7.430547e+06 3.632844e+05 4.599661e+06 2.018366e+06 3.254243e+05 7.723526e+04 2.068006e+06 4.922122e+06 6.988744e+04 1.618978e+06 1.520574e+06 1.694540e+05 6.951003e+06 9.996075e+05 4.303573e+06 1.798974e+06 1.980148e+05 4.953263e+06 1.176154e+06 4.989215e+06 3.531367e+06 1.130567e+05 2.224362e+06 1.688299e+05 8.715158e+05 8.031482e+06 1.971820e+06 1.281098e+05 1.315509e+05 3.216817e+05 7.772569e+05 8.606111e+04 3.196486e+06 1.260188e+06 1.084875e+06 2.305659e+06 2.204629e+06 9.222536e+05 1.722896e+05 3.588754e+05 1.590484e+06 7.799584e+04 6.628419e+06 1.145858e+06 2.634449e+05 8.658902e+05 2.200544e+06 6.091397e+05 5.269522e+05 2.425927e+06 3.778451e+05 9.049113e+04 1.882489e+06 3.163931e+06 1.307774e+05 6.069268e+06 4.757979e+06 7.782386e+05 3.394204e+05 4.194710e+05 5.740576e+05 1.106030e+06 1.266588e+05 3.968586e+06 3.065078e+05 2.407914e+06 7.781253e+04 1.673749e+05 7.755668e+05 8.844617e+05 5.354052e+06 1.186698e+05 1.560333e+05 3.963927e+05 9.929200e+04 2.327017e+06 6.888889e+05 4.652718e+06 1.312340e+06 7.726453e+05 8.362034e+04 1.811443e+06 1.780049e+06 2.156351e+06 1.107140e+06 4.687689e+06 1.542370e+05 2.630191e+06 6.411936e+05 1.391717e+05 5.361643e+06 3.964301e+05 2.062839e+06 1.235015e+06 2.951554e+06 8.295085e+04 5.765599e+06 5.304776e+06 C8 H N O15 P2 S_1.967 4.167519e+04 1.054331e+06 9.695958e+05 9.520192e+05 4.143553e+04 8.209180e+05 1.021267e+06 1.019451e+06 42052.31 9.337046e+05 9.993607e+05 1.136818e+06 40477.65 9.107767e+05 8.946008e+05 9.644459e+05 3.167984e+04 8.645905e+05 1.005805e+06 1.100403e+06 5.351327e+04 7.658434e+05 9.652578e+05 1.162375e+06 29864.982 9.798318e+05 9.206098e+05 9.534324e+05 2.491558e+04 9.264127e+05 9.662985e+05 1.117881e+06 38362.45 9.254366e+05 8.408665e+05 9.429769e+05 3.060949e+04 9.520889e+05 1.119607e+06 9.794615e+05 2.501189e+04 7.955460e+05 1.063617e+06 1.225289e+06 1.061067e+04 7.349029e+05 9.225939e+05 1.008261e+06 1.297599e+06 4.534286e+05 3.805498e+05 2.257697e+06 1.397205e+06 4.254713e+05 1.174852e+06 1.655919e+06 8.265583e+05 1.454683e+06 7.055528e+05 8.579981e+05 1.760885e+06 1.168821e+06 1.127699e+06 5.788751e+05 2.905599e+06 1.559952e+06 1.219293e+06 1.208810e+06 8.516839e+05 6.748735e+05 3.228418e+06 1.480158e+06 1.278509e+06 2.505919e+06 7.462230e+05 2.948380e+06 9.978816e+05 1.202836e+06 4.692555e+04 1.597138e+06 1.562763e+06 1.198523e+06 3.847437e+05 1.516776e+06 1.126865e+06 8.224348e+05 5.423604e+05 3.597671e+05 5.865066e+05 3.994789e+05 1.057416e+06 1.809239e+06 7.332251e+05 5.423618e+05 9.562722e+05 1.406710e+06 1.592104e+06 1.579338e+06 2.124738e+06 7.439587e+05 5.428031e+05 2.036298e+06 1.254225e+06 2.161370e+06 6.093147e+05 4.675810e+05 3.252452e+05 2.767679e+05 7.348477e+05 9.653318e+05 1.526400e+06 2.540669e+05 1.008189e+06 2.024297e+06 2.369318e+06 7.815377e+05 8.552873e+05 2.747748e+06 7.340165e+05 1.070210e+06 8.453819e+05 9.243382e+05 1.231805e+06 1.065095e+06 1.052362e+06 5.995281e+05 9.282719e+05 8.708085e+05 1.142064e+06 1.388132e+06 1.026632e+06 4.616826e+04 7.244199e+05 9.454097e+05 1.025808e+06 1.279528e+06 8.164682e+05 1.492252e+06 1.039769e+06 1.194947e+06 7.478820e+05 1.330658e+06 1.301069e+06 8.304910e+05 1.139258e+06 1.348538e+06 2.518827e+06 1.996680e+06 1.279720e+06 1.288679e+06 7.175491e+05 1.310612e+06 7.024759e+05 1.316517e+06 1.143292e+06 1.295097e+06 1.051067e+06 9.712580e+05 1.409449e+06 1.254085e+06 7.865673e+05 1.427608e+06 6.346040e+05 3.973331e+05 2.903906e+05 5.998428e+05 4.466021e+05 6.586832e+05 4.073370e+05 3.414779e+05 6.275703e+05 6.188261e+05 3.684606e+05 3.544845e+05 7.548210e+05 1.132563e+06 1.008959e+06 1.356669e+06 1.044214e+06 3.267716e+06 5.379025e+06 3.747750e+05 2.232791e+05 2.094286e+06 1.424772e+06 1.517533e+06 3.287912e+05 4.491489e+05 7.260420e+05 3.216941e+05 1.129491e+05 9.918246e+05 6.680832e+05 6.722727e+05 3.788622e+06 5.990875e+05 3.247906e+05 2.542318e+06 3.877276e+05 4.966388e+05 1.482744e+05 1.742644e+06 9.552437e+04 6.258279e+05 8.898981e+05 1.044054e+06 1.046418e+06 4.074976e+05 3.184315e+05 4.598248e+05 1.011839e+06 3.095120e+05 1.956081e+05 4.931410e+05 9.457929e+05 6.245978e+05 4.134939e+05 3.909071e+05 1.406990e+06 6.097284e+05 3.279713e+05 8.009047e+05 4.339737e+05 3.990221e+05 6.885084e+05 6.570189e+05 5.086533e+05 1.055115e+06 4.822889e+05 6.974077e+05 1.067412e+06 7.855722e+05 6.165826e+05 1.157565e+06 3.687711e+05 7.123492e+05 3.911300e+05 6.578943e+05 4.363746e+05 1.175534e+06 1.217329e+06 1.034362e+06 1.271802e+06 5.290261e+05 1.126913e+06 1.198844e+06 7.478051e+05 3.599126e+05 5.166716e+05 1.352758e+06 1.358996e+06 1.069052e+06 1.000405e+06 7.797761e+05 1.158663e+06 1.337503e+06 5.211774e+05 8.077735e+05 5.494066e+05 1.958168e+06 5.241250e+05 5.655251e+05 C6 H6 O2_1.968 4.040183e+07 4.117563e+06 5.044158e+06 3.930761e+06 6.605021e+04 3.209837e+06 4.283632e+06 4.956726e+06 67845.25 3.820126e+06 4.273915e+06 5.012411e+06 70853.90 3.507165e+06 4.103089e+06 4.458912e+06 8.052947e+04 3.558904e+06 4.493921e+06 4.201040e+06 1.013882e+05 3.555080e+06 4.079328e+06 5.399274e+06 57276.093 3.721986e+06 4.377737e+06 3.991621e+06 4.862837e+04 3.849460e+06 4.419311e+06 4.583459e+06 73806.12 3.994833e+06 3.865390e+06 3.972446e+06 6.136309e+04 4.174135e+06 4.587798e+06 4.700459e+06 5.350251e+04 3.293029e+06 4.674695e+06 5.025615e+06 2.455569e+04 3.304131e+06 3.603671e+06 4.659208e+06 2.046176e+06 2.895149e+06 1.785258e+06 2.853216e+06 1.745482e+06 1.305647e+06 2.582332e+06 2.995109e+06 2.724514e+06 2.693928e+06 1.942806e+06 2.075508e+06 4.124183e+06 6.829916e+05 3.400958e+06 2.642084e+06 2.878768e+06 3.343689e+06 2.515986e+06 2.777765e+06 2.100024e+06 2.032952e+06 2.851872e+06 2.092354e+06 1.642636e+07 1.075841e+08 3.789408e+06 2.007272e+06 2.050780e+06 2.615055e+06 6.468106e+05 2.620255e+06 2.071571e+06 2.068794e+06 3.452934e+06 4.270304e+06 2.303621e+06 2.459879e+06 1.073269e+06 1.618649e+06 2.416419e+06 2.643617e+06 4.167496e+06 1.899588e+06 3.448170e+06 1.550232e+06 4.825750e+06 2.176574e+06 3.212389e+06 1.382885e+06 1.520922e+06 1.919055e+06 3.305398e+06 2.208518e+06 1.086282e+06 2.787571e+06 3.106669e+06 3.525654e+06 2.633983e+06 2.933527e+06 3.863986e+06 2.236186e+06 2.116350e+06 4.279451e+06 2.951997e+06 4.716597e+07 1.827602e+06 1.463601e+06 2.850362e+06 1.675669e+06 2.384687e+06 3.227501e+06 9.906473e+05 2.064463e+06 1.502034e+06 9.299689e+05 1.998404e+06 1.685991e+07 3.066561e+06 1.683410e+06 1.576066e+06 2.635070e+06 1.661849e+06 1.520570e+05 2.229226e+06 1.829100e+06 1.997268e+06 2.274219e+06 6.469202e+06 2.418156e+06 1.251075e+06 3.410652e+06 1.514131e+06 1.254465e+06 2.066750e+06 1.879929e+06 1.524274e+06 2.077093e+06 1.261715e+06 2.056048e+06 7.003867e+05 3.260596e+06 3.577706e+06 4.322015e+06 3.021458e+06 3.459966e+06 2.379230e+06 2.419361e+06 5.800390e+06 8.037266e+06 7.002321e+06 1.765299e+06 2.596995e+06 3.706204e+06 2.935238e+06 2.051930e+06 3.724131e+06 2.477866e+06 1.761760e+06 1.942304e+06 1.771016e+06 1.849001e+06 1.252550e+06 1.958349e+06 2.177850e+06 1.724142e+06 2.790503e+06 2.023028e+06 3.199064e+06 2.516741e+06 4.242278e+06 1.578232e+06 3.779846e+06 4.326827e+05 1.102388e+06 2.410377e+06 5.553411e+05 8.686767e+05 8.129600e+05 1.057834e+06 3.414289e+06 8.622006e+05 3.824763e+06 4.505327e+05 7.882941e+05 1.297539e+06 2.846371e+06 8.524720e+05 3.727698e+06 3.382241e+06 1.191714e+06 4.720502e+06 6.538779e+06 4.427336e+06 2.722797e+06 1.132044e+06 1.089182e+06 7.105797e+05 9.863239e+05 7.816488e+05 1.648023e+06 9.213292e+05 1.074046e+06 1.275722e+07 1.083252e+06 1.057303e+06 7.885540e+05 1.241711e+06 5.902715e+06 2.126841e+06 1.089829e+06 1.002121e+07 1.373388e+06 5.677074e+05 1.018636e+06 1.464792e+06 8.942629e+05 1.514598e+06 1.455302e+06 8.935416e+05 1.303472e+06 9.245995e+05 1.437338e+06 1.017853e+06 6.591808e+05 1.120615e+06 1.050200e+06 1.045032e+06 1.484465e+06 6.420513e+05 1.246871e+06 2.053631e+06 2.805382e+06 3.085093e+06 2.942482e+08 4.351423e+06 2.701360e+06 4.237142e+06 5.686738e+06 4.940723e+06 5.783536e+06 5.094528e+06 4.606331e+06 2.588691e+06 2.660717e+06 2.489582e+06 6.614907e+06 2.246250e+06 2.350567e+06 4.546268e+06 6.232863e+05 4.851573e+05 4.814988e+06 3.844370e+06 N-ACETYL-N-FORMYL-5-METHOXYKYNURENAMINE (AFMK) 2.954891e+07 5.025078e+06 4.571301e+06 4.952367e+06 2.985856e+04 3.829289e+06 4.907335e+06 5.273867e+06 32101.17 4.246382e+06 4.826905e+06 5.357843e+06 31868.83 4.151486e+06 4.496250e+06 4.707773e+06 3.226979e+04 4.409741e+06 5.132943e+06 4.772212e+06 4.557554e+04 3.658621e+06 4.746136e+06 6.383521e+06 26611.562 4.134068e+06 4.213976e+06 4.873780e+06 2.315954e+04 4.305904e+06 4.953672e+06 5.065171e+06 37587.36 4.405686e+06 4.605297e+06 4.479473e+06 3.215142e+04 4.379596e+06 4.933998e+06 5.044911e+06 2.712953e+04 3.773253e+06 5.784703e+06 5.748781e+06 1.215324e+04 3.320388e+06 4.202344e+06 5.073949e+06 9.664528e+06 1.769768e+07 8.999011e+06 1.864667e+07 5.047887e+06 7.994521e+06 6.768225e+06 1.243982e+07 1.326518e+07 1.035537e+07 1.414226e+07 1.464246e+07 9.995834e+06 5.796120e+06 3.469640e+06 6.298377e+06 1.491427e+06 9.774068e+06 5.721549e+06 9.614045e+06 4.029187e+06 4.637227e+06 1.869099e+06 2.550452e+06 2.296527e+06 5.764200e+05 1.129011e+07 1.970423e+06 2.964299e+06 8.377597e+05 8.960066e+06 3.616439e+06 7.214625e+06 6.012293e+05 1.361768e+07 2.294190e+06 3.202084e+06 6.834027e+05 1.305719e+06 9.376072e+06 4.819733e+06 4.779761e+06 7.875762e+06 5.731945e+06 9.241174e+06 3.293564e+06 1.185801e+07 4.631271e+06 4.016354e+06 1.492982e+06 2.023714e+06 1.777902e+06 6.846220e+06 6.376774e+06 1.587197e+06 4.109668e+06 4.976273e+06 1.182192e+07 4.309661e+06 7.665344e+06 6.435310e+05 3.726690e+06 4.190944e+06 1.008610e+07 5.354413e+06 7.356967e+06 3.479280e+06 6.962793e+06 4.663899e+06 5.380729e+06 9.810054e+06 4.605646e+06 6.359186e+06 1.039185e+07 8.209884e+06 1.890915e+06 4.774559e+06 3.973108e+06 3.275680e+06 4.192783e+06 2.166354e+06 4.475655e+06 3.350106e+06 4.586859e+06 3.938493e+06 6.985426e+06 5.617023e+06 2.857786e+06 1.484300e+06 1.035676e+07 5.560283e+06 2.420240e+06 3.536828e+06 4.477809e+06 4.764945e+06 5.678655e+06 1.327730e+06 5.661926e+06 4.397109e+06 2.072077e+06 2.851948e+06 2.050177e+06 2.620862e+06 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3.234023e+06 7.265062e+06 1.652491e+06 8.566309e+06 5.787526e+06 4.824565e+06 1.736957e+06 2.233419e+06 3.338065e+06 4.066941e+06 1.130092e+07 1.456786e+07 5.147779e+06 4.328879e+06 4.887692e+06 1.066898e+07 2.659384e+06 5.715476e+06 5.711436e+06 1.523367e+07 5.138931e+06 8.136270e+06 9.796532e+06 4.198828e+06 1.561301e+05 2.916720e+06 1.185644e+07 3.848971e+06 1.080011e+06 7.609603e+05 7.762793e+06 4.850246e+06 5.102701e+06 1.335943e+06 571.75888_1.968 1.086143e+05 6.403946e+06 5.454392e+06 5.406863e+06 1.100089e+05 4.227313e+06 6.066871e+06 6.003055e+06 121077.44 4.836942e+06 5.597096e+06 6.087733e+06 119610.29 4.975413e+06 5.159160e+06 5.772059e+06 8.922343e+04 5.442133e+06 5.891914e+06 5.182878e+06 1.654009e+05 4.996590e+06 5.393980e+06 6.371069e+06 90541.646 5.561142e+06 4.925501e+06 5.413173e+06 7.134563e+04 5.592604e+06 5.410591e+06 6.464775e+06 106817.15 5.342366e+06 4.942841e+06 5.243235e+06 8.864151e+04 5.208722e+06 5.886683e+06 5.786297e+06 7.366427e+04 4.644021e+06 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3.156156e+06 8.453781e+06 4.836043e+06 4.898911e+06 5.281211e+06 4.959975e+06 4.850691e+06 3.756178e+06 5.476422e+06 4.130208e+06 4.356031e+06 4.154269e+06 3.941689e+06 1.039930e+07 6.136593e+06 3.841166e+06 4.486986e+06 2.179486e+06 5.254731e+06 3.080037e+06 3.392291e+06 3.680247e+06 4.026334e+06 5.012089e+06 3.671897e+06 9.900538e+06 4.717107e+06 7.729156e+06 3.317595e+06 4.871105e+06 3.646507e+06 2.035819e+06 1.768129e+06 3.861807e+06 3.053635e+06 4.044182e+06 6.289097e+06 3.467989e+06 3.592885e+06 2.938184e+06 3.155388e+06 3.234222e+06 1.855580e+06 2.732661e+06 3.549554e+06 2.840933e+06 3.185645e+06 4.310099e+06 2.727278e+06 4.243267e+06 3.540565e+06 6.008052e+06 3.457858e+06 2.403569e+06 3.646755e+06 3.025306e+06 4.000721e+06 6.218913e+06 3.392227e+06 4.919782e+06 3.305185e+06 3.387315e+06 2.716142e+06 3.823025e+06 4.331944e+06 4.290091e+06 4.946145e+06 2.503361e+06 4.485892e+06 3.194110e+06 5.185575e+06 5.566358e+06 4.152520e+06 6.448377e+06 5.209098e+06 2.994465e+06 5.885337e+06 3.064045e+06 3.459143e+06 2.604201e+06 4.722799e+06 2.802706e+06 3.429193e+06 3.164909e+06 6.121777e+06 5.699573e+06 4.628763e+06 2.060830e+06 5.909270e+06 4.580858e+06 1.043338e+07 8.009856e+06 2.525108e+06 6.129257e+06 4.592889e+06 4.315491e+06 2.359060e+06 6.405651e+06 9.651968e+06 "1-hexadecanoyl-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine_1.968" 2.162493e+07 1.366899e+07 1.422578e+07 1.408560e+07 1.075807e+05 1.202163e+07 1.457899e+07 1.545038e+07 115926.06 1.323469e+07 1.389385e+07 1.547818e+07 105326.98 1.271079e+07 1.385591e+07 1.356433e+07 8.334968e+04 1.254964e+07 1.501932e+07 1.344479e+07 1.756479e+05 1.241290e+07 1.449247e+07 1.790315e+07 100193.288 1.217280e+07 1.290539e+07 1.326431e+07 9.087203e+04 1.399982e+07 1.259385e+07 1.657253e+07 144435.04 1.343297e+07 1.295807e+07 1.270426e+07 1.201405e+05 1.340462e+07 1.527544e+07 1.490062e+07 1.026791e+05 1.208692e+07 1.515794e+07 1.688310e+07 4.956154e+04 1.009987e+07 1.404246e+07 1.398093e+07 1.104563e+07 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1.126931e+07 1.163217e+07 1.313217e+07 1.103507e+07 1.631285e+07 6.522007e+06 1.164337e+07 7.150908e+06 1.133403e+07 1.113062e+07 1.076587e+07 2.063455e+07 1.478135e+07 8.422731e+06 1.648795e+07 9.557720e+06 9.855971e+06 9.114607e+06 1.168625e+07 7.935196e+06 8.474277e+06 9.060270e+06 1.875130e+07 1.016015e+07 1.234951e+07 5.147150e+06 1.101038e+07 1.431081e+07 2.432453e+07 1.848814e+07 6.797971e+06 1.390617e+07 1.083375e+07 1.338757e+07 8.815543e+06 1.916558e+07 2.561170e+07 C49 H80 N P3_1.968 5.113913e+06 3.190695e+06 3.673945e+06 3.413737e+06 3.648424e+04 2.531273e+06 3.582237e+06 3.756255e+06 40375.11 3.160055e+06 3.038005e+06 3.707598e+06 36447.91 2.990047e+06 3.171116e+06 3.462208e+06 2.807361e+04 3.357175e+06 3.204312e+06 3.269029e+06 6.069190e+04 3.054242e+06 3.571443e+06 3.822005e+06 34923.694 2.774238e+06 3.212025e+06 3.299038e+06 2.961148e+04 3.416016e+06 3.103234e+06 3.915860e+06 46269.86 3.094490e+06 3.087093e+06 2.801295e+06 3.893670e+04 3.536587e+06 3.476090e+06 3.550568e+06 3.367915e+04 2.977371e+06 3.521141e+06 4.036261e+06 1.608926e+04 2.322524e+06 3.384583e+06 3.360683e+06 2.319147e+06 3.344052e+06 2.547595e+06 6.189514e+06 2.235582e+06 2.623376e+06 3.037257e+06 3.853410e+06 4.073757e+06 3.583923e+06 4.948064e+06 3.454608e+06 2.586885e+06 3.811503e+06 4.689542e+06 5.210602e+06 3.363663e+06 4.863331e+06 2.511523e+06 3.486913e+06 4.436435e+06 4.617721e+06 3.341075e+06 3.684718e+06 3.635617e+06 2.769235e+06 4.813026e+06 4.124840e+06 3.541502e+06 2.526827e+06 2.635836e+06 2.851337e+06 3.021514e+06 2.717953e+06 2.755366e+06 6.077472e+06 2.807098e+06 3.356247e+06 3.473494e+06 3.876114e+06 2.865479e+06 1.412671e+06 3.582747e+06 2.512904e+06 3.752611e+06 1.872941e+06 4.187390e+06 2.188235e+06 3.291408e+06 2.421138e+06 2.421988e+06 2.021036e+06 3.449243e+06 3.173176e+06 1.722175e+06 2.196079e+06 3.869857e+06 3.807645e+06 3.973783e+06 3.612166e+06 1.744562e+06 2.804260e+06 2.883651e+06 3.639182e+06 4.218075e+06 2.384128e+06 1.838904e+06 4.647069e+06 2.629366e+06 2.490963e+06 3.133055e+06 2.471635e+06 2.949858e+06 3.484287e+06 1.728238e+06 3.400720e+06 2.797816e+06 3.210867e+06 4.145860e+06 3.010362e+06 2.919180e+06 1.324791e+06 2.215873e+06 4.219754e+06 3.413298e+06 4.770677e+06 3.285961e+06 2.562904e+06 4.029372e+06 2.833506e+06 3.070960e+06 3.075204e+06 3.019381e+06 3.123667e+06 4.206975e+06 2.737031e+06 4.309643e+06 3.109430e+06 1.834877e+06 3.255257e+06 2.409392e+06 3.157790e+06 4.858234e+06 3.245996e+06 3.038639e+06 2.760870e+06 3.369107e+06 2.865059e+06 4.593995e+06 4.103356e+06 3.395357e+06 4.284380e+06 2.666003e+06 4.436015e+06 5.039059e+06 2.216417e+06 5.680275e+06 3.087981e+06 3.716236e+06 2.909057e+06 3.011053e+06 3.251446e+06 2.801532e+06 3.519709e+06 2.668575e+06 2.344241e+06 2.677310e+06 3.202628e+06 8.052583e+06 4.258000e+06 2.877651e+06 3.151288e+06 1.492223e+06 4.046136e+06 2.149997e+06 2.370172e+06 2.901214e+06 2.432027e+06 4.560730e+06 2.393806e+06 5.946392e+06 3.399497e+06 4.838455e+06 2.405207e+06 4.145878e+06 2.598593e+06 1.395599e+06 1.319895e+06 2.465971e+06 2.672933e+06 2.829226e+06 4.647032e+06 2.168748e+06 2.868291e+06 2.198724e+06 2.854428e+06 2.850686e+06 1.302035e+06 2.509821e+06 3.379239e+06 2.465321e+06 2.784976e+06 3.189084e+06 2.064634e+06 2.284002e+06 2.584569e+06 3.429071e+06 2.762787e+06 2.190434e+06 2.609035e+06 2.282316e+06 3.470460e+06 4.196895e+06 2.693539e+06 3.573496e+06 2.980008e+06 2.394260e+06 2.516878e+06 3.188314e+06 3.682531e+06 3.084135e+06 4.151561e+06 1.570922e+06 3.776339e+06 2.189777e+06 3.163696e+06 3.500976e+06 3.427251e+06 5.144069e+06 3.682085e+06 2.776528e+06 5.107865e+06 2.009292e+06 3.357056e+06 3.045003e+06 3.809348e+06 1.820410e+06 2.720380e+06 2.164987e+06 4.237083e+06 3.256428e+06 2.972798e+06 1.662769e+06 3.653705e+06 4.350470e+06 7.957320e+06 5.490836e+06 2.289619e+06 4.744271e+06 3.262502e+06 2.877944e+06 2.439551e+06 4.723810e+06 6.311154e+06 C44 H74 N5 O4 P_1.969 2.619639e+07 1.515087e+07 1.643538e+07 1.532703e+07 7.132932e+04 1.431163e+07 1.517055e+07 1.728821e+07 78507.70 1.570936e+07 1.682689e+07 1.772208e+07 72382.92 1.173102e+07 1.531727e+07 1.514920e+07 5.554726e+04 1.556823e+07 1.635875e+07 1.559680e+07 1.153059e+05 1.429540e+07 1.605174e+07 1.911984e+07 66419.809 1.387113e+07 1.496511e+07 1.467361e+07 5.991124e+04 1.570396e+07 1.433384e+07 1.831009e+07 95675.98 1.537089e+07 1.471738e+07 1.511134e+07 8.597481e+04 1.550585e+07 1.426854e+07 1.693676e+07 7.073095e+04 1.429037e+07 1.733646e+07 1.970115e+07 3.397609e+04 1.221504e+07 1.304779e+07 1.696343e+07 1.444730e+07 1.290102e+07 5.473129e+06 2.977419e+07 1.537635e+07 8.823843e+06 1.840042e+07 2.224550e+07 1.730879e+07 1.565114e+07 2.992175e+07 1.677211e+07 1.518950e+07 1.965830e+07 2.699120e+07 2.385564e+07 1.813655e+07 1.892858e+07 1.109662e+07 1.804356e+07 2.289970e+07 1.897768e+07 1.539991e+07 1.933135e+07 1.867644e+07 1.312489e+07 2.164260e+07 1.477269e+07 1.464492e+07 1.337514e+07 1.244690e+07 1.685332e+07 1.835195e+07 1.201744e+07 1.188204e+07 2.217317e+07 9.754745e+06 1.289273e+07 1.774950e+07 1.741466e+07 1.123530e+07 6.157913e+06 2.235609e+07 1.244669e+07 1.644373e+07 1.003266e+07 1.847510e+07 1.065975e+07 1.758440e+07 9.875839e+06 1.076353e+07 7.440996e+06 1.431369e+07 2.270020e+07 8.683102e+06 1.224052e+07 1.616105e+07 1.802884e+07 1.801864e+07 1.914385e+07 1.147607e+07 1.332581e+07 1.356752e+07 1.531205e+07 2.641552e+07 1.225763e+07 1.170711e+07 2.066596e+07 9.985498e+06 1.675536e+07 1.232961e+07 1.198088e+07 1.343260e+07 1.237738e+07 7.889097e+06 1.550749e+07 1.066990e+07 9.642404e+06 1.569072e+07 1.332610e+07 1.399414e+07 8.245876e+06 1.279458e+07 1.626754e+07 1.086307e+07 2.508502e+07 1.369337e+07 1.488773e+07 1.594202e+07 1.028914e+07 1.017454e+07 1.462307e+07 1.826261e+07 1.734201e+07 2.078067e+07 1.336778e+07 1.669567e+07 1.395374e+07 8.049894e+06 1.722441e+07 1.016520e+07 1.186816e+07 1.779025e+07 1.443971e+07 1.676506e+07 1.430043e+07 1.506376e+07 1.224948e+07 2.029787e+07 1.591298e+07 1.955973e+07 1.830586e+07 7.812981e+06 2.627706e+07 1.822055e+07 1.380117e+07 2.750304e+07 1.264584e+07 1.508114e+07 1.530657e+07 1.505798e+07 1.246770e+07 1.367611e+07 1.450632e+07 1.652192e+07 1.723696e+07 1.489824e+07 1.622895e+07 3.030229e+07 2.129146e+07 1.682219e+07 1.311090e+07 1.174370e+07 1.939797e+07 1.448554e+07 1.095036e+07 1.462876e+07 8.047089e+06 2.196435e+07 1.077752e+07 3.955905e+07 1.593904e+07 1.756013e+07 1.225025e+07 1.516456e+07 1.304911e+07 1.009365e+07 9.361569e+06 1.562629e+07 1.578617e+07 1.150079e+07 2.284407e+07 1.413647e+07 1.396157e+07 1.234015e+07 1.148486e+07 1.986669e+07 5.913207e+06 9.360393e+06 1.190122e+07 1.073940e+07 1.529206e+07 1.530262e+07 8.730975e+06 1.204638e+07 1.164281e+07 2.415178e+07 9.977341e+06 1.372573e+07 1.514625e+07 9.839202e+06 1.278323e+07 1.790660e+07 1.204985e+07 1.775455e+07 1.587596e+07 1.375963e+07 1.314009e+07 1.902360e+07 1.518750e+07 1.570260e+07 1.891776e+07 1.274103e+07 1.367948e+07 1.124129e+07 1.143199e+07 1.407012e+07 1.178280e+07 2.028423e+07 1.768002e+07 1.163606e+07 1.965494e+07 1.023772e+07 1.436783e+07 1.102299e+07 1.722055e+07 1.066169e+07 1.209162e+07 1.506964e+07 2.541785e+07 1.263792e+07 1.449147e+07 7.327419e+06 1.379813e+07 1.461624e+07 2.925311e+07 2.184449e+07 1.025191e+07 1.639934e+07 1.220926e+07 1.480716e+07 1.390845e+07 1.943407e+07 2.621659e+07 C6 H7 N O_1.969 4.235389e+05 7.522014e+05 8.025757e+05 9.776601e+05 5.331685e+04 5.819550e+05 7.216502e+05 7.509701e+05 74638.93 7.364724e+05 9.145488e+05 8.138837e+05 169599.23 7.029283e+05 8.082287e+05 8.407990e+05 4.781050e+04 6.700600e+05 8.031734e+05 7.527774e+05 2.304810e+05 6.798723e+05 8.205245e+05 8.570294e+05 67692.390 7.615496e+05 7.280391e+05 9.120139e+05 4.562449e+04 6.761372e+05 7.308330e+05 7.779043e+05 136503.88 7.994289e+05 7.790323e+05 7.338222e+05 1.069420e+05 8.228293e+05 7.388492e+05 7.772781e+05 6.025843e+04 7.330945e+05 8.371036e+05 9.483344e+05 5.244100e+04 5.874216e+05 7.975758e+05 7.626725e+05 5.727229e+05 7.550181e+05 4.336957e+05 6.631219e+05 4.881324e+05 5.759187e+05 5.698701e+05 6.278781e+05 8.376234e+05 7.652297e+05 8.151393e+05 7.330785e+05 8.821185e+05 6.836591e+05 7.674942e+05 9.262326e+05 8.577306e+05 9.873774e+05 1.020354e+06 8.500769e+05 6.965782e+05 7.821123e+05 8.865694e+05 9.021843e+05 8.495284e+05 1.844313e+06 9.000194e+05 8.823969e+05 9.047794e+05 9.865595e+05 1.187043e+05 8.547958e+05 7.906332e+05 7.924987e+05 9.294579e+05 7.922162e+05 9.217755e+05 7.863231e+05 5.767926e+05 7.207485e+05 9.328620e+05 9.947213e+05 1.168863e+06 7.238718e+05 1.117163e+06 8.648104e+05 1.178337e+06 9.260361e+05 1.478568e+06 6.931641e+05 7.404795e+05 7.237098e+05 8.306875e+05 8.610655e+05 5.901208e+05 1.037296e+06 1.209911e+06 1.164521e+06 9.281847e+05 1.274512e+06 8.848212e+05 7.593461e+05 7.814490e+05 1.710986e+06 1.037940e+06 1.086070e+06 8.194460e+05 7.916511e+05 9.593490e+05 7.084331e+05 8.424795e+05 9.793707e+05 7.047988e+05 6.780706e+05 6.521321e+05 7.130291e+05 8.756402e+05 8.676115e+05 1.546671e+06 6.424588e+05 6.998822e+05 7.671715e+05 1.056684e+06 3.589334e+05 8.363967e+05 6.160503e+05 5.860006e+05 8.627075e+05 1.127043e+06 9.770982e+05 7.384385e+05 9.586632e+05 6.331600e+05 1.012841e+06 9.321476e+05 6.816461e+05 6.524170e+05 7.760432e+05 8.446402e+05 9.941646e+05 9.193970e+05 1.827952e+06 1.067395e+06 1.903456e+06 1.405263e+06 1.024321e+06 6.581856e+05 9.037882e+05 1.810064e+06 1.575222e+06 2.090768e+06 9.679506e+05 1.149662e+06 1.038510e+06 5.439604e+05 4.649405e+05 5.978663e+05 4.742465e+05 4.523927e+05 5.861238e+05 4.346880e+05 5.481204e+05 5.261323e+05 5.191986e+05 6.397796e+05 6.217373e+05 8.032072e+05 6.571161e+05 7.769300e+05 9.247506e+05 1.109395e+06 6.992034e+05 1.098995e+06 3.089046e+05 5.887309e+05 9.047440e+05 4.203167e+05 5.322046e+05 5.928979e+05 6.384316e+05 1.180643e+06 5.786282e+05 1.182735e+06 7.445921e+05 6.055393e+05 8.334519e+05 1.126236e+06 5.887888e+05 1.260780e+06 9.823800e+05 5.035790e+05 1.394332e+06 1.564536e+06 1.354449e+06 6.985916e+05 6.596557e+05 5.734243e+05 5.194237e+05 6.595333e+05 5.033810e+05 9.161670e+05 5.058420e+05 8.481151e+05 7.169450e+05 6.821743e+05 5.582768e+05 5.256442e+05 7.193750e+05 1.855183e+06 9.412125e+05 6.124647e+05 6.491877e+05 8.050980e+05 5.270989e+05 4.728595e+05 7.719437e+05 7.774971e+05 1.029179e+06 9.906757e+05 5.962888e+05 8.674293e+05 6.076248e+05 8.274391e+05 7.821436e+05 8.383273e+05 6.437094e+05 8.281333e+05 6.923515e+05 9.299895e+05 7.191937e+05 7.683572e+05 9.171515e+05 1.026162e+06 1.055365e+06 5.024621e+06 1.198361e+06 9.151623e+05 1.131936e+06 1.397969e+06 1.108598e+06 1.141119e+06 1.596988e+06 1.084197e+06 8.894574e+05 1.131145e+06 9.738787e+05 2.231107e+06 6.779702e+05 7.518971e+05 6.882483e+05 5.720326e+05 4.646199e+05 1.306108e+06 1.034628e+06 C45 H76 N O P3_1.969 6.343179e+06 2.976246e+06 2.969254e+06 2.930956e+06 7.029815e+04 2.748372e+06 2.902375e+06 3.268881e+06 79686.82 2.832028e+06 3.098176e+06 3.328289e+06 73632.14 2.513991e+06 2.871975e+06 2.918889e+06 5.770974e+04 2.830413e+06 2.944043e+06 2.962575e+06 1.203875e+05 2.828021e+06 3.015971e+06 3.830624e+06 69589.089 2.450584e+06 2.754763e+06 2.860250e+06 6.256247e+04 2.834603e+06 2.832666e+06 3.682994e+06 97884.54 2.659427e+06 2.697862e+06 2.874631e+06 8.504503e+04 2.701792e+06 3.242354e+06 3.081203e+06 6.990692e+04 2.762279e+06 3.071716e+06 3.588084e+06 3.452575e+04 2.236725e+06 3.017992e+06 2.903292e+06 1.756733e+06 1.687696e+06 1.185216e+06 2.855624e+06 4.036951e+06 2.195373e+06 3.889375e+06 3.740611e+06 2.372911e+06 2.629213e+06 7.704318e+06 2.817667e+06 5.313528e+06 4.960813e+06 3.381582e+06 4.364927e+06 3.010982e+06 2.138293e+06 2.866229e+06 3.703134e+06 3.418398e+06 1.197624e+06 3.095982e+06 2.362111e+06 2.040795e+06 3.299653e+06 3.916347e+06 2.118730e+06 2.485963e+06 3.153048e+06 2.327060e+06 2.514934e+06 4.999727e+06 2.129127e+06 2.652334e+06 2.983247e+06 1.758868e+06 2.577282e+06 2.727653e+06 2.944109e+06 2.787658e+06 1.986491e+06 5.535059e+06 2.036454e+06 2.900247e+06 2.850606e+06 3.974607e+06 2.453327e+06 2.404129e+06 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1.788420e+06 2.852707e+06 4.909729e+06 3.381647e+06 3.014341e+06 2.265903e+06 1.913587e+06 2.643446e+06 2.179262e+06 2.756451e+06 2.815675e+06 C6 H7 N2 O16 P3 S_1.969 5.428533e+04 9.938021e+06 9.008793e+06 9.364873e+06 5.986087e+04 7.592941e+06 1.123592e+07 1.111027e+07 77713.17 6.734705e+06 9.529571e+06 9.845115e+06 82722.17 8.251677e+06 8.651092e+06 9.838224e+06 6.178852e+04 8.939114e+06 9.986782e+06 9.084403e+06 1.200482e+05 8.326611e+06 9.076945e+06 1.064133e+07 60883.817 9.504326e+06 8.305732e+06 9.787256e+06 4.823545e+04 8.574737e+06 9.239993e+06 1.060092e+07 72894.51 9.604976e+06 7.837396e+06 9.160904e+06 6.172481e+04 8.927449e+06 9.830696e+06 9.593731e+06 5.235891e+04 7.817354e+06 1.030907e+07 1.144556e+07 2.335150e+04 7.094221e+06 9.208098e+06 9.298329e+06 7.921211e+06 3.889064e+06 1.286659e+06 4.517699e+06 3.719245e+06 4.573234e+06 3.152794e+06 3.499886e+06 2.659611e+06 3.943162e+06 1.977306e+06 7.646016e+06 4.001122e+06 3.012218e+06 3.759652e+06 1.928348e+06 6.925975e+06 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6.384038e+06 4.018317e+06 4.677341e+06 6.027229e+06 8.938006e+06 7.639585e+06 5.209247e+06 5.586574e+06 5.254645e+06 4.820515e+06 3.520982e+06 3.494689e+06 2.794531e+06 3.579435e+06 3.511404e+06 2.896646e+06 2.666815e+06 3.668856e+06 1.972273e+06 3.078365e+06 3.723452e+06 3.199715e+06 2.195468e+06 5.004054e+06 3.269443e+06 4.242603e+06 3.450918e+06 3.443768e+06 4.591683e+06 4.457096e+06 4.327733e+06 3.400023e+06 4.982316e+06 8.663266e+06 2.476267e+06 3.575338e+06 4.089820e+06 6.430519e+06 1.111172e+07 6.852949e+05 5.718819e+05 7.092928e+06 2.843718e+06 2.474296e+06 1.155107e+06 1.229814e+06 5.137834e+06 1.175441e+06 4.111664e+06 2.703984e+06 1.776661e+06 1.682411e+06 8.741814e+06 4.539161e+06 4.713344e+06 6.538673e+06 1.715679e+06 5.508666e+06 7.119970e+06 6.043970e+06 6.663727e+05 2.398741e+06 2.173318e+06 4.012983e+06 2.063228e+06 1.586500e+06 1.470423e+06 1.424059e+06 2.318172e+06 1.141918e+06 1.088889e+06 1.396760e+06 2.622803e+06 1.642186e+06 6.913085e+06 1.221944e+06 3.408255e+06 2.149211e+06 2.993600e+06 2.542684e+06 1.560898e+06 9.637500e+05 2.166132e+06 2.406613e+06 1.517787e+06 1.748601e+06 1.981721e+06 2.951902e+06 1.849293e+06 1.492632e+06 1.864288e+06 2.658216e+06 1.255512e+06 2.093198e+06 1.785128e+06 1.756626e+06 3.539265e+06 3.662607e+06 2.406251e+06 4.293736e+06 4.544054e+06 2.920384e+06 5.799983e+06 4.899084e+06 2.783734e+06 1.729518e+06 2.378728e+06 5.498833e+06 5.865070e+06 3.265520e+06 6.595173e+06 3.112969e+06 3.831526e+06 3.824267e+06 3.176445e+06 2.527603e+06 1.775830e+06 5.124188e+06 2.955687e+06 2.045208e+06 1-(1Z-octadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine_1.969 2.034437e+07 1.360515e+07 1.463269e+07 1.391644e+07 7.336010e+04 1.217119e+07 1.429450e+07 1.569943e+07 79512.90 1.333661e+07 1.372656e+07 1.498928e+07 71677.94 1.276218e+07 1.400569e+07 1.433808e+07 5.615299e+04 1.316227e+07 1.380244e+07 1.434038e+07 1.209508e+05 1.222316e+07 1.500905e+07 1.582882e+07 69632.872 1.298539e+07 1.356139e+07 1.289613e+07 6.067998e+04 1.398106e+07 1.318968e+07 1.658099e+07 93232.43 1.311271e+07 1.349562e+07 1.295859e+07 7.768764e+04 1.309803e+07 1.513694e+07 1.424261e+07 6.717332e+04 1.277046e+07 1.496151e+07 1.708424e+07 3.266150e+04 1.037494e+07 1.404994e+07 1.384736e+07 1.349093e+07 1.369224e+07 4.407459e+06 2.602880e+07 8.928737e+06 1.135870e+07 1.487907e+07 2.143226e+07 1.741564e+07 1.610149e+07 2.167047e+07 1.649669e+07 1.152845e+07 2.156687e+07 2.598692e+07 2.099822e+07 1.303590e+07 2.014012e+07 9.192967e+06 1.425219e+07 2.377553e+07 2.202714e+07 1.267707e+07 1.899160e+07 2.176362e+07 1.064212e+07 1.982515e+07 1.699540e+07 1.485552e+07 1.118834e+07 1.145760e+07 1.429039e+07 1.088999e+07 1.201644e+07 9.686110e+06 2.140713e+07 1.078661e+07 1.218310e+07 1.729785e+07 1.880692e+07 9.530270e+06 4.281640e+06 1.657621e+07 1.001419e+07 1.755013e+07 7.153493e+06 1.520824e+07 7.285329e+06 1.640503e+07 1.045849e+07 9.134397e+06 6.643691e+06 1.856010e+07 1.728200e+07 7.074385e+06 9.486118e+06 1.858630e+07 1.669720e+07 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1.834708e+07 2.615449e+07 402.73529_1.969 6.025758e+06 8.422292e+05 8.865942e+05 1.111552e+06 9.460038e+04 8.816347e+05 1.171339e+06 7.300406e+05 79086.91 8.075210e+05 1.356342e+06 7.323402e+05 68586.73 1.158345e+06 9.356170e+05 8.069577e+05 4.363978e+04 9.836562e+05 7.963336e+05 8.560576e+05 8.407051e+04 1.373522e+06 1.070534e+06 9.408591e+05 44846.761 6.681239e+05 1.041131e+06 9.539576e+05 3.101076e+04 7.831919e+05 1.058898e+06 9.352270e+05 37734.33 1.108380e+06 8.504058e+05 8.506647e+05 3.134401e+04 1.135258e+06 9.450001e+05 7.625798e+05 2.689725e+04 1.219685e+06 8.792010e+05 1.053303e+06 1.518033e+04 8.321932e+05 1.084171e+06 8.588178e+05 1.078270e+06 1.036924e+06 2.981198e+05 1.555954e+06 4.902513e+05 9.909283e+05 1.145496e+06 1.324462e+06 1.396170e+06 1.200850e+06 1.035468e+06 9.881040e+05 7.936848e+05 1.778364e+06 1.121491e+06 1.240393e+06 6.032870e+05 1.710002e+06 6.683564e+05 1.174999e+06 2.287483e+06 2.503417e+06 4.639482e+05 1.746097e+06 1.632097e+06 5.561288e+05 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1.382779e+06 1.915520e+06 1.181254e+06 6.385675e+05 2.346012e+06 9.144008e+05 3.555250e+06 1.564373e+06 3.740454e+06 2.257217e+06 1.906356e+06 6.281490e+05 2.653302e+06 7.881948e+05 1.342792e+06 8.887335e+05 1.414512e+06 1.555407e+06 2.064292e+06 2.169075e+06 2.294449e+06 1.669574e+06 1.033598e+06 3.397896e+06 1.540364e+06 1.196779e+06 3.477937e+06 1.990855e+06 1.154831e+06 1.634538e+06 1.531146e+06 8.780638e+05 1.638601e+06 1.772994e+06 1.932913e+06 1.314275e+06 9.482200e+05 1.237787e+06 2.517241e+06 1.237405e+06 1.697372e+06 1.259706e+06 C42 H84 N O P3 S_1.969 1.582189e+07 8.130920e+06 7.830383e+06 8.173946e+06 1.063560e+05 6.199382e+06 8.120856e+06 8.530502e+06 115673.31 7.542585e+06 7.848026e+06 8.631041e+06 104866.55 7.075454e+06 7.821687e+06 7.575399e+06 8.366994e+04 7.578168e+06 7.703717e+06 8.150457e+06 1.819699e+05 6.902008e+06 8.862512e+06 8.376052e+06 106651.082 6.934755e+06 7.574386e+06 7.705520e+06 9.205525e+04 7.774658e+06 7.371848e+06 9.666052e+06 143810.93 7.427579e+06 6.834724e+06 7.036377e+06 1.210938e+05 7.440713e+06 8.754902e+06 8.223513e+06 1.030603e+05 6.890154e+06 8.679412e+06 9.271388e+06 5.024874e+04 5.671986e+06 8.157200e+06 7.635321e+06 5.397920e+06 6.250236e+06 3.599911e+06 5.195637e+06 7.397357e+06 5.599983e+06 8.466848e+06 1.069286e+07 8.669320e+06 7.898110e+06 1.448671e+07 8.125644e+06 1.174564e+07 1.296945e+07 1.036956e+07 1.424894e+07 5.207822e+06 5.538733e+06 7.121257e+06 8.068915e+06 8.267503e+06 6.761505e+06 9.166742e+06 8.472458e+06 6.533626e+06 6.591768e+06 1.092956e+07 7.078940e+06 4.617591e+06 9.166640e+06 6.378345e+06 6.696036e+06 9.319796e+06 4.714992e+06 5.030205e+06 8.322478e+06 4.318099e+06 5.795805e+06 5.584879e+06 8.577466e+06 5.222313e+06 5.292076e+06 9.920441e+06 5.928629e+06 6.094081e+06 1.056467e+07 7.873543e+06 6.667344e+06 8.380339e+06 5.130454e+06 5.757490e+06 4.016453e+06 8.493540e+06 1.383925e+07 5.027840e+06 6.443060e+06 3.528317e+06 7.553016e+06 8.118639e+06 1.053123e+07 8.505599e+06 6.843885e+06 5.602789e+06 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1.123311e+07 6.998626e+06 1.072417e+07 6.607922e+06 5.149192e+06 1.200546e+07 5.513454e+06 4.844540e+06 8.874622e+06 6.945514e+06 4.928770e+06 8.800848e+06 6.869908e+06 5.902647e+06 7.803366e+06 6.316626e+06 1.231309e+07 4.707008e+06 4.913990e+06 6.868760e+06 4.822283e+06 6.687270e+06 4.492454e+06 3.497384e+06 6.308642e+06 6.144081e+06 8.268482e+06 6.750117e+06 7.240357e+06 6.237061e+06 4.321547e+06 6.196304e+06 7.047849e+06 7.935617e+06 6.523407e+06 6.459780e+06 7.101769e+06 5.771020e+06 9.903956e+06 8.252250e+06 1.366837e+07 9.719982e+06 6.812666e+06 4.627033e+06 8.041812e+06 4.716484e+06 6.706855e+06 4.803760e+06 9.448390e+06 7.277355e+06 8.608479e+06 1.014626e+07 7.919452e+06 8.519891e+06 5.328463e+06 1.251504e+07 6.247989e+06 5.228841e+06 9.332101e+06 1.062425e+07 5.951976e+06 6.773078e+06 5.436559e+06 5.357348e+06 7.110676e+06 1.193931e+07 9.784622e+06 7.089134e+06 5.524716e+06 5.462053e+06 9.062671e+06 6.462504e+06 9.875560e+06 1.261034e+07 1-(1Z-hexadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine_1.97 1.274324e+07 9.621606e+06 1.025123e+07 9.935162e+06 3.666971e+04 8.578603e+06 1.035709e+07 1.105124e+07 39449.50 9.446660e+06 9.909527e+06 1.099061e+07 35982.46 9.006966e+06 9.889286e+06 9.550015e+06 2.849796e+04 8.814247e+06 1.086487e+07 9.535855e+06 5.981033e+04 8.902204e+06 1.021874e+07 1.280697e+07 34166.804 8.691385e+06 9.144170e+06 9.587388e+06 3.108495e+04 9.780223e+06 8.819998e+06 1.185184e+07 49006.72 9.451776e+06 9.484731e+06 9.056114e+06 4.052764e+04 9.563276e+06 1.075499e+07 1.051326e+07 3.477064e+04 8.608749e+06 1.097055e+07 1.201667e+07 1.681155e+04 7.062313e+06 9.867623e+06 1.007225e+07 8.714928e+06 8.219836e+06 2.290461e+06 2.332668e+07 7.821074e+06 7.014807e+06 1.126061e+07 1.378407e+07 1.171947e+07 1.165246e+07 1.765430e+07 9.280653e+06 6.516896e+06 1.067802e+07 2.339259e+07 1.598513e+07 1.058564e+07 1.953957e+07 6.466836e+06 8.582076e+06 2.085062e+07 1.769198e+07 9.041888e+06 1.344624e+07 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3.557801e+06 2.729958e+06 2.787233e+06 3.704350e+06 3.963237e+06 2.487251e+06 2.458048e+06 2.834650e+06 1.354865e+07 5.522940e+06 2.489621e+06 3.045165e+06 4.010811e+06 2.320607e+06 2.598271e+06 4.103916e+06 2.663735e+06 4.382922e+06 4.002491e+06 2.350506e+06 4.998889e+06 3.730497e+06 4.541471e+06 2.299050e+06 2.746612e+06 3.156144e+06 3.065717e+06 3.187755e+06 3.671927e+06 3.266202e+06 3.303753e+06 7.094640e+06 7.390634e+06 8.564148e+06 7.196024e+06 1.067646e+07 7.493219e+06 9.440067e+06 1.294019e+07 9.769950e+06 7.757586e+06 1.219867e+07 8.411957e+06 5.891446e+06 6.979548e+06 8.517809e+06 1.535165e+07 4.619816e+06 5.999086e+06 4.519219e+06 1.889131e+06 1.509461e+06 1.014592e+07 9.621997e+06 C14 H7 N2 O5 P3_1.97 5.754139e+04 1.883825e+05 1.129021e+05 3.186922e+05 4.831299e+04 1.113142e+05 2.532077e+05 1.683470e+05 46659.37 1.198925e+05 1.624494e+05 1.120759e+05 42233.16 1.277554e+05 9.308465e+04 1.619364e+05 3.065641e+04 1.401833e+05 1.520225e+05 9.066607e+04 6.096118e+04 1.315602e+05 1.427676e+05 1.667478e+05 31304.524 1.029299e+05 1.432404e+05 1.296603e+05 2.636004e+04 1.416357e+05 1.254723e+05 1.405285e+05 46892.44 1.598341e+05 9.663769e+04 1.407891e+05 4.589765e+04 1.200453e+05 1.362480e+05 1.283279e+05 3.647357e+04 1.160112e+05 1.309136e+05 1.734748e+05 1.388701e+04 5.327287e+04 1.093617e+05 1.399691e+05 2.067977e+05 5.366210e+05 6.199533e+04 9.983113e+04 7.887832e+04 4.962417e+05 6.405122e+04 5.177543e+04 2.017436e+05 7.742583e+04 1.124622e+05 2.120842e+05 1.559285e+05 5.281487e+04 2.175368e+05 1.046239e+05 1.326476e+05 1.087916e+05 1.748209e+05 8.116380e+04 7.856455e+04 1.325770e+05 1.076667e+05 7.096700e+04 9.173638e+04 9.019285e+04 1.240185e+05 6.685749e+04 9.989063e+04 8.616854e+04 4.574931e+04 9.836354e+04 7.785681e+04 8.335021e+04 1.025251e+05 8.658046e+04 7.476526e+04 8.217112e+04 5.320305e+04 7.750461e+04 1.864757e+05 6.570991e+04 1.478411e+05 1.033238e+05 1.447919e+05 7.259475e+04 7.147672e+04 7.141976e+04 1.172314e+05 7.643958e+04 7.839489e+04 8.436665e+04 8.105514e+04 7.320451e+04 6.560549e+04 9.676849e+04 9.369419e+04 7.695117e+04 1.340163e+05 7.391162e+04 6.206596e+04 6.455640e+04 7.620327e+04 7.585960e+04 6.741361e+04 6.771565e+04 7.623633e+04 9.033609e+04 9.929782e+04 8.138839e+04 6.346009e+04 1.013288e+05 5.807121e+04 6.176873e+04 5.734852e+04 6.746706e+04 7.174737e+04 7.748833e+04 1.081719e+05 5.240327e+04 8.048301e+04 9.340919e+04 6.903216e+04 6.735601e+04 5.272641e+04 7.207192e+04 8.403957e+04 7.569245e+04 6.075081e+04 6.831499e+04 6.320107e+04 6.447007e+04 5.937826e+04 7.954267e+04 7.697380e+04 5.063728e+04 8.299719e+04 6.826941e+04 7.443456e+04 8.203667e+04 8.786538e+04 1.090805e+05 8.618323e+04 8.519221e+04 8.253292e+04 8.500134e+04 5.726277e+04 8.230334e+04 1.119798e+05 9.813136e+04 7.209607e+04 7.312681e+04 7.032755e+04 7.669066e+04 1.935675e+05 4.048873e+05 9.517079e+05 5.681242e+05 3.579010e+05 4.957709e+05 2.401776e+05 7.698673e+05 4.229845e+05 3.534988e+05 4.601827e+05 4.320582e+05 5.022662e+05 1.239849e+05 8.470482e+04 9.546469e+04 8.580002e+04 7.997031e+04 2.844397e+05 6.610135e+05 1.288004e+06 9.960987e+04 7.203252e+04 4.246959e+05 8.321165e+05 5.803616e+04 4.961277e+05 7.369420e+05 3.510026e+05 1.065635e+05 5.642692e+05 1.545778e+05 7.635328e+05 1.071839e+05 1.588732e+06 2.332520e+05 6.476550e+04 8.648229e+04 4.512206e+05 2.225540e+05 9.041606e+05 5.813492e+05 5.958699e+05 2.975894e+05 2.656353e+05 1.090334e+05 9.686248e+05 4.374373e+05 1.043268e+05 1.340685e+06 1.485041e+05 1.035858e+06 1.515718e+05 7.724805e+05 1.396589e+06 3.000869e+05 6.252151e+05 3.403628e+05 2.078115e+06 9.104244e+05 9.976818e+04 6.882838e+04 1.366706e+05 1.287520e+06 2.550390e+05 7.740240e+04 2.960522e+05 1.597137e+05 7.887482e+04 1.284166e+06 1.559481e+05 1.397616e+05 2.273832e+05 2.660838e+05 8.806241e+05 8.317562e+04 1.723490e+05 1.048933e+05 8.371024e+04 7.652356e+05 1.072292e+05 3.099167e+05 1.255099e+05 7.208031e+04 7.527083e+04 9.537275e+04 8.900949e+04 1.809998e+05 9.572378e+04 6.960257e+04 8.705443e+04 8.048636e+04 1.466923e+05 7.553296e+04 7.456034e+04 8.463637e+04 1.149177e+05 1.386074e+05 2.851981e+05 5.874999e+05 744.55007_1.97 2.369865e+06 9.127639e+05 1.216626e+06 1.112888e+06 3.381257e+04 9.259789e+05 1.128349e+06 1.050120e+06 37338.82 1.015911e+06 1.035881e+06 1.217958e+06 32883.00 1.015902e+06 1.014464e+06 1.083161e+06 2.614254e+04 1.005255e+06 1.143449e+06 1.021565e+06 5.968568e+04 9.576242e+05 1.208344e+06 9.175803e+05 35536.478 9.660372e+05 1.187109e+06 1.148887e+06 3.014443e+04 1.133064e+06 8.289257e+05 1.207190e+06 48798.84 1.021553e+06 9.637464e+05 1.020235e+06 3.972877e+04 1.061063e+06 1.071367e+06 1.143971e+06 3.367524e+04 9.993708e+05 1.155182e+06 1.347777e+06 1.673054e+04 6.640809e+05 1.069292e+06 1.081983e+06 5.441198e+05 5.733875e+05 5.440183e+05 4.355386e+05 1.244508e+06 7.383126e+05 1.230479e+06 1.703099e+06 1.307574e+06 8.099552e+05 2.570405e+06 7.836037e+05 1.707675e+06 2.109401e+06 6.697553e+05 2.319891e+06 3.651406e+05 5.283638e+05 1.214818e+06 9.749599e+05 8.004639e+05 2.628835e+05 1.536778e+06 9.995622e+05 5.686599e+05 7.714637e+05 1.408389e+06 8.187140e+05 3.030895e+05 1.201597e+06 1.008712e+06 8.987151e+05 1.318863e+06 7.266295e+05 6.331019e+05 7.657856e+05 5.609095e+05 9.654799e+05 6.026747e+05 1.203221e+06 7.107777e+05 8.685824e+05 1.135556e+06 7.706990e+05 6.142274e+05 2.224101e+06 8.850874e+05 1.612981e+06 1.077291e+06 6.664100e+05 8.118850e+05 4.543122e+05 1.088839e+06 2.208128e+06 1.133468e+06 1.190141e+06 4.910758e+05 7.306806e+05 1.298486e+06 1.728489e+06 1.353355e+06 1.007504e+06 6.293299e+05 1.296712e+06 1.261346e+06 1.939953e+06 6.230794e+05 9.836533e+05 4.813448e+05 8.901652e+05 1.482621e+06 3.286593e+06 6.837168e+05 5.547500e+05 3.630666e+05 1.442567e+06 4.036676e+05 1.503136e+06 1.265256e+06 2.842528e+05 1.211006e+06 2.953799e+05 9.122818e+05 5.204500e+05 1.186860e+06 5.286178e+05 1.058977e+06 6.594650e+05 1.820309e+06 1.993767e+06 1.274143e+06 1.135652e+06 1.232584e+06 1.868726e+06 8.784943e+05 9.031647e+05 1.902291e+06 8.500407e+05 7.918367e+05 1.525960e+06 9.038133e+05 3.413892e+05 9.510976e+05 6.924043e+05 1.433488e+06 1.793815e+06 1.155527e+06 9.844347e+05 8.016953e+05 1.433368e+06 1.184000e+06 8.621045e+05 1.065629e+06 1.306543e+06 8.369980e+05 1.855610e+06 6.914329e+05 7.715428e+05 8.887213e+05 9.381208e+05 8.940042e+05 1.060866e+06 2.241083e+06 1.021785e+06 1.117371e+06 1.005486e+06 1.227689e+06 9.548163e+05 1.497010e+06 9.449236e+05 1.751711e+06 4.775418e+05 3.712451e+05 1.062113e+06 1.490748e+06 9.238218e+05 4.452307e+05 3.603160e+05 1.672531e+06 3.666553e+05 4.209771e+05 6.407593e+05 1.627483e+06 9.185566e+05 3.550138e+05 2.541512e+06 8.020798e+05 1.279377e+06 1.794808e+06 1.129018e+06 6.440793e+05 4.709965e+05 1.563800e+06 7.784123e+05 1.483688e+06 8.503376e+05 2.877173e+06 9.038346e+05 4.971488e+05 1.150695e+06 5.940134e+05 6.430758e+05 4.786714e+05 2.974002e+05 8.239194e+05 9.478955e+05 7.017052e+05 9.414053e+05 8.635345e+05 5.960166e+05 9.198811e+05 7.271602e+05 7.520911e+05 1.125459e+06 5.390121e+05 6.172800e+05 1.038644e+06 5.301187e+05 2.104768e+06 1.476415e+06 2.709066e+06 1.209049e+06 1.121006e+06 3.678959e+05 1.692017e+06 4.300961e+05 7.669549e+05 5.635939e+05 1.007278e+06 1.098541e+06 1.445950e+06 1.132299e+06 1.793987e+06 1.113348e+06 4.599601e+05 1.772793e+06 8.880098e+05 7.368102e+05 1.804128e+06 1.143986e+06 7.629871e+05 7.592504e+05 8.921338e+05 6.921086e+05 7.281195e+05 9.946827e+05 1.249158e+06 9.968794e+05 6.506370e+05 8.888174e+05 1.577596e+06 7.817290e+05 1.492333e+06 9.782646e+05 C H N5 O16 P2_1.97 6.252946e+04 1.218122e+06 1.397689e+06 1.529626e+06 6.510216e+04 1.127563e+06 1.375561e+06 1.347966e+06 62063.09 1.273274e+06 1.372591e+06 1.302197e+06 55445.33 1.640563e+06 1.300578e+06 1.292373e+06 4.318960e+04 1.175411e+06 1.289829e+06 1.322770e+06 8.719952e+04 1.291883e+06 1.434929e+06 1.660227e+06 47448.236 1.168564e+06 1.314951e+06 1.285075e+06 4.170038e+04 1.308287e+06 1.279669e+06 1.471323e+06 62745.25 1.368522e+06 1.176300e+06 1.333656e+06 5.508153e+04 1.422933e+06 1.434174e+06 1.261875e+06 4.392832e+04 1.167632e+06 1.466995e+06 1.739320e+06 2.242056e+04 1.012065e+06 1.202343e+06 1.434547e+06 1.654983e+06 7.592535e+05 5.209859e+05 2.733804e+06 1.677907e+06 5.937909e+05 1.396257e+06 2.239768e+06 1.167755e+06 1.681846e+06 9.693734e+05 1.299395e+06 2.115212e+06 1.589492e+06 1.594092e+06 8.980440e+05 3.589864e+06 1.992860e+06 1.448770e+06 1.579832e+06 1.242549e+06 1.370243e+06 3.148748e+06 2.090760e+06 1.999081e+06 2.908142e+06 9.287698e+05 3.249549e+06 1.331859e+06 1.588803e+06 6.224396e+04 1.943251e+06 1.661086e+06 1.840397e+06 4.676538e+05 1.711029e+06 1.377226e+06 1.130428e+06 7.038146e+05 8.813864e+05 9.665953e+05 9.667317e+05 2.902346e+06 1.776846e+06 1.040415e+06 1.102793e+06 1.305937e+06 1.622758e+06 1.979149e+06 2.020365e+06 2.133138e+06 1.008093e+06 9.370746e+05 2.293872e+06 1.464910e+06 2.426354e+06 8.548477e+05 7.135625e+05 4.068035e+05 4.104462e+05 8.570168e+05 1.133959e+06 1.767045e+06 5.118487e+05 1.317375e+06 2.521989e+06 2.163627e+06 1.099895e+06 1.161696e+06 3.257514e+06 7.995460e+05 1.271625e+06 1.076863e+06 1.169946e+06 1.532948e+06 1.249254e+06 1.342960e+06 7.557585e+05 1.372521e+06 1.136334e+06 3.557740e+06 1.350012e+06 1.337286e+06 8.184091e+04 9.351819e+05 1.148660e+06 1.318279e+06 1.558105e+06 1.065043e+06 1.640348e+06 1.290522e+06 1.412694e+06 1.008871e+06 1.831407e+06 1.408864e+06 1.042472e+06 1.182184e+06 1.498508e+06 3.093351e+06 2.200386e+06 1.391188e+06 1.498389e+06 1.211996e+06 1.630293e+06 1.099915e+06 1.683239e+06 1.432240e+06 1.707951e+06 1.397132e+06 1.690952e+06 2.091094e+06 1.452879e+06 9.488237e+05 2.246184e+06 8.518382e+05 5.407568e+05 4.667473e+05 8.260834e+05 6.284539e+05 8.688924e+05 6.192820e+05 4.329789e+05 1.005574e+06 8.975585e+05 5.555809e+05 6.417839e+05 1.070942e+06 1.560627e+06 1.472384e+06 1.913269e+06 1.852638e+06 3.099247e+06 6.732476e+06 5.168744e+05 4.208087e+05 2.424695e+06 1.565003e+06 1.733452e+06 7.898521e+05 6.753063e+05 1.112499e+06 4.382025e+05 2.922316e+05 9.771989e+05 7.836475e+05 9.585670e+05 4.808819e+06 7.634199e+05 4.451392e+05 2.933723e+06 6.660368e+05 1.072943e+06 9.916445e+05 2.522249e+06 1.657697e+05 9.749841e+05 1.079187e+06 1.137864e+06 1.288982e+06 9.854625e+05 9.298790e+05 5.791123e+05 1.244941e+06 5.472769e+05 3.713993e+05 7.227885e+05 1.309862e+06 9.573257e+05 6.028434e+05 6.596069e+05 1.410193e+06 8.162313e+05 7.928541e+05 9.758621e+05 7.068105e+05 5.726115e+05 1.042077e+06 2.462324e+06 6.529456e+05 1.565280e+06 1.175001e+06 9.579587e+05 1.408201e+06 1.208676e+06 8.417045e+05 1.291582e+06 7.596763e+05 9.178560e+05 8.741623e+05 9.415606e+05 1.019136e+06 1.453875e+06 1.481321e+06 1.183642e+06 1.567015e+06 9.682454e+05 1.358360e+06 1.546838e+06 1.683157e+06 4.140771e+05 8.536577e+05 1.552578e+06 1.299623e+06 1.443881e+06 1.157398e+06 1.184910e+06 2.016838e+06 1.339846e+06 1.319359e+06 1.033698e+06 1.030076e+06 2.381754e+06 7.189737e+05 7.661113e+05 1-hexadecanoyl-2-[(Z)-octadec-9-enoyl]-sn-glycerol 3-(2-aminoethylphosphonate)_1.971 1.363338e+07 1.017749e+07 1.064263e+07 1.032904e+07 7.282305e+04 8.892431e+06 1.083260e+07 1.164533e+07 78288.90 9.861874e+06 1.029228e+07 1.138237e+07 75995.78 9.481119e+06 1.036346e+07 9.866447e+06 5.669507e+04 9.233030e+06 1.139981e+07 9.987268e+06 1.192076e+05 9.365953e+06 1.070689e+07 1.313038e+07 68389.187 9.107407e+06 9.653873e+06 9.942629e+06 6.193111e+04 1.028086e+07 9.241709e+06 1.226592e+07 97235.97 9.939038e+06 9.942246e+06 9.511834e+06 8.043280e+04 1.000200e+07 1.112082e+07 1.098606e+07 6.911044e+04 8.982120e+06 1.146894e+07 1.260655e+07 3.338909e+04 7.369061e+06 1.028680e+07 1.051506e+07 9.144868e+06 8.790650e+06 2.382942e+06 2.420048e+07 8.058426e+06 7.265250e+06 1.176797e+07 1.447774e+07 1.231877e+07 1.222718e+07 1.809621e+07 1.006978e+07 6.970723e+06 1.125105e+07 2.425982e+07 1.654285e+07 1.088933e+07 2.020277e+07 6.843020e+06 8.931850e+06 2.141931e+07 1.824857e+07 9.432620e+06 1.420510e+07 1.542310e+07 6.159544e+06 1.413491e+07 1.360765e+07 1.193131e+07 6.284403e+06 8.760272e+06 1.214739e+07 1.039681e+07 8.817250e+06 6.662120e+06 2.044596e+07 6.649133e+06 8.641420e+06 1.397072e+07 1.904351e+07 6.534152e+06 2.998557e+06 1.538408e+07 8.343829e+06 1.515492e+07 5.473068e+06 1.532734e+07 6.095662e+06 1.569146e+07 6.504395e+06 6.387511e+06 3.769067e+06 1.307199e+07 1.402232e+07 4.988536e+06 7.136446e+06 1.399219e+07 1.044115e+07 1.408773e+07 1.250814e+07 6.144414e+06 1.248775e+07 8.591393e+06 1.485079e+07 2.382291e+07 5.992048e+06 8.469928e+06 1.492995e+07 8.897161e+06 1.084709e+07 1.051648e+07 5.510284e+06 1.057924e+07 7.887099e+06 5.167307e+06 1.207292e+07 1.122668e+07 4.137288e+06 7.536954e+06 1.393177e+07 7.348391e+06 5.005496e+06 6.825958e+06 9.788504e+06 6.648131e+06 2.850562e+07 1.143363e+07 1.016267e+07 7.282917e+06 5.917159e+06 8.770414e+06 9.658816e+06 1.780877e+07 9.211656e+06 2.047058e+07 9.145436e+06 1.193589e+07 7.823423e+06 3.481362e+06 1.064479e+07 5.520083e+06 1.172444e+07 1.107272e+07 1.089541e+07 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1.232237e+07 6.025023e+06 9.531627e+06 5.328128e+06 9.353910e+06 1.058933e+07 6.150902e+06 1.664597e+07 1.305705e+07 4.830806e+06 1.183286e+07 6.796665e+06 1.107075e+07 4.964097e+06 1.154088e+07 7.466618e+06 6.843793e+06 8.516277e+06 1.448558e+07 7.580366e+06 8.969009e+06 2.854141e+06 1.130236e+07 9.916080e+06 1.910142e+07 1.466458e+07 6.118944e+06 1.305146e+07 7.088550e+06 1.213729e+07 5.625484e+06 1.263150e+07 1.930365e+07 C49 H71 N O4_1.971 4.397724e+06 2.326115e+06 2.460530e+06 2.716999e+06 3.421135e+04 2.077399e+06 2.444677e+06 2.768615e+06 38002.17 2.348510e+06 2.579242e+06 2.772351e+06 39711.26 2.034240e+06 2.436168e+06 2.267392e+06 2.812622e+04 2.456181e+06 2.520651e+06 2.286622e+06 5.850597e+04 2.261725e+06 2.744987e+06 2.966259e+06 33086.184 2.158210e+06 2.272489e+06 2.234196e+06 3.004074e+04 2.713641e+06 2.239180e+06 2.940069e+06 49882.83 2.396378e+06 1.933955e+06 2.316030e+06 4.193770e+04 2.435556e+06 2.735146e+06 2.673269e+06 3.507986e+04 2.108695e+06 2.554765e+06 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6.340552e+06 8.503829e+06 7.314660e+06 7.822728e+06 5.135581e+06 6.329385e+06 8.133725e+06 6.751097e+06 8.244779e+06 6.052961e+06 6.653726e+06 1.639951e+07 1.011045e+07 6.578519e+06 6.409549e+06 5.759527e+06 9.147183e+06 6.593159e+06 4.396884e+06 7.155766e+06 4.054008e+06 7.905865e+06 5.761310e+06 2.574311e+07 8.251342e+06 8.100351e+06 5.827584e+06 8.618721e+06 5.265784e+06 3.691094e+06 3.532885e+06 7.671717e+06 5.094184e+06 4.737784e+06 1.360527e+07 6.388650e+06 7.237801e+06 5.279735e+06 5.434459e+06 8.738270e+06 2.274095e+06 5.266077e+06 5.239554e+06 5.861496e+06 7.373966e+06 8.113774e+06 3.999952e+06 5.711289e+06 5.451711e+06 1.208029e+07 5.164293e+06 5.987541e+06 7.755774e+06 3.757314e+06 7.053730e+06 9.447285e+06 5.571698e+06 9.841399e+06 8.833437e+06 5.233305e+06 6.805896e+06 6.289006e+06 6.809449e+06 6.198138e+06 9.749024e+06 4.289918e+06 6.706234e+06 3.875733e+06 6.442537e+06 6.212942e+06 5.722880e+06 1.146591e+07 8.275424e+06 4.355419e+06 9.168657e+06 5.828816e+06 8.110829e+06 4.753345e+06 8.644797e+06 5.059124e+06 4.533764e+06 5.904637e+06 1.095005e+07 6.153690e+06 7.330250e+06 2.705764e+06 6.566095e+06 7.515360e+06 1.445989e+07 1.098925e+07 5.053758e+06 8.411043e+06 6.282755e+06 7.578358e+06 4.924828e+06 1.149634e+07 1.590333e+07 C2 H6 N2 O10 P2 S_1.971 4.793038e+04 7.909288e+05 1.036167e+06 1.055048e+06 5.257577e+04 8.844468e+05 1.607212e+06 1.232190e+06 55452.34 7.834893e+05 8.448609e+05 8.704862e+05 49754.97 1.248026e+06 1.014202e+06 1.011666e+06 3.372895e+04 9.395651e+05 1.096113e+06 1.015592e+06 5.931888e+04 1.096096e+06 1.083290e+06 1.013436e+06 28321.181 9.647101e+05 1.074318e+06 1.289297e+06 1.958423e+04 7.071541e+05 9.694700e+05 1.061868e+06 24812.15 1.185571e+06 9.989472e+05 1.024881e+06 1.909205e+04 1.014305e+06 1.035213e+06 1.044403e+06 1.714284e+04 1.107606e+06 9.343061e+05 1.269775e+06 8.706688e+03 8.725975e+05 8.902470e+05 1.141068e+06 7.269048e+05 4.707747e+05 1.419398e+05 4.344154e+05 3.773389e+05 4.784575e+05 3.960763e+05 3.660024e+05 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2.121379e+04 6.802314e+05 9.082763e+05 6.522856e+05 29716.14 1.008663e+06 8.603437e+05 6.025621e+05 2.888473e+04 1.155158e+06 6.638258e+05 6.922504e+05 2.411112e+04 9.507706e+05 8.696438e+05 9.327648e+05 1.935917e+04 7.691057e+05 9.048047e+05 6.820766e+05 6.069109e+05 4.580459e+05 8.207205e+04 5.873513e+05 5.325392e+05 4.884554e+05 1.884949e+05 7.162977e+05 4.416159e+05 1.313739e+05 2.229346e+05 5.980042e+05 2.815142e+05 1.253841e+05 6.862808e+05 1.017740e+05 4.364298e+05 3.864795e+05 5.673552e+05 7.544571e+04 2.892148e+05 6.884627e+05 6.197231e+05 2.409047e+05 6.846775e+05 6.405789e+05 3.090662e+05 6.119132e+05 5.675207e+05 3.050079e+05 3.173073e+04 3.913879e+05 2.916867e+05 4.370132e+05 5.395112e+04 2.768459e+05 1.426755e+05 7.898332e+04 1.069050e+05 9.870659e+04 3.677449e+05 1.271189e+05 1.951787e+05 5.564899e+05 7.747636e+05 2.115691e+05 1.025736e+05 4.789293e+05 5.653689e+05 5.883762e+05 7.572575e+05 5.276070e+05 8.237079e+04 5.712706e+05 6.352893e+05 6.521954e+05 1.592211e+05 1.347123e+05 1.398867e+05 6.234465e+04 1.116899e+05 8.449912e+04 3.835706e+05 7.119785e+04 2.433668e+05 6.353623e+05 5.844175e+05 5.349839e+05 8.741116e+04 8.850446e+05 1.973106e+05 5.631858e+04 1.737423e+05 6.353622e+04 1.220134e+05 2.329544e+05 1.745978e+05 5.551125e+04 2.241236e+05 1.150847e+05 4.280971e+05 4.526914e+05 4.521303e+05 3.361492e+04 8.608897e+04 1.864135e+05 2.949664e+05 3.815775e+05 1.956580e+05 2.406431e+05 4.863848e+05 4.015552e+05 1.128534e+05 3.286868e+05 2.765287e+05 8.054635e+04 3.374746e+05 2.247844e+05 4.847648e+05 3.361460e+05 2.764808e+05 1.007550e+05 9.606461e+04 6.281854e+04 2.529855e+05 1.001755e+05 2.075610e+05 2.756971e+05 9.785318e+04 1.737670e+05 2.733866e+05 1.146074e+05 9.194081e+04 1.077951e+05 3.407258e+05 3.499184e+05 4.812166e+05 5.773525e+05 5.007938e+05 1.385950e+06 2.505024e+05 3.828707e+05 7.528756e+05 7.329818e+05 3.365022e+05 4.803366e+05 6.515496e+05 5.618582e+05 1.022514e+05 2.046327e+05 1.046975e+05 6.277899e+05 6.026630e+05 5.728314e+05 5.697217e+05 2.024088e+05 2.042153e+06 2.502655e+06 1.091179e+06 1.609941e+06 7.872664e+04 9.559354e+05 4.967872e+04 1.585084e+06 1.502836e+06 1.754725e+06 8.622092e+05 1.568966e+06 7.666920e+04 1.857728e+05 6.806197e+05 6.257465e+04 7.335035e+04 2.571802e+05 2.923588e+05 1.434183e+06 2.328499e+06 1.839314e+06 3.157104e+06 1.433685e+06 2.063571e+06 1.281971e+06 1.804688e+06 2.114559e+06 5.669570e+05 1.960866e+06 4.341661e+06 1.382144e+06 1.113440e+05 2.195516e+05 1.350195e+06 2.253349e+06 1.606420e+06 1.605997e+06 1.025164e+06 5.519153e+05 2.426600e+06 1.471128e+06 1.267922e+06 2.786465e+06 1.386122e+06 1.458110e+06 2.762364e+06 2.917735e+06 1.372834e+06 1.476364e+06 1.378566e+06 2.314942e+06 1.983471e+06 1.604595e+06 9.218445e+05 7.366511e+05 6.218599e+05 1.128762e+06 1.439354e+06 7.464442e+05 1.494886e+06 1.979914e+06 7.094326e+05 9.461838e+04 4.491413e+05 9.165394e+05 7.282453e+05 2.821492e+05 1.067025e+06 3.570663e+05 5.253157e+05 3.272342e+05 3.507822e+05 1.384515e+05 5.697256e+05 2.828795e+06 5.987681e+05 5.390616e+05 C35 H37 N3_1.974 1.912418e+05 8.945035e+04 1.394807e+05 8.527657e+04 4.096684e+04 1.813956e+05 8.805148e+04 8.644777e+04 44443.55 1.243672e+05 1.572819e+05 1.183462e+05 66042.45 7.928099e+04 9.542695e+04 1.389453e+05 2.864622e+04 9.315284e+04 1.375401e+05 1.124827e+05 6.171321e+04 1.152263e+05 7.740701e+04 1.682515e+05 34339.860 1.296780e+05 1.102296e+05 7.485715e+04 2.881952e+04 1.290628e+05 9.691124e+04 1.289548e+05 39472.22 1.107593e+05 9.878108e+04 5.954055e+04 3.473731e+04 7.980821e+04 1.313186e+05 1.168716e+05 2.885462e+04 8.248193e+04 1.135135e+05 1.236457e+05 1.009065e+04 9.408092e+04 9.961340e+04 1.132866e+05 4.708694e+04 1.608654e+05 8.202734e+04 1.088667e+05 1.092553e+05 6.963654e+04 5.960008e+04 1.333535e+05 4.065870e+05 1.076412e+06 1.591544e+05 2.387607e+05 8.251818e+04 6.108148e+04 8.502952e+04 7.614726e+04 4.309258e+05 4.697593e+04 1.057405e+05 6.938887e+04 1.154266e+05 2.843338e+05 1.182566e+05 2.779756e+05 6.255335e+04 9.434775e+04 7.376602e+04 1.017890e+06 7.342483e+04 1.080400e+05 3.078302e+05 9.140625e+04 3.254136e+05 6.785493e+04 3.509968e+05 8.049791e+04 6.456135e+04 1.421766e+05 5.176039e+04 3.375882e+05 1.290668e+05 6.596992e+04 8.488294e+04 8.750027e+04 4.001618e+05 9.054557e+04 5.203931e+04 1.035133e+05 6.811594e+04 2.433153e+05 6.476056e+04 5.679925e+04 1.807202e+05 1.762529e+05 1.549392e+06 1.532966e+05 6.995658e+04 1.141740e+05 2.426137e+05 8.352325e+04 6.438712e+04 1.558587e+05 7.005188e+04 4.210281e+05 8.576344e+04 4.836327e+04 7.266973e+04 7.843525e+04 1.057327e+05 5.476024e+04 5.410418e+05 9.512463e+04 2.151316e+05 4.459148e+04 1.741699e+05 2.464840e+05 9.133587e+04 2.633575e+05 1.432435e+06 3.657298e+04 4.449822e+05 1.748330e+05 7.681865e+04 5.920060e+04 4.226045e+05 1.049165e+05 7.870663e+04 5.649999e+05 6.522754e+04 7.554486e+04 1.253365e+05 1.768988e+05 4.280307e+04 8.760730e+04 6.993131e+04 2.910090e+05 4.296165e+05 9.761080e+04 5.390710e+05 6.972543e+04 3.365965e+05 1.055835e+05 1.762734e+05 1.292116e+05 1.131448e+05 1.151033e+05 8.482685e+04 7.682506e+04 1.895668e+06 9.766129e+04 1.382623e+05 2.356192e+06 5.799596e+04 1.415045e+05 2.409852e+05 9.322092e+04 8.122290e+04 1.025004e+05 5.178432e+04 4.006795e+04 8.533917e+04 6.217260e+04 1.084851e+05 1.814488e+05 1.953729e+05 1.124166e+05 1.845840e+05 7.080482e+04 9.991419e+04 5.459396e+05 6.590716e+04 6.263074e+04 7.909238e+04 6.283468e+04 9.618493e+04 9.560702e+04 7.476028e+04 8.206639e+04 2.961470e+05 6.209616e+04 9.188018e+04 5.124474e+04 8.834169e+04 8.607593e+04 8.625911e+04 7.906139e+04 1.016449e+05 9.010450e+04 7.897333e+04 1.200078e+05 1.348575e+05 8.165620e+04 2.352051e+05 9.280569e+04 3.189441e+05 1.375052e+05 8.896437e+04 8.275182e+04 8.486588e+04 1.262756e+05 7.898773e+04 8.644527e+04 7.693709e+04 7.733356e+04 1.592392e+05 2.781461e+05 3.428770e+04 1.617893e+05 5.409605e+04 4.981814e+04 9.357942e+04 7.686745e+04 3.119260e+05 7.563564e+04 6.286379e+04 4.536984e+04 1.409523e+05 9.323154e+04 1.365755e+05 1.460714e+05 9.632209e+04 1.086833e+06 8.226471e+04 1.517881e+05 1.406799e+05 7.407934e+04 1.375343e+05 6.275359e+04 8.467650e+04 2.743391e+05 8.314886e+04 2.559644e+05 9.056815e+04 8.517710e+04 1.499633e+05 1.028487e+05 7.867334e+04 3.699166e+05 2.223891e+05 7.291399e+04 1.000483e+05 1.312879e+05 8.157039e+04 5.786964e+04 1.173751e+05 8.962481e+04 2.095882e+05 1.017937e+05 6.717658e+04 1.142566e+06 7.610898e+04 7.266249e+04 8.318067e+04 6.137654e+05 "3-Acetyl-7-methyl-1,4,5,6,7,7a-hexahydro-2H-pyrrolo[3,2-b]pyridin-2-one_1.974" 2.404909e+06 3.226574e+05 2.334813e+05 3.252047e+05 4.287756e+04 2.759233e+05 2.953183e+05 2.866273e+05 48875.51 2.685868e+05 2.913519e+05 3.243746e+05 47532.52 2.971969e+05 2.994216e+05 2.651173e+05 3.149358e+04 2.392138e+05 3.432125e+05 3.063718e+05 6.374058e+04 2.205714e+05 3.274636e+05 2.813345e+05 32266.908 3.180411e+05 2.605443e+05 2.976621e+05 2.413124e+04 2.718267e+05 3.204638e+05 3.376227e+05 36697.02 2.306100e+05 2.849934e+05 3.673031e+05 3.496945e+04 1.909318e+05 3.086163e+05 2.811213e+05 3.343217e+04 2.744163e+05 2.933472e+05 3.788801e+05 1.354107e+04 2.421720e+05 2.530039e+05 3.051928e+05 1.659436e+05 3.581943e+05 2.847289e+05 4.109752e+05 3.536255e+05 4.386911e+05 5.390545e+05 4.512378e+05 3.687589e+05 4.334491e+05 7.458769e+05 3.408476e+05 3.835600e+05 3.915184e+05 2.678508e+05 3.141506e+05 2.072470e+05 7.547873e+05 4.865567e+05 4.798154e+05 5.251874e+05 3.280047e+05 2.461351e+05 3.068417e+05 3.702429e+05 3.121422e+05 7.425559e+05 1.790541e+05 1.756158e+05 4.463076e+05 3.888875e+05 4.877451e+05 3.734353e+05 1.931755e+05 3.488739e+05 6.349902e+05 3.699357e+05 3.338252e+05 1.852127e+05 3.361532e+05 3.392670e+05 5.536987e+05 4.147728e+05 2.052239e+05 2.185306e+05 4.456251e+05 2.741440e+05 1.859531e+05 4.447128e+05 4.244523e+05 7.074926e+04 3.900122e+05 5.073107e+05 2.689836e+05 2.913660e+05 2.807376e+05 4.199293e+05 2.584254e+05 1.558921e+05 3.508413e+05 3.104816e+05 3.481985e+05 1.919465e+05 3.265223e+05 3.009536e+05 4.525755e+05 5.602313e+05 4.169992e+05 1.682711e+05 4.575606e+05 4.313266e+05 7.728214e+05 2.400843e+05 1.991100e+05 1.345647e+05 2.128097e+05 1.534833e+05 2.023661e+05 3.043242e+05 5.847073e+05 4.637504e+05 2.889687e+05 6.848601e+05 4.366330e+05 3.280405e+05 2.999291e+05 4.998123e+05 2.338019e+05 2.188451e+05 1.704292e+05 4.221126e+05 4.827126e+05 4.110237e+05 3.416749e+05 2.064844e+05 2.770296e+05 3.097437e+05 2.494891e+05 8.165616e+04 7.755305e+04 1.472052e+05 1.319528e+05 5.110501e+05 2.974361e+05 1.458333e+05 4.001778e+05 4.641227e+05 2.985655e+05 2.914044e+05 2.957715e+05 2.455433e+05 1.700601e+05 5.075531e+05 3.268622e+05 8.829654e+05 4.485420e+05 4.762269e+05 7.508689e+05 2.366536e+05 4.161618e+05 4.010893e+05 2.561064e+05 3.276323e+05 1.278830e+05 2.790040e+05 5.481401e+05 4.026892e+05 1.097314e+05 3.170388e+05 2.590627e+05 8.113747e+05 1.954875e+05 1.688044e+05 1.707082e+05 6.280519e+05 2.282616e+05 4.539598e+05 2.522613e+05 5.238660e+05 3.100944e+05 4.465463e+05 2.064863e+05 2.107525e+05 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1.069742e+06 5.600946e+05 7.210962e+05 5.041707e+05 2.638461e+05 1.921712e+05 6.776422e+05 4.989936e+05 MM3670000_1.979 5.598478e+05 1.841842e+06 1.868065e+06 2.396802e+06 3.630210e+05 1.538552e+06 1.755615e+06 1.930233e+06 814733.74 1.816635e+06 2.129261e+06 2.206124e+06 2139918.59 1.647427e+06 1.710030e+06 1.790706e+06 5.095647e+06 2.033362e+06 1.855172e+06 1.911612e+06 4.115947e+05 1.744630e+06 1.962820e+06 2.001561e+06 197864.135 2.230633e+06 1.517215e+06 1.800534e+06 3.914368e+05 1.843024e+06 2.222868e+06 1.858296e+06 128468.44 2.034613e+06 1.607384e+06 1.885840e+06 3.551934e+05 1.979764e+06 1.928568e+06 1.838213e+06 1.399824e+05 1.687905e+06 2.181625e+06 2.157002e+06 2.666615e+05 1.620911e+06 1.861932e+06 1.905554e+06 9.906962e+05 9.580302e+05 6.197499e+05 5.389906e+05 6.002405e+05 6.754224e+05 8.556539e+05 5.472288e+05 1.269967e+07 5.351872e+05 9.759703e+05 9.818270e+05 5.805376e+05 8.523044e+05 6.090213e+05 5.055956e+05 1.623782e+06 8.861339e+05 6.935801e+05 4.644053e+05 7.766926e+05 7.852240e+05 1.124799e+06 8.146967e+05 1.568801e+06 1.172714e+06 1.346501e+06 8.770228e+05 1.139482e+06 7.793000e+06 3.880005e+06 1.134517e+06 8.023423e+05 1.096860e+06 7.780139e+05 7.023579e+05 6.771636e+05 7.274918e+05 1.922592e+06 1.027076e+06 1.194331e+06 2.683580e+06 9.831980e+05 8.894455e+05 1.616189e+06 8.505151e+05 5.177410e+06 7.875792e+05 8.414917e+05 9.082924e+05 5.281437e+05 7.442414e+05 1.026386e+06 6.868572e+05 5.932562e+05 7.546661e+05 1.221743e+06 1.484790e+06 6.844672e+05 1.725771e+06 8.789699e+05 5.389798e+05 5.116919e+05 1.236497e+06 7.841759e+05 1.144007e+06 7.804502e+05 6.469526e+05 1.140822e+08 9.535776e+05 5.938584e+05 7.222302e+05 6.930495e+05 1.777765e+06 6.514371e+05 6.672083e+05 5.490956e+05 1.198791e+06 9.069695e+05 6.217565e+05 6.109847e+05 1.225748e+06 7.417488e+05 2.089023e+05 7.539534e+05 7.776260e+05 7.429560e+05 1.348364e+06 1.317485e+06 2.428592e+06 9.254530e+05 7.733905e+05 1.903132e+06 1.262171e+06 1.993396e+06 1.161489e+06 5.476122e+05 4.339790e+05 8.617348e+05 5.231734e+05 9.585586e+05 8.566813e+05 1.385926e+07 2.303956e+06 2.362324e+06 8.562248e+05 1.970805e+07 1.687818e+06 8.315292e+05 1.769767e+06 2.555722e+06 7.283283e+05 1.057899e+06 5.943764e+05 6.016308e+05 1.162062e+06 7.634029e+06 6.934602e+05 5.494388e+05 1.403473e+06 1.142978e+06 6.326129e+05 2.600720e+06 1.983552e+06 2.697997e+06 1.433699e+06 7.630549e+05 6.015456e+05 5.735595e+05 6.809198e+05 9.021376e+05 7.967766e+05 1.370358e+06 5.630512e+05 9.460062e+05 2.172910e+06 7.624072e+05 5.743449e+05 8.060235e+05 1.388624e+06 1.816697e+06 1.015998e+06 1.579378e+06 9.478971e+05 8.440038e+05 7.746550e+05 2.830469e+06 8.317763e+05 1.563140e+06 1.022326e+06 8.093614e+05 1.490895e+06 7.725243e+06 2.277861e+06 1.120952e+06 6.492822e+05 8.521813e+05 1.362575e+06 6.879490e+05 1.657337e+06 1.170074e+06 5.303521e+05 1.070108e+06 7.718115e+05 5.356112e+05 1.845957e+06 6.406474e+05 7.423885e+05 2.788697e+06 1.005366e+06 5.124098e+05 7.408123e+05 1.732914e+06 6.022813e+05 9.409688e+05 1.918426e+06 9.270241e+05 1.490903e+06 2.733276e+06 1.618358e+06 1.116567e+06 5.494346e+05 9.726669e+05 9.027743e+05 5.357771e+05 5.221960e+05 1.026463e+06 7.867198e+05 9.587521e+05 5.400277e+05 1.146150e+06 7.450524e+05 4.310175e+05 8.092089e+05 6.972617e+05 8.892170e+05 7.279796e+05 8.025761e+05 1.145649e+06 9.146582e+05 1.316423e+06 1.501888e+06 8.034216e+05 5.630718e+05 4.841919e+05 1.246039e+06 1.453962e+06 7.202006e+05 8.819499e+05 4.485629e+05 7.108553e+05 7.993317e+05 6.726559e+05 2.916001e+06 388.71928_1.979 4.545600e+06 1.045497e+06 8.499494e+05 7.948675e+05 1.226541e+05 5.496104e+05 9.488128e+05 6.491194e+05 99640.48 7.328276e+05 8.514850e+05 9.863436e+05 79446.75 9.344571e+05 6.675705e+05 9.037323e+05 4.657931e+04 6.824866e+05 8.616432e+05 6.214345e+05 1.152590e+05 1.068144e+06 7.338361e+05 1.001949e+06 48003.133 7.251851e+05 7.689540e+05 8.844183e+05 3.572159e+04 6.833408e+05 7.660980e+05 7.708882e+05 41195.48 1.060912e+06 7.018244e+05 6.956229e+05 4.777247e+04 9.675181e+05 9.183027e+05 6.195359e+05 3.603854e+04 9.343317e+05 7.915445e+05 8.885088e+05 2.520178e+04 7.672736e+05 8.470968e+05 7.855206e+05 7.066137e+05 7.700821e+05 1.950486e+05 1.498728e+06 8.570688e+05 6.921770e+05 1.061796e+06 7.747284e+05 1.003123e+06 1.120351e+06 1.007048e+06 6.453378e+05 4.716023e+05 8.936678e+05 1.553155e+06 1.228874e+06 7.674688e+05 1.977709e+06 4.136418e+05 9.066667e+05 2.194440e+06 2.147334e+06 4.401105e+05 1.379769e+06 1.461525e+06 4.292915e+05 1.291660e+06 1.232229e+06 1.327610e+06 6.744974e+05 1.304831e+06 9.078282e+05 7.343679e+05 6.979880e+05 7.710985e+05 1.220833e+06 7.113220e+05 9.144873e+05 1.186272e+06 3.770746e+06 9.672956e+05 4.596608e+05 6.625306e+05 5.842639e+05 1.318731e+06 5.791904e+05 9.747810e+05 3.913031e+05 1.030492e+06 5.523490e+05 2.713210e+05 3.588181e+05 1.517336e+06 6.905505e+05 5.870099e+05 5.476956e+05 1.508893e+06 8.835121e+05 1.215735e+06 1.213919e+06 6.243660e+05 1.195803e+06 7.642094e+05 1.472796e+06 2.076295e+06 4.116145e+05 7.073317e+05 2.938509e+06 9.141465e+05 1.118556e+06 1.112034e+06 3.710218e+05 1.265129e+06 8.299556e+05 6.426367e+05 1.009862e+06 1.266016e+06 5.795872e+05 4.002575e+05 1.595752e+06 7.296837e+05 2.733712e+05 6.810090e+05 1.413149e+06 7.574729e+05 2.526223e+06 1.199737e+06 9.215861e+05 6.271752e+05 5.456400e+05 1.089279e+06 8.612056e+05 1.396828e+06 6.619151e+05 1.191916e+06 1.036330e+06 1.013273e+06 4.935324e+05 3.143019e+05 7.509354e+05 4.727707e+05 8.152256e+05 1.017744e+06 1.096372e+06 1.383262e+06 5.608756e+05 1.060197e+06 7.935691e+05 7.276631e+05 1.281845e+06 8.573039e+05 7.482794e+05 2.750320e+05 1.140404e+06 1.474678e+06 4.704439e+05 1.863539e+06 7.574365e+05 7.780775e+05 8.575047e+05 8.480924e+05 4.563117e+05 5.604801e+05 1.136968e+06 7.165342e+05 9.788684e+05 8.489491e+05 6.384740e+05 1.772758e+06 9.551203e+05 8.346384e+05 4.366160e+05 3.034939e+05 1.101870e+06 1.086385e+06 2.809474e+05 6.522618e+05 2.221407e+05 1.383276e+06 9.131534e+05 3.448605e+06 1.228358e+06 8.256705e+05 2.773794e+05 8.151805e+05 4.092756e+05 1.584248e+05 2.009251e+05 4.661975e+05 3.478643e+05 5.976444e+05 1.730109e+06 1.252320e+06 6.187795e+05 4.969925e+05 5.835795e+05 7.304539e+05 1.447473e+05 6.466419e+05 1.115386e+06 8.431516e+05 4.974059e+05 1.138628e+06 7.552326e+05 9.727328e+05 5.743081e+05 1.239575e+06 3.547774e+05 3.947805e+05 1.172176e+06 1.528213e+05 6.706072e+05 1.623986e+06 5.358447e+05 1.584582e+06 9.868082e+05 4.376184e+05 7.576719e+05 5.260663e+05 6.087501e+05 4.708195e+05 1.101932e+06 4.437464e+05 8.637267e+05 4.423516e+05 6.745673e+05 1.477663e+06 6.063006e+05 2.560210e+06 1.124885e+06 4.821392e+05 1.165338e+06 4.870572e+05 9.754618e+05 1.597464e+05 1.163169e+06 5.851305e+05 3.241079e+05 5.498200e+05 1.202090e+06 9.675344e+05 5.045807e+05 1.380119e+05 9.724049e+05 5.398930e+05 1.889174e+06 1.284556e+06 3.321602e+05 2.096156e+06 6.931131e+05 1.318365e+06 2.922847e+05 1.071578e+06 1.086172e+06 C15 H29 N5 O4_1.979 5.616459e+05 2.580890e+06 2.252399e+06 2.607870e+06 8.869282e+04 1.720265e+06 2.216282e+06 2.347838e+06 392059.91 2.196878e+06 2.390263e+06 2.540978e+06 1939713.00 2.009989e+06 2.326324e+06 2.060633e+06 3.001435e+06 2.473436e+06 2.374385e+06 2.069439e+06 1.544543e+05 2.275687e+06 2.203832e+06 2.509860e+06 43890.180 2.486508e+06 2.011931e+06 2.387749e+06 1.004465e+05 2.225988e+06 2.350824e+06 2.348123e+06 140409.28 2.261697e+06 2.276754e+06 2.150486e+06 1.992670e+05 2.369092e+06 2.377288e+06 2.135617e+06 5.612820e+04 2.189620e+06 2.369364e+06 2.542427e+06 1.279549e+05 2.142293e+06 2.221717e+06 2.312656e+06 3.215585e+05 5.053877e+05 4.798014e+05 3.370502e+05 3.563113e+05 3.796083e+05 1.101261e+06 2.703220e+05 8.901643e+06 3.140393e+05 6.840722e+05 5.842861e+05 3.486648e+05 4.530024e+05 3.282920e+05 2.903502e+05 4.082352e+05 3.812267e+05 3.272242e+05 1.782055e+05 3.202258e+05 5.186358e+05 6.618082e+05 4.145976e+05 5.110411e+06 4.706897e+05 7.699600e+05 5.069210e+05 4.432265e+05 9.544346e+06 1.021605e+06 6.627544e+05 4.449198e+05 6.869241e+05 3.647536e+05 3.417092e+05 4.410720e+05 4.518800e+05 2.504929e+06 5.848313e+05 7.334844e+05 2.742196e+06 5.689663e+05 5.043291e+05 9.896693e+05 6.881252e+05 9.177875e+06 4.479793e+05 3.950635e+05 5.755999e+05 1.921322e+05 4.160527e+05 7.203916e+05 5.048488e+05 4.541087e+05 5.390691e+05 6.770895e+05 1.251839e+06 4.314124e+05 1.249592e+06 5.764303e+05 3.807747e+05 2.619905e+05 5.283769e+05 3.025275e+05 6.631936e+05 4.112672e+05 3.524033e+05 1.682560e+08 7.410883e+05 5.571948e+05 5.941956e+05 3.890848e+05 1.361805e+06 2.928081e+05 3.851708e+05 3.703150e+05 7.658956e+05 5.145834e+05 2.605603e+05 2.838298e+05 7.628507e+05 4.403410e+05 1.138929e+05 4.754873e+05 4.919851e+05 4.460419e+05 6.875899e+05 6.450411e+05 2.720757e+06 6.434042e+05 7.060554e+05 9.385617e+05 8.803345e+05 1.507728e+06 7.356355e+05 1.852255e+05 1.915049e+05 5.191767e+05 3.015268e+05 5.466468e+05 4.083991e+05 7.485590e+06 2.649943e+06 2.444564e+06 5.441886e+05 5.183838e+06 1.275470e+06 5.590383e+05 8.791855e+05 1.307522e+06 2.943834e+05 4.972441e+05 5.405714e+05 2.826572e+05 6.436404e+05 1.213900e+07 3.049593e+05 2.851908e+05 9.826151e+05 4.693602e+05 4.808201e+05 2.718052e+06 3.112471e+06 7.540286e+05 8.466926e+05 4.312733e+05 2.374782e+05 3.472692e+05 3.595934e+05 5.040519e+05 5.112877e+05 6.063533e+05 3.587343e+05 5.402186e+05 1.506277e+06 5.244171e+05 4.396875e+05 3.645999e+05 7.471847e+05 1.128724e+06 5.000035e+05 8.362998e+05 5.259276e+05 5.840890e+05 4.832323e+05 1.613743e+06 6.262341e+05 1.410311e+06 5.799270e+05 5.975272e+05 9.873470e+05 8.776883e+06 1.758346e+06 6.237630e+05 3.585539e+05 3.865360e+05 5.558564e+05 4.249661e+05 1.251198e+06 7.453570e+05 1.105254e+05 6.642544e+05 4.624814e+05 2.553241e+05 9.374905e+05 3.228056e+05 2.987654e+05 1.879930e+06 6.375953e+05 1.919098e+05 5.044337e+05 1.013430e+06 1.867733e+05 7.296266e+05 8.183149e+05 4.887499e+05 8.283886e+05 1.631190e+06 1.238562e+06 7.324740e+05 2.733059e+05 6.771738e+05 4.263926e+05 3.401189e+05 2.699413e+05 5.737756e+05 5.123673e+05 6.025807e+05 5.220411e+05 8.273036e+05 3.865883e+05 2.909178e+05 5.059353e+05 2.158367e+05 3.931989e+05 2.456739e+05 4.132158e+05 4.900795e+05 6.401747e+05 3.328102e+06 1.449591e+06 3.340416e+05 2.400891e+05 2.026792e+05 4.798433e+05 8.828228e+05 2.814836e+05 9.639287e+05 2.814401e+05 4.367338e+05 3.679462e+05 3.152254e+05 3.173750e+06 Dihydrothymine (1)_1.981 1.236338e+06 3.291648e+05 2.560671e+05 3.598418e+05 4.685149e+04 3.493660e+05 3.264995e+05 3.104845e+05 49175.34 2.881505e+05 3.346164e+05 3.763505e+05 46987.79 2.774827e+05 2.779160e+05 3.345613e+05 6.087460e+04 3.271469e+05 3.491145e+05 3.092487e+05 7.943696e+04 2.445908e+05 3.085070e+05 4.062167e+05 136008.456 2.665020e+05 3.088620e+05 3.446761e+05 5.045191e+05 2.766394e+05 3.141239e+05 4.927828e+05 218948.48 4.227996e+05 2.301067e+05 3.253557e+05 1.017807e+05 3.009591e+05 2.528107e+05 5.400828e+05 1.662676e+05 2.817400e+05 2.809136e+05 5.192912e+05 2.184200e+04 3.113961e+05 2.106880e+05 3.771714e+05 2.716968e+05 6.189342e+05 4.610619e+05 2.953681e+05 3.737963e+05 3.367259e+05 3.610578e+05 5.115511e+05 2.993060e+05 4.065600e+05 6.230189e+05 5.081354e+05 5.278871e+05 5.965911e+05 5.871225e+05 8.982994e+05 4.053391e+05 2.586820e+05 3.592130e+05 3.572332e+05 3.329474e+05 2.725845e+05 1.805296e+05 4.807222e+05 6.138293e+05 1.911468e+05 4.317897e+05 2.349870e+05 3.072300e+05 3.141003e+05 3.544600e+05 3.044481e+05 3.714976e+05 2.872271e+05 4.424168e+05 2.274146e+05 5.509176e+05 3.932774e+05 3.513015e+05 4.174114e+05 5.570461e+05 4.577632e+05 8.035477e+05 1.168944e+05 2.824606e+05 3.940194e+05 6.343636e+04 4.575634e+05 2.050339e+05 2.287741e+05 1.401418e+05 1.909706e+05 3.627987e+05 1.884669e+05 2.787596e+05 2.516952e+05 4.049901e+05 2.422952e+05 3.715783e+05 3.875247e+05 4.989596e+06 4.213791e+05 1.870560e+05 6.096809e+05 2.359162e+05 2.041780e+05 1.648112e+05 4.246730e+05 5.444681e+05 3.534286e+05 2.347859e+05 1.368564e+06 3.525139e+05 2.952515e+05 2.684718e+05 2.750720e+05 1.779265e+05 2.378035e+05 3.182128e+05 3.545627e+05 2.495088e+05 2.261565e+05 2.618990e+05 4.869387e+05 2.167815e+05 4.221981e+05 4.881968e+05 2.525059e+05 4.036049e+05 2.068835e+05 2.443729e+05 4.440755e+05 1.660118e+05 4.834020e+06 3.187204e+05 1.781302e+05 3.215985e+05 3.246833e+05 1.404989e+05 3.106844e+05 2.873530e+05 2.856128e+05 3.079404e+05 1.311214e+05 4.429994e+05 2.556830e+05 4.120657e+05 4.268267e+05 2.123474e+05 5.059416e+05 3.967351e+05 2.952282e+05 3.222233e+05 5.168147e+05 4.362382e+05 3.002898e+05 4.639006e+05 4.196193e+05 2.732787e+05 2.760584e+05 3.986731e+05 4.278521e+05 6.190916e+05 2.975565e+05 3.076920e+05 1.305846e+05 2.595323e+05 2.942795e+05 4.308770e+05 2.769007e+05 4.279320e+05 1.266550e+05 2.360745e+05 3.436192e+05 2.451426e+05 1.167081e+05 3.963707e+05 2.797590e+05 3.275101e+05 1.853782e+05 3.849850e+05 2.464344e+05 4.689863e+05 9.935207e+04 1.062790e+05 3.433090e+05 1.987242e+05 3.386231e+05 3.766688e+05 3.951347e+05 4.138616e+05 7.390367e+05 5.089467e+05 2.629051e+05 2.528381e+05 2.913574e+05 1.128254e+05 7.411349e+04 2.520053e+05 3.829086e+05 5.839585e+05 1.746398e+05 2.714786e+05 5.183808e+05 5.524036e+05 2.381875e+05 5.154346e+05 3.499815e+05 3.590582e+05 1.581972e+05 7.682473e+04 4.578086e+05 3.632764e+05 2.373977e+05 2.188462e+05 2.541518e+05 3.535470e+05 4.256876e+05 1.701006e+05 1.659900e+05 2.027174e+05 3.454747e+05 4.683309e+05 2.012335e+05 2.430240e+05 3.085524e+05 4.288882e+05 3.763527e+05 3.016218e+05 2.263674e+05 3.355796e+05 5.385743e+05 3.492532e+05 4.930408e+05 2.312575e+05 5.776208e+05 1.378696e+05 2.203904e+05 1.911507e+05 1.938191e+05 5.241121e+05 4.352691e+05 2.195455e+05 3.487614e+05 3.399466e+05 6.225487e+05 2.388522e+05 2.257812e+05 3.699071e+05 1.178678e+06 5.506316e+05 2.897702e+05 3.957972e+05 3.488533e+05 C7 H26 N9 O2 P_1.981 4.431574e+05 1.392538e+06 1.333620e+06 1.732788e+06 2.477408e+05 1.026799e+06 1.252559e+06 1.376090e+06 625546.41 1.366798e+06 1.444875e+06 1.600969e+06 1689425.49 1.222112e+06 1.181498e+06 1.306825e+06 4.154168e+06 1.462045e+06 1.350842e+06 1.360876e+06 2.222550e+05 1.258204e+06 1.441478e+06 1.395362e+06 121147.924 1.589064e+06 1.057513e+06 1.305545e+06 2.963943e+05 1.334477e+06 1.662207e+06 1.284828e+06 136290.87 1.473912e+06 1.158796e+06 1.317672e+06 2.360229e+05 1.482726e+06 1.300797e+06 1.366661e+06 5.958998e+04 1.175783e+06 1.581591e+06 1.565172e+06 2.064601e+05 1.173139e+06 1.359563e+06 1.332499e+06 7.137932e+05 7.357987e+05 4.359499e+05 3.434317e+05 3.862354e+05 4.375794e+05 5.657817e+05 3.906631e+05 8.663426e+06 3.525174e+05 7.042706e+05 6.446408e+05 3.577605e+05 5.453062e+05 3.968722e+05 3.032293e+05 1.146941e+06 5.620849e+05 4.508913e+05 2.797971e+05 6.209687e+05 5.202446e+05 6.564891e+05 5.782446e+05 1.149993e+06 9.036079e+05 9.476584e+05 6.592753e+05 7.965207e+05 4.217689e+06 2.615982e+06 7.991729e+05 5.788779e+05 8.537946e+05 5.314583e+05 4.547209e+05 4.642135e+05 5.394061e+05 1.351162e+06 8.107715e+05 8.337249e+05 1.998023e+06 6.459069e+05 6.173957e+05 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4.006943e+05 1.942632e+06 1.424962e+06 1.954607e+06 1.110477e+06 5.273044e+05 3.356076e+05 4.203862e+05 4.888700e+05 6.379534e+05 4.867484e+05 8.857702e+05 3.736679e+05 7.684000e+05 1.455258e+06 5.021441e+05 4.107660e+05 5.837655e+05 1.030114e+06 1.359301e+06 6.577704e+05 1.146412e+06 4.782306e+05 6.025962e+05 5.434829e+05 1.962617e+06 6.401654e+05 1.155488e+06 6.632427e+05 5.326121e+05 1.122149e+06 5.749034e+06 1.598710e+06 8.398384e+05 3.982369e+05 5.784180e+05 9.008691e+05 4.634033e+05 1.108361e+06 9.108638e+05 1.822280e+05 7.610111e+05 5.344172e+05 3.693947e+05 1.268496e+06 4.457429e+05 4.535119e+05 2.004426e+06 7.229792e+05 3.056338e+05 4.807630e+05 1.318624e+06 3.307863e+05 6.888565e+05 1.336360e+06 5.657789e+05 1.042351e+06 1.872870e+06 1.143518e+06 8.055884e+05 3.662645e+05 5.441343e+05 5.930137e+05 3.685235e+05 3.531691e+05 6.958175e+05 5.301385e+05 6.014225e+05 3.667236e+05 9.049926e+05 4.918779e+05 2.408382e+05 6.194981e+05 4.640508e+05 6.136616e+05 3.019369e+05 5.497539e+05 7.975645e+05 6.806285e+05 9.304419e+05 1.106865e+06 4.886038e+05 3.289717e+05 2.897904e+05 8.467386e+05 1.024645e+06 5.110772e+05 5.762156e+05 2.669708e+05 4.863221e+05 5.197320e+05 3.982697e+05 2.053666e+06 C17 H19 N3 O4 S_1.983 8.143966e+04 1.233249e+05 1.106918e+05 1.169643e+05 6.589371e+04 1.031129e+05 1.061979e+05 1.178830e+05 66861.62 1.400766e+05 1.036407e+05 1.272174e+05 68762.32 9.151730e+04 1.004231e+05 1.151758e+05 4.287082e+04 8.259667e+04 1.124923e+05 1.266576e+05 1.087056e+05 1.217535e+05 8.258681e+04 1.800227e+05 39883.668 1.252758e+05 1.409124e+05 7.517854e+04 3.106324e+04 1.195550e+05 1.262943e+05 1.478292e+05 40883.22 9.190649e+04 1.626295e+05 5.769836e+04 4.632117e+04 1.283083e+05 1.566935e+05 1.219278e+05 3.103233e+04 9.640520e+04 1.298064e+05 1.288632e+05 1.952892e+04 1.132199e+05 1.343964e+05 1.060688e+05 5.482553e+04 1.004329e+05 4.269822e+04 5.619242e+04 5.094575e+04 6.808172e+04 9.041069e+04 5.926467e+04 7.931341e+04 9.108871e+04 5.347072e+04 1.118813e+05 7.668862e+04 4.902608e+04 1.248340e+05 5.809677e+04 5.345054e+04 6.599251e+04 8.170960e+04 5.857084e+04 8.795832e+04 7.180663e+04 1.093972e+05 8.017559e+04 6.404725e+04 1.008418e+05 8.044109e+04 7.479178e+04 8.849102e+04 8.095289e+04 6.428754e+04 5.016236e+04 9.785022e+04 8.112425e+04 5.771133e+04 9.601779e+04 8.819753e+04 4.905522e+04 3.989005e+04 9.046819e+04 8.580693e+04 6.805956e+04 6.677029e+04 1.030967e+05 7.592693e+04 8.641190e+04 5.213408e+04 9.118096e+04 6.806650e+04 6.138574e+04 8.687817e+04 8.435800e+04 9.544842e+04 8.029630e+04 7.314313e+04 8.089342e+04 6.798355e+04 7.820821e+04 7.086437e+04 7.089758e+04 6.943950e+04 5.813214e+04 6.634578e+04 8.978106e+04 8.625294e+04 5.204659e+04 9.713724e+04 9.663865e+04 1.273197e+05 5.666637e+04 6.210879e+04 5.406448e+04 4.213797e+04 4.202722e+04 4.362881e+04 6.098672e+04 4.209030e+04 4.866720e+04 1.266442e+05 5.387475e+04 9.107944e+04 9.484162e+04 7.393655e+04 4.092623e+04 5.369633e+04 6.989604e+04 9.748203e+04 1.029677e+05 2.261167e+06 7.569887e+04 6.534996e+04 7.819506e+04 4.031530e+04 9.014963e+04 1.046881e+05 6.563785e+04 9.895059e+04 5.774286e+04 4.787171e+04 6.897858e+04 1.099389e+05 6.704562e+04 1.086310e+05 8.804330e+04 8.699898e+04 6.088963e+04 6.779236e+04 9.127363e+04 6.407141e+04 1.034207e+05 9.076481e+04 9.558666e+04 5.054216e+04 5.686436e+04 7.307599e+04 4.444019e+04 5.714612e+04 9.710804e+04 4.231268e+04 4.473594e+04 4.034896e+04 4.992313e+04 9.129937e+04 7.279223e+04 5.078171e+04 7.601250e+04 4.885174e+04 1.004942e+05 6.243390e+04 5.772742e+04 8.921317e+04 8.726111e+04 6.909046e+04 5.011734e+04 7.138821e+04 1.219527e+05 8.663591e+04 6.401615e+04 1.152070e+05 4.749133e+04 1.173165e+05 5.174012e+04 6.011333e+04 1.215401e+05 5.608548e+04 6.458263e+04 6.128426e+04 8.489362e+04 5.551075e+04 7.620271e+04 6.849143e+04 1.072996e+05 1.334533e+05 1.108498e+05 5.783154e+04 9.793723e+04 1.214962e+05 1.034507e+05 8.106589e+04 9.809625e+04 7.462627e+04 8.753511e+04 5.786277e+04 9.032956e+04 5.956629e+04 6.822645e+04 4.747233e+04 8.984076e+04 5.785268e+04 5.845978e+04 1.125852e+05 6.249037e+04 1.056113e+05 9.327930e+04 6.008629e+04 4.899337e+04 7.568861e+04 1.182708e+05 2.196269e+07 6.358535e+04 2.452166e+07 1.062988e+05 7.614656e+04 6.428593e+04 5.531708e+04 7.925619e+04 8.106767e+04 6.109741e+04 1.042711e+05 6.484777e+04 9.103214e+04 1.035342e+05 8.903387e+04 1.156385e+05 1.134283e+05 1.101532e+05 1.076790e+05 5.912147e+04 9.460872e+04 6.431863e+04 9.991329e+04 1.120188e+05 1.121751e+05 6.140883e+04 1.067964e+05 1.003281e+05 1.649987e+05 9.418332e+04 8.279751e+04 4.643160e+04 7.715725e+04 6.027131e+04 8.376703e+04 1.073202e+05 C7 H16 Br Cl N3 O17 P3 S4_1.983 1.069416e+05 1.626560e+07 1.387139e+07 1.915764e+07 7.625218e+04 2.352604e+07 2.340698e+07 2.036688e+07 52434.25 2.484435e+07 1.982698e+07 1.642154e+07 48931.50 2.044638e+07 1.947937e+07 2.057663e+07 3.094764e+04 2.036441e+07 2.125448e+07 2.271876e+07 1.015966e+05 2.365155e+07 1.358178e+07 2.186944e+07 50503.518 1.159784e+07 2.254011e+07 2.336635e+07 3.628196e+04 2.119990e+07 2.258338e+07 1.400282e+07 57177.52 2.175614e+07 2.340714e+07 1.463983e+07 8.498901e+04 2.944105e+07 1.395913e+07 1.242899e+07 7.628408e+04 2.510330e+07 2.293873e+07 2.432820e+07 7.003697e+04 1.884450e+07 1.570070e+07 2.223785e+07 1.160482e+07 2.343784e+07 6.912148e+06 2.227330e+07 2.563354e+07 2.086511e+07 2.185573e+07 2.543918e+07 2.418736e+07 2.196943e+07 1.769196e+07 1.599352e+07 1.978235e+07 1.483543e+07 2.117534e+07 1.201105e+07 2.603506e+07 3.410341e+07 2.054512e+07 1.462992e+07 2.333122e+07 2.657620e+07 1.619013e+07 2.356167e+07 1.627250e+07 2.063661e+07 2.001291e+07 2.353334e+07 2.556185e+07 2.282202e+07 4.506399e+04 1.527244e+07 9.528206e+06 2.174257e+07 1.308549e+07 2.089006e+07 1.575554e+07 1.615961e+07 4.843484e+06 2.943984e+07 1.548122e+07 2.463338e+07 1.911445e+07 1.881786e+07 2.240731e+07 1.706904e+07 1.213498e+07 2.589189e+07 1.693479e+07 2.742030e+07 1.613880e+07 2.005404e+07 2.537907e+07 2.347114e+07 1.667223e+07 2.112846e+07 2.255378e+07 1.014837e+07 1.104356e+07 1.156711e+07 2.266917e+07 2.352309e+07 1.988208e+07 2.509974e+07 2.566067e+07 2.202742e+07 1.581084e+07 4.017231e+07 2.170233e+07 3.201549e+07 1.421578e+07 1.917992e+07 3.064348e+07 2.135813e+07 1.436041e+07 2.134291e+07 1.311548e+07 1.930720e+07 2.280679e+07 2.356152e+06 1.901702e+07 1.037801e+07 2.558265e+07 7.060954e+04 1.551522e+05 2.115526e+07 2.129611e+07 2.350575e+07 1.563635e+07 2.113285e+07 2.586036e+07 2.414237e+07 1.866981e+07 1.237004e+07 1.672827e+07 2.901351e+07 2.673450e+07 2.052784e+07 1.948711e+07 2.156045e+07 1.857943e+07 2.196142e+07 2.110758e+07 1.489965e+07 2.930205e+07 1.100290e+07 2.431589e+07 3.130122e+07 1.209616e+07 2.433228e+07 1.600012e+07 2.194221e+07 1.043001e+07 2.530072e+07 2.238023e+07 4.856541e+06 9.182914e+06 2.950380e+07 1.265799e+07 2.919814e+07 2.072205e+07 1.029726e+07 2.474962e+07 2.238845e+07 1.396522e+07 2.398796e+07 3.192520e+07 1.918909e+07 1.277219e+07 2.349801e+07 2.372606e+07 6.842928e+06 2.796237e+07 3.757737e+06 1.886493e+07 1.917594e+07 2.599915e+07 2.261525e+07 2.687325e+07 2.582386e+07 3.459386e+07 1.015246e+07 1.481621e+06 1.129661e+07 3.198803e+06 2.904289e+07 2.895712e+07 3.585703e+07 1.422587e+06 1.970350e+07 1.979694e+07 1.929544e+07 1.783948e+07 1.803887e+07 1.045377e+07 2.174073e+07 2.677709e+07 1.683153e+07 2.357669e+07 4.743869e+07 2.710372e+07 2.401453e+07 1.181677e+07 2.187136e+07 2.532558e+07 2.400047e+07 3.301009e+07 2.099556e+07 2.278560e+06 1.935484e+06 1.296012e+07 1.469490e+07 2.517998e+07 1.916835e+07 2.556949e+07 1.355199e+07 1.218991e+07 1.145786e+07 1.073762e+07 1.524506e+07 2.059780e+07 2.890902e+07 1.246807e+07 2.723896e+07 2.155052e+07 1.170436e+07 2.320609e+07 1.295766e+07 3.551690e+07 2.565199e+07 2.608066e+07 1.434516e+07 2.307433e+07 1.934113e+07 1.997770e+07 3.210196e+07 1.726485e+07 1.626065e+07 1.263691e+07 5.985598e+06 2.396169e+07 2.033370e+07 1.501404e+07 1.489965e+07 2.174577e+07 2.757060e+07 9.754424e+06 1.815180e+07 2.986946e+07 2.286694e+07 2.494333e+07 2.893183e+07 2.208853e+07 2.393769e+07 C14 H30 O8_1.984 7.147813e+05 3.047965e+06 2.673174e+06 3.062771e+06 2.284700e+05 2.019443e+06 2.679720e+06 2.876038e+06 599342.90 2.606574e+06 2.718456e+06 3.047162e+06 2123487.17 2.392955e+06 2.793674e+06 2.532626e+06 3.228558e+06 2.782799e+06 2.785596e+06 2.559410e+06 3.947568e+05 2.605569e+06 2.625768e+06 3.100607e+06 116691.988 2.829725e+06 2.456860e+06 2.823302e+06 1.642148e+05 2.610150e+06 2.782703e+06 2.791236e+06 242216.62 2.607670e+06 2.701463e+06 2.636840e+06 3.237270e+05 2.766781e+06 2.825175e+06 2.600872e+06 1.435258e+05 2.593749e+06 2.746080e+06 3.026447e+06 1.992801e+05 2.492593e+06 2.665080e+06 2.750101e+06 4.837016e+05 6.875504e+05 6.715995e+05 4.971766e+05 4.887702e+05 5.496293e+05 1.288491e+06 4.645450e+05 1.051580e+07 5.645110e+05 8.520534e+05 8.255009e+05 5.282635e+05 6.271531e+05 5.802928e+05 4.532716e+05 6.031810e+05 5.657855e+05 5.505226e+05 3.239643e+05 5.239004e+05 7.123535e+05 9.523798e+05 5.732229e+05 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1.873430e+06 1.627420e+06 1.086640e+06 5.210029e+05 8.747290e+05 6.163923e+05 4.874745e+05 4.271652e+05 7.633567e+05 6.916844e+05 8.462862e+05 7.310686e+05 1.070298e+06 6.067058e+05 4.739359e+05 7.751011e+05 4.458838e+05 6.074208e+05 4.479792e+05 5.919313e+05 7.284786e+05 8.590834e+05 3.734566e+06 1.812642e+06 5.937253e+05 4.062670e+05 4.541631e+05 6.697281e+05 1.162652e+06 4.612598e+05 1.300341e+06 4.147355e+05 6.166742e+05 5.416577e+05 4.941594e+05 3.938081e+06 C17 H33 N5 O5_1.986 7.098555e+05 2.210994e+06 1.974363e+06 2.328477e+06 9.704190e+04 1.619014e+06 1.842736e+06 2.282734e+06 204888.01 1.798349e+06 2.135559e+06 2.204552e+06 1562794.21 1.816339e+06 1.891478e+06 2.104960e+06 2.483852e+06 2.163822e+06 2.232340e+06 1.438298e+06 1.348156e+05 1.933215e+06 2.125619e+06 2.352280e+06 34072.483 2.079293e+06 1.914570e+06 2.022605e+06 6.172668e+04 1.856402e+06 1.985039e+06 2.089263e+06 46051.39 2.234677e+06 2.010406e+06 1.735540e+06 1.310983e+05 2.024513e+06 2.214320e+06 1.859645e+06 4.243047e+04 2.188493e+06 1.897046e+06 2.339532e+06 1.063492e+05 1.747762e+06 1.909562e+06 2.136587e+06 3.475453e+05 3.899796e+05 5.031482e+05 3.872116e+05 1.850253e+05 2.299614e+05 1.850758e+06 3.486276e+05 6.062011e+06 2.083473e+05 5.171512e+05 3.651429e+05 2.657876e+05 3.687158e+05 1.308877e+05 9.550725e+04 2.496412e+05 3.524211e+05 3.396053e+05 1.368889e+05 2.307671e+05 4.237202e+05 4.941913e+05 4.256903e+05 8.920819e+06 3.148476e+05 7.309601e+05 5.510610e+05 3.292664e+05 1.001722e+07 4.292721e+05 5.328274e+05 3.986986e+05 6.255684e+05 2.547075e+05 3.023162e+05 3.724209e+05 2.611606e+05 2.519613e+06 4.501592e+05 5.445735e+05 1.983885e+06 4.741053e+05 3.901609e+05 7.352756e+05 5.189371e+05 9.863175e+06 2.768059e+05 3.323795e+05 3.921702e+05 1.178680e+05 3.758468e+05 8.098193e+05 4.045044e+05 2.965331e+05 5.333644e+05 5.320364e+05 6.570618e+05 3.688590e+05 1.415923e+06 2.796540e+05 5.095479e+05 2.748770e+05 4.531134e+05 1.871144e+05 5.348708e+05 3.415212e+05 1.004004e+05 2.201073e+08 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5.760709e+06 45843.54 5.588745e+06 5.517603e+06 6.078442e+06 45978.35 4.970620e+06 4.737131e+06 5.306432e+06 3.096207e+04 5.521217e+06 5.491636e+06 5.591818e+06 9.408516e+04 4.154040e+06 5.950654e+06 7.311573e+06 42084.108 4.178495e+06 5.079781e+06 5.262723e+06 4.033906e+04 5.510564e+06 6.002425e+06 4.760186e+06 75398.39 4.006976e+06 5.655381e+06 6.223175e+06 9.856111e+04 4.549076e+06 5.678190e+06 7.800149e+06 7.716306e+04 2.990524e+06 7.107946e+06 5.325077e+06 9.338735e+04 3.110741e+06 6.414515e+06 5.104820e+06 2.061334e+05 4.379870e+06 3.525602e+06 2.118426e+06 5.022924e+06 1.214284e+07 3.215861e+05 9.361801e+06 2.388994e+07 2.752943e+07 1.458169e+05 5.514944e+06 7.945995e+06 8.558677e+05 3.269989e+07 1.288271e+05 5.007583e+05 2.414667e+05 4.861794e+06 1.193584e+06 7.045576e+04 4.238267e+06 7.654379e+04 1.989241e+05 1.750338e+06 3.954307e+06 3.757862e+06 6.209506e+06 3.316251e+06 6.038654e+06 4.460185e+04 1.155905e+05 1.967669e+05 6.088164e+04 1.404705e+06 1.916798e+05 3.441259e+06 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1.142452e+07 9.688576e+05 5.507892e+05 1.592762e+07 2.752601e+06 1.317756e+05 3.033019e+06 1.007085e+06 4.431344e+06 6.429193e+04 3.935210e+06 1.158475e+05 3.080988e+06 5.289051e+05 1.093238e+05 5.417879e+06 5.331033e+06 3.213143e+06 7.705589e+06 3.001651e+05 3.535452e+06 1.474483e+07 1.700949e+06 2.390447e+07 7.387661e+07 3.386340e+06 3.379824e+06 3.071488e+06 4.339670e+05 8.885295e+05 2.307331e+05 4.152837e+06 4.634787e+05 5.198207e+06 1.340214e+06 9.062278e+05 4.172019e+06 4.448770e+05 2.272618e+07 9.979919e+05 5.418120e+06 1.673040e+07 1.691338e+07 7.486190e+06 1.224826e+07 7.372614e+06 4.072162e+05 4.831340e+06 1.069836e+07 1.983071e+07 6.563356e+06 3.954490e+06 2.092503e+05 5.309234e+05 9.645055e+05 1.638815e+05 6.869435e+06 6.175023e+05 8.919388e+05 9.711065e+06 4.893735e+05 1.583313e+05 2.028311e+06 7.927022e+04 8.727265e+06 9.116503e+06 8.755384e+06 4.138907e+05 1.137037e+07 1.478825e+06 1.115964e+07 4.001403e+06 2.340304e+05 1.360763e+05 1.170712e+07 1.375359e+06 2.114664e+07 1.500587e+07 1.916370e+07 3.211768e+06 7.135671e+06 3.798088e+06 1.423548e+07 1.392812e+07 1.287489e+07 1.207257e+06 8.512719e+06 1.329859e+06 2.274534e+07 3.181639e+06 7.233566e+04 6.929067e+04 5.626597e+06 2.018353e+07 4.009388e+05 1.046596e+05 7.341500e+06 1.365582e+06 5.193569e+06 2.054410e+06 C8 H11 N3 S_1.986 1.270215e+07 1.557632e+06 1.425776e+06 1.527296e+06 6.683764e+04 1.486390e+06 1.679784e+06 1.618882e+06 67241.49 1.362986e+06 1.718176e+06 1.436179e+06 64959.92 1.450031e+06 1.594304e+06 1.514005e+06 3.972269e+04 1.555420e+06 1.328809e+06 2.009371e+06 1.112223e+05 1.283162e+06 1.501617e+06 1.575177e+06 34207.740 1.467564e+06 1.568182e+06 1.480938e+06 3.267866e+04 1.333338e+06 1.661053e+06 1.725314e+06 45418.30 1.525474e+06 1.511661e+06 1.529261e+06 5.799239e+04 1.323709e+06 1.626683e+06 1.651497e+06 4.098664e+04 1.331505e+06 1.615862e+06 1.914233e+06 3.513373e+04 1.191310e+06 1.319840e+06 1.699651e+06 1.192221e+05 1.211642e+06 3.365979e+06 6.156498e+05 8.939265e+05 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1.435365e+06 1.056137e+06 1.699855e+05 5.460588e+05 1.403724e+06 1.284038e+06 7.828492e+05 1.702855e+06 1.202342e+06 8.605405e+05 1.758868e+06 1.078978e+06 1.190442e+06 7.185504e+06 1.013765e+06 2.227575e+06 2.424069e+06 8.465235e+05 1.357171e+06 1.371283e+06 8.977370e+05 1.350188e+06 1.242815e+06 1.252598e+06 8.981811e+05 1.591767e+06 1.321666e+06 2.643837e+06 2.419482e+06 1.310921e+06 1.250632e+06 2.319833e+06 1.352070e+06 4.177877e+05 5.396610e+05 6.742648e+05 1.630243e+06 1.367866e+06 1.943172e+06 9.660385e+05 1.505820e+06 1.250079e+06 1.271136e+06 7.322531e+05 4.098609e+05 2.697577e+06 8.698538e+05 7.400581e+05 C42 H80 N8 O8 P2_1.991 2.381505e+06 6.693159e+05 7.531081e+05 6.920921e+05 5.205011e+04 3.785815e+05 8.322859e+05 6.696780e+05 53863.18 6.539488e+05 6.635377e+05 6.426870e+05 54751.88 6.220550e+05 6.516907e+05 5.889487e+05 2.854489e+04 7.060218e+05 7.796530e+05 6.421114e+05 1.052389e+05 6.605369e+05 7.181725e+05 3.590885e+05 33719.163 7.489613e+05 6.706253e+05 6.810660e+05 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9.368307e+05 3.349363e+05 2.091736e+05 4.374424e+05 9.975206e+05 4.907923e+05 6.579904e+05 6.187699e+05 1.271579e+06 2.760314e+05 5.048520e+05 7.280239e+05 2.168100e+05 9.902134e+05 1.043342e+06 8.515249e+05 9.019790e+05 1.039951e+06 1.105878e+06 3.017151e+05 8.027941e+05 4.474509e+05 7.838318e+05 2.762955e+05 4.425370e+05 1.113827e+06 6.213677e+05 2.693273e+05 6.564704e+05 1.582156e+06 1.594800e+06 6.720665e+05 5.637580e+05 7.250286e+05 4.451774e+05 7.871129e+05 2.763095e+05 3.271272e+05 1.062600e+06 7.712707e+05 8.598188e+05 4.985250e+05 4.373385e+05 5.562638e+05 3.839402e+05 4.575475e+05 9.527208e+05 8.254975e+05 6.338778e+05 4.826525e+05 7.219656e+05 4.295966e+05 1.098154e+06 7.506978e+05 6.251698e+05 7.599648e+05 1.384535e+06 1.007109e+06 6.520898e+05 6.166865e+05 2.658718e+05 9.194260e+05 4.426744e+05 4.729931e+05 6.839699e+05 9.987567e+05 1.001412e+06 6.168985e+05 3.648982e+05 1.144697e+06 6.035033e+05 1.369877e+06 8.253700e+05 8.317735e+05 9.031738e+05 5.946485e+05 8.143860e+05 3.882829e+05 7.113632e+05 8.682388e+05 C63 H72 O S3_1.991 1.708360e+07 1.287468e+06 7.282954e+05 6.325019e+05 1.485120e+05 4.472063e+05 1.204205e+06 7.947533e+05 131714.21 8.388291e+05 4.435097e+05 7.119996e+05 116775.25 1.115742e+06 8.599215e+05 8.454674e+05 4.018096e+04 6.464988e+05 8.054704e+05 8.989742e+05 1.180425e+05 1.090876e+06 9.820196e+05 2.050254e+05 33639.898 8.417030e+05 9.409380e+05 1.035724e+06 2.075231e+04 6.215852e+05 7.464317e+05 7.773402e+05 25866.50 1.041423e+06 7.229751e+05 7.012651e+05 2.795942e+04 9.624240e+05 7.773449e+05 9.191041e+05 1.960313e+04 8.942281e+05 6.267866e+05 9.548058e+05 1.848631e+04 6.444880e+05 1.058484e+06 6.839432e+05 4.315350e+05 1.655360e+06 1.157207e+06 3.754510e+05 8.100381e+05 9.526494e+05 1.082296e+06 7.099544e+05 9.777459e+05 7.752232e+05 1.567764e+06 9.926631e+05 6.342574e+05 8.009187e+05 3.621287e+05 1.240642e+06 5.120201e+05 7.108333e+05 4.659470e+05 8.285697e+05 5.598611e+05 1.216569e+06 2.923789e+05 1.274663e+06 8.346045e+05 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7.565690e+05 9.791032e+05 1.502272e+06 3.901529e+05 7.025931e+05 7.519445e+05 3.495333e+05 2.153623e+06 9.896130e+05 1.329071e+06 7.585300e+05 3.809942e+06 1.779182e+06 6.366859e+05 1.189365e+06 2.970032e+05 3.022576e+06 5.189141e+05 5.175339e+05 8.968998e+05 1.812138e+06 1.637929e+06 6.262662e+05 2.456629e+05 1.551703e+06 8.749125e+05 2.411921e+06 6.391818e+05 4.820065e+05 2.345620e+06 8.435917e+05 1.652112e+06 3.791142e+05 1.097729e+06 1.373611e+06 C7 H10 N2 O9 P2 S_1.992 5.316190e+04 9.505921e+05 2.486231e+06 3.520576e+06 4.208353e+04 2.655097e+06 2.559736e+06 3.120066e+06 40590.41 1.701952e+06 2.804501e+06 2.938189e+06 43968.11 2.323481e+06 1.839223e+06 2.846276e+06 3.641590e+04 2.698699e+06 1.793812e+06 2.770881e+06 1.474780e+05 2.286716e+06 1.875164e+06 3.341968e+06 78204.820 2.582830e+06 2.269698e+06 1.845393e+06 7.977925e+04 2.510821e+06 2.933770e+06 4.291888e+06 179071.05 1.396293e+06 1.812531e+06 7.798805e+05 5.041122e+05 3.327013e+06 1.502224e+06 5.515975e+06 5.604850e+05 4.294896e+06 8.570451e+06 1.812082e+06 5.101515e+05 5.449364e+06 5.548018e+06 2.786649e+06 1.001667e+07 1.472848e+06 3.789955e+06 9.038031e+06 2.160257e+06 1.883905e+06 3.291571e+06 2.307508e+06 1.381868e+06 4.258293e+06 5.328110e+05 3.683837e+06 4.134035e+06 5.693225e+06 2.202016e+06 2.178256e+06 3.530611e+06 7.419457e+06 4.195886e+06 2.279825e+06 2.708984e+06 3.441978e+06 4.376172e+06 2.771824e+06 5.546576e+06 5.088153e+06 1.775402e+06 3.478638e+06 1.855602e+06 2.270812e+06 4.913536e+04 3.598549e+06 3.968271e+06 1.859165e+06 7.758695e+05 1.918326e+06 3.566174e+06 2.585504e+06 3.300298e+06 7.430398e+05 1.301279e+06 7.358311e+05 1.603430e+06 2.873509e+06 4.071900e+06 1.950877e+06 2.470427e+06 4.776368e+06 2.578857e+06 5.644661e+06 5.193247e+06 1.648963e+06 1.396397e+06 4.010674e+06 5.093791e+06 2.647867e+06 4.659360e+06 2.523499e+05 5.733211e+05 4.973270e+05 2.187831e+06 1.938157e+06 2.051769e+06 7.023185e+05 1.717674e+06 1.075484e+07 3.285091e+06 2.973380e+06 2.680268e+06 1.187645e+07 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4.644619e+06 3.608236e+06 5.726110e+06 44974.67 4.356570e+06 2.633054e+06 5.301750e+06 3.342357e+04 3.947092e+06 2.689888e+06 5.123631e+06 1.177039e+05 5.436413e+06 2.798645e+06 5.639558e+06 68600.206 2.930073e+06 3.078651e+06 4.893787e+06 7.059997e+04 3.893691e+06 6.469645e+06 3.034626e+06 146833.13 3.030387e+06 3.183290e+06 9.609231e+05 2.381402e+05 1.107413e+07 2.747402e+06 3.130483e+06 2.467045e+05 4.053443e+06 2.972940e+06 3.810527e+06 2.346127e+05 2.946784e+06 1.012895e+07 6.825252e+05 3.502817e+06 1.675747e+06 1.620320e+06 1.445091e+06 4.342549e+06 2.554112e+06 2.281616e+06 2.303684e+06 2.557648e+06 5.450179e+06 2.750135e+05 4.818741e+06 3.218149e+06 1.222375e+06 4.261010e+06 5.279412e+05 4.369944e+06 1.527039e+06 6.510756e+06 8.202888e+05 3.396450e+06 4.574407e+06 6.542340e+06 2.814660e+06 2.268028e+06 7.867692e+06 2.087557e+06 1.167970e+07 4.220054e+06 2.521905e+06 4.710431e+04 4.225836e+06 5.910895e+06 4.809117e+06 1.525074e+06 4.852022e+06 3.824428e+06 3.086397e+06 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1.327026e+06 2.439696e+06 3.458757e+06 2.502221e+06 1.221518e+06 2.682421e+06 1.851043e+06 2.583018e+06 1.996607e+06 2.618380e+06 8.894896e+06 2.666916e+06 1.487967e+06 3.994208e+06 2.430506e+06 1.301558e+07 3.053265e+06 7.076973e+06 3.343500e+06 2.185468e+07 2.437906e+06 5.615819e+06 9.110768e+06 3.055244e+06 2.696259e+06 4.293850e+06 3.217458e+06 1.708258e+07 2.456393e+06 5.609105e+06 2.003957e+06 5.949882e+06 3.609399e+06 4.115864e+06 4.336362e+06 1.941580e+06 6.235415e+06 2.817828e+06 2.667647e+06 1.105868e+06 1.331924e+06 4.593617e+06 4.191396e+06 2.599016e+06 4.249649e+06 1.917693e+06 5.440111e+06 3.502785e+06 3.083449e+06 2.622492e+06 2.217414e+06 9.407581e+06 1.715930e+06 2.183646e+06 Diatrizoic acid_1.993 1.703965e+05 4.046918e+08 5.161209e+08 5.951033e+08 1.479122e+05 2.492522e+08 5.533832e+08 4.478130e+08 161379.01 5.321397e+08 3.855538e+08 5.659797e+08 184338.15 4.105954e+08 4.178945e+08 3.900033e+08 1.609373e+05 5.365595e+08 5.450365e+08 3.944366e+08 5.133941e+05 4.340778e+08 5.301544e+08 5.086104e+08 238066.173 3.894116e+08 3.914806e+08 2.959058e+08 2.493453e+05 6.033651e+08 6.336971e+08 4.727319e+08 446075.31 3.827396e+08 4.174404e+08 5.922483e+08 7.600055e+05 3.101629e+08 6.604970e+08 3.290697e+08 9.794424e+05 4.140990e+08 3.599894e+08 5.954940e+08 7.517232e+05 5.393594e+08 7.507172e+08 2.926044e+08 5.463208e+08 2.763052e+08 2.994588e+08 6.093999e+08 4.501673e+08 2.936535e+08 3.484675e+08 2.199600e+08 3.705067e+08 4.360103e+08 1.740478e+08 6.100524e+08 3.679231e+08 2.248431e+08 5.548027e+08 2.056060e+08 5.144588e+08 3.010104e+08 6.618052e+08 2.959114e+08 3.306831e+08 2.511617e+08 5.649008e+08 3.620857e+08 1.431252e+09 9.391481e+08 4.836279e+08 5.415131e+08 2.880504e+08 3.857597e+08 1.954818e+05 3.566680e+08 5.577554e+08 5.217556e+08 1.786955e+08 4.843813e+08 4.778171e+08 4.429925e+08 1.212313e+08 2.901283e+08 2.459972e+08 2.608580e+08 4.274497e+08 4.309187e+08 2.116058e+08 3.647000e+08 4.310866e+08 6.053335e+08 5.807382e+08 7.128101e+08 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1.324523e+07 4.250095e+04 1.286572e+07 2.911108e+06 8.165415e+06 1.327955e+05 8.171066e+06 1.169838e+07 1.014477e+07 36595.588 9.552728e+06 9.526556e+06 9.820526e+06 3.872252e+04 8.510993e+06 9.775529e+06 7.409419e+06 67767.73 1.281940e+07 5.021564e+06 9.822535e+06 1.028252e+05 1.248880e+07 6.667154e+06 1.031646e+07 8.826042e+04 1.034193e+07 8.450004e+06 1.009303e+07 1.025385e+05 9.733679e+06 9.395586e+06 8.491013e+06 8.502919e+06 1.668681e+07 4.775995e+06 8.263695e+06 8.473495e+06 6.270617e+06 1.413263e+07 1.539480e+07 6.987991e+06 1.209378e+07 1.337813e+06 1.201855e+06 1.040534e+07 6.155844e+06 1.457899e+07 1.477128e+06 6.429642e+06 2.632726e+06 1.337178e+07 1.593760e+06 9.683336e+06 6.110457e+06 7.750356e+06 1.562202e+07 1.238205e+07 1.215929e+07 8.992681e+06 1.023625e+07 1.478961e+07 4.937800e+06 6.453561e+04 6.332971e+06 1.305159e+07 1.293051e+07 2.178946e+06 8.344800e+06 7.830339e+06 5.882868e+06 8.014210e+06 7.648725e+06 1.138185e+07 1.004391e+07 8.288925e+06 9.339855e+06 4.528193e+06 1.303958e+07 1.503622e+07 7.646146e+06 4.468748e+06 1.086219e+07 1.014091e+07 9.992192e+06 1.217550e+07 9.699478e+06 1.165296e+07 9.938895e+06 9.170347e+06 9.795554e+06 7.102568e+06 1.484648e+06 9.687684e+06 9.566258e+06 4.655853e+06 1.795395e+06 7.935263e+06 6.448906e+06 9.384123e+06 2.336536e+07 9.695497e+06 1.521780e+07 4.134032e+06 1.065691e+07 4.239051e+06 1.328714e+07 1.603052e+07 8.526670e+06 4.085904e+06 3.975245e+06 1.083432e+07 4.576211e+06 1.663544e+07 1.124876e+07 1.138881e+07 2.207812e+05 4.259919e+06 1.047114e+07 1.574753e+07 5.641248e+06 3.253018e+06 1.926544e+06 4.629728e+06 1.215950e+07 6.119750e+06 9.578453e+06 1.210056e+07 1.119056e+07 9.593303e+06 5.252972e+06 1.679356e+07 9.403477e+06 1.076412e+07 7.564014e+06 7.068710e+06 4.454921e+06 1.267791e+07 7.704358e+06 1.046115e+07 4.168029e+06 8.582342e+06 1.090443e+07 6.746357e+06 1.468376e+07 6.442588e+06 1.052554e+07 1.124391e+07 1.021594e+07 5.826762e+05 6.631058e+06 6.336303e+06 8.696935e+06 2.082406e+06 1.002531e+07 1.459363e+07 1.209344e+07 6.565397e+06 4.410231e+06 1.362225e+07 3.248321e+06 1.802964e+06 1.046801e+07 1.220397e+07 2.584452e+06 1.475050e+07 1.284578e+06 3.476203e+06 9.712775e+06 1.313500e+07 9.305582e+05 9.128835e+06 8.162913e+05 1.149871e+07 9.564030e+06 1.241692e+05 8.167376e+06 9.749989e+06 1.334382e+07 1.177660e+07 1.643010e+07 1.660587e+06 9.991433e+06 4.437078e+06 5.117350e+06 7.105707e+06 1.045185e+07 6.589438e+06 3.001318e+06 1.249152e+07 1.211944e+07 1.056533e+07 1.772703e+07 1.185873e+07 9.161007e+06 4.471249e+06 9.376516e+06 6.335497e+06 9.993906e+06 1.979676e+07 2.722081e+06 8.840359e+05 6.248750e+05 9.665958e+06 3.840357e+06 5.059560e+06 1.426618e+07 1.132906e+07 1.823380e+06 9.448835e+06 3.832535e+06 7.958747e+06 1.147968e+07 1.236332e+07 4.658706e+06 9.455421e+06 2.125343e+06 1.101438e+07 1.392103e+07 6.760175e+06 1.070616e+07 7.390923e+06 1.175753e+07 1.175748e+07 1.099103e+07 1.098625e+07 1.038582e+07 8.975715e+06 6.498771e+06 1.428019e+07 1.259564e+07 3.738548e+06 2.003619e+06 1.254099e+07 1.252983e+07 8.286665e+06 6.037845e+06 2.678949e+06 1.343914e+07 1.071759e+07 1.187131e+07 1.377165e+07 1.184344e+07 1.403059e+07 9.545621e+06 8.246374e+06 1.068242e+07 C19 H37 N5 O6_1.995 4.753388e+05 1.340944e+06 1.280346e+06 1.251181e+06 7.459957e+04 8.438592e+05 9.751468e+05 1.124194e+06 74329.56 1.239372e+06 1.158086e+06 1.212310e+06 1032992.89 1.189239e+06 1.022408e+06 1.240952e+06 1.807025e+06 1.261327e+06 1.151793e+06 1.068159e+06 1.184745e+05 9.797388e+05 1.303305e+06 1.227378e+06 32817.920 1.234390e+06 1.075890e+06 1.088261e+06 2.811104e+04 1.184645e+06 1.148348e+06 1.196118e+06 45925.84 1.221015e+06 1.082266e+06 1.129035e+06 7.080394e+04 1.155450e+06 1.230564e+06 1.190716e+06 4.127335e+04 1.000143e+06 1.171858e+06 1.450656e+06 5.009157e+04 1.015990e+06 1.117694e+06 1.129976e+06 2.882252e+05 3.693943e+05 3.899681e+05 2.611197e+05 1.675724e+05 7.420993e+04 1.808701e+06 3.268302e+05 2.515688e+06 2.155554e+05 3.209282e+05 1.766328e+05 2.414959e+05 2.234974e+05 1.123694e+05 2.288914e+05 1.209347e+05 2.785791e+05 2.813318e+05 6.513635e+04 8.558878e+04 2.754488e+05 2.063681e+05 2.676403e+05 8.999045e+06 1.599808e+05 5.199844e+05 4.191917e+05 9.423625e+04 5.064240e+06 4.711675e+05 4.551382e+05 1.303263e+05 3.856320e+05 1.713192e+05 3.115749e+05 1.235001e+05 1.903403e+05 1.479153e+06 3.077452e+05 3.523163e+05 1.003703e+06 3.947014e+05 1.612965e+05 6.205369e+05 2.279587e+05 7.566814e+06 2.203071e+05 1.242413e+05 2.723524e+05 7.530400e+04 2.424479e+05 5.326314e+05 3.682795e+05 2.405849e+05 4.279866e+05 3.739631e+05 3.937007e+05 3.252861e+05 1.009554e+06 2.113652e+05 4.222340e+05 1.127777e+05 3.591350e+05 2.617948e+05 3.154433e+05 2.134636e+05 1.067554e+05 1.330606e+08 2.924526e+05 2.914003e+05 5.429403e+05 1.623727e+05 6.497345e+05 1.010932e+05 1.977507e+05 2.295185e+05 4.113892e+05 4.330614e+05 1.764177e+05 3.061892e+05 1.848980e+05 3.246369e+05 6.137633e+04 2.920957e+05 1.861484e+05 2.819916e+05 3.421113e+05 4.474040e+05 1.891392e+06 3.262487e+05 5.133556e+05 2.589189e+05 5.138344e+05 8.103715e+05 4.422051e+05 1.013259e+05 9.786440e+04 2.672973e+05 1.256398e+05 2.421870e+05 2.178710e+05 1.793344e+05 1.660837e+06 1.748286e+06 3.092391e+05 1.586655e+06 7.082313e+05 4.127778e+05 5.122231e+05 4.837274e+05 1.193265e+05 2.532512e+05 4.623274e+05 1.144225e+05 2.364643e+05 6.772927e+06 9.908181e+04 1.662081e+05 3.960866e+05 1.315960e+05 2.391858e+05 1.380996e+06 1.962879e+06 2.097729e+05 3.775836e+05 1.853844e+05 3.303002e+05 1.348706e+05 1.570775e+05 3.482949e+05 2.491971e+05 4.165981e+05 1.923504e+05 2.329921e+05 5.331030e+05 4.290506e+05 2.631582e+05 2.225180e+05 4.791095e+05 8.443860e+05 2.352827e+05 5.917819e+05 1.918722e+05 2.882759e+05 4.112404e+05 6.949221e+05 3.821259e+05 1.474827e+06 3.796424e+05 4.085627e+05 5.493345e+05 3.342528e+06 1.094682e+06 4.145236e+05 3.103221e+05 2.190288e+05 1.159856e+05 1.759987e+05 9.893293e+05 5.364284e+05 9.734958e+04 2.261075e+05 3.673460e+05 2.197239e+05 4.463317e+05 2.166789e+05 2.307191e+05 9.989632e+05 3.553133e+05 1.596915e+05 2.681025e+05 6.994641e+05 1.876388e+05 3.983870e+05 3.642015e+05 2.357628e+05 4.455526e+05 5.443148e+05 5.910779e+05 5.314879e+05 9.433773e+04 3.084393e+05 1.624305e+05 1.522960e+05 9.760461e+04 4.820493e+05 3.000902e+05 4.022421e+05 4.243154e+05 9.527876e+05 1.941909e+05 2.290537e+05 3.240574e+05 1.433604e+05 2.766971e+05 9.791504e+04 2.576546e+05 3.107887e+05 4.682700e+05 4.057797e+06 9.466165e+05 1.947875e+05 1.171915e+05 9.385760e+04 1.883578e+05 7.660307e+05 1.615789e+05 7.489238e+05 8.720061e+04 1.743480e+05 2.233114e+05 2.733682e+05 8.745587e+05 C9 H10 N2 O3_1.997 5.583404e+05 2.425573e+05 1.508631e+05 1.763080e+05 1.069183e+05 1.474346e+05 2.021217e+05 2.291782e+05 98088.60 1.368523e+05 2.258284e+05 1.156176e+05 85370.72 2.249788e+05 9.862208e+04 2.529022e+05 4.366977e+04 1.084828e+05 2.075667e+05 2.757514e+05 1.018512e+05 1.541291e+05 2.408032e+05 3.312700e+05 23864.038 1.208888e+05 2.040754e+05 1.405273e+05 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813.74674_2.306 6.559336e+04 1.840792e+06 2.579743e+06 2.164062e+06 9.003621e+04 1.675036e+06 2.580717e+06 2.021024e+06 89141.07 2.471775e+06 1.772354e+06 1.391118e+06 94392.17 2.974912e+06 1.986652e+06 1.914505e+06 7.028712e+04 2.451336e+06 2.034327e+06 1.812139e+06 1.389920e+05 3.490201e+06 1.500561e+06 1.185976e+06 122675.386 2.576371e+06 2.081803e+06 2.084876e+06 1.990353e+05 2.025834e+06 2.998222e+06 1.288317e+06 144998.43 2.751103e+06 1.982287e+06 1.675765e+06 2.138391e+05 2.876527e+06 1.894519e+06 1.075973e+06 2.076422e+05 3.360990e+06 1.385803e+06 1.706782e+06 7.319162e+04 3.407744e+06 2.993460e+06 8.146803e+05 1.047082e+06 3.579122e+06 2.882011e+06 1.447494e+06 1.540808e+06 1.934993e+06 2.360484e+06 2.015225e+06 4.168239e+06 2.633891e+06 2.332479e+06 2.922136e+06 2.001400e+06 2.901616e+06 3.327046e+06 4.635947e+06 8.254568e+05 1.700791e+06 2.436278e+06 2.449160e+06 3.887461e+06 3.898990e+06 8.482023e+05 2.923898e+06 3.224287e+06 2.177341e+06 2.902275e+06 8.095212e+05 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4.795636e+06 2.721731e+06 3.001195e+06 3.003601e+06 3.899833e+06 5.899907e+06 2.470897e+06 3.375134e+06 2.536415e+06 2.919981e+06 3.227883e+06 4.300458e+06 2.127616e+06 2.746250e+06 2.837622e+06 3.429374e+06 2.608433e+06 2.171714e+06 2.580230e+06 4.018104e+06 3.691830e+06 3.140816e+06 2.323231e+06 2.883068e+06 2.101604e+06 4.009161e+06 8.932820e+05 2.534665e+05 9.706028e+05 1.338751e+06 2.024395e+06 1.472702e+05 2.802352e+05 1.535351e+06 1.491218e+06 3.653160e+06 1.330997e+06 3.164362e+06 2.492553e+05 5.188078e+05 1.433831e+06 4.419175e+05 1.436653e+06 5.901798e+06 1.215138e+06 1.621358e+06 3.887371e+06 2.389826e+06 3.442271e+06 4.253092e+06 1.581389e+06 1.483306e+06 5.740459e+05 6.244572e+05 2.332981e+06 1.937325e+06 1.800186e+06 4.786569e+05 1.109097e+06 2.583678e+06 1.130219e+06 4.312877e+05 8.114012e+05 7.798937e+06 5.271048e+06 2.209870e+05 9.117699e+05 1.469896e+06 6.964878e+05 1.973484e+06 2.826098e+06 4.023059e+05 1.800707e+06 1.345330e+06 9.716219e+05 1.855070e+06 1.123963e+06 7.004569e+05 9.493662e+05 5.425573e+05 8.559712e+05 2.334649e+06 1.133507e+06 1.710634e+06 5.685440e+05 2.718624e+06 2.589238e+06 2.620632e+06 2.027896e+06 1.922578e+06 4.012504e+06 2.516370e+06 2.218163e+06 5.233485e+06 5.488927e+06 2.963640e+06 3.102486e+06 1.359615e+06 1.930555e+06 3.003906e+06 3.113336e+06 3.357414e+06 1.396188e+06 3.230183e+06 3.564582e+06 7.936919e+05 4.640011e+05 4.331657e+06 3.776212e+06 C7 H8 N8 O P2_2.309 4.893826e+04 3.380281e+06 2.836696e+06 3.897850e+06 6.869231e+04 2.717223e+06 3.951516e+06 1.910802e+06 75310.85 4.068695e+06 2.382725e+06 2.311938e+06 79717.00 6.062042e+06 2.285016e+06 3.042776e+06 9.021550e+04 3.048922e+06 3.492865e+06 3.310949e+06 1.429148e+05 4.077895e+06 3.105565e+06 1.277952e+06 182911.345 4.549713e+06 2.161490e+06 4.027484e+06 2.306554e+05 3.992296e+06 2.503542e+06 2.390190e+06 157489.52 4.069241e+06 3.340545e+06 2.713684e+06 2.008466e+05 4.768310e+06 2.510918e+06 1.839470e+06 2.012101e+05 5.243892e+06 1.674811e+06 2.806313e+06 8.245635e+04 4.911722e+06 4.332010e+06 1.522466e+06 1.915095e+06 7.007903e+06 6.935051e+06 1.900685e+06 3.182311e+06 3.205361e+06 6.054924e+06 4.134886e+06 7.011134e+06 4.138452e+06 3.343090e+06 3.714706e+06 4.433983e+06 6.443814e+06 6.806539e+06 7.984482e+06 1.154409e+06 3.941734e+06 2.091148e+06 4.028495e+06 5.775734e+06 8.969341e+06 1.434051e+06 4.341800e+06 6.663826e+06 3.676363e+06 5.081969e+06 1.866082e+06 6.244174e+06 5.522331e+06 1.819733e+05 3.400947e+06 5.006833e+06 5.730590e+06 1.479223e+07 5.598997e+06 4.491835e+06 1.059066e+07 3.404821e+06 7.394910e+06 8.811657e+06 1.031212e+07 5.044051e+06 2.631543e+06 7.715211e+06 5.357607e+06 6.903197e+06 4.698877e+06 2.151920e+06 2.318713e+06 8.330861e+05 2.505182e+06 1.065366e+07 2.061709e+06 1.201280e+06 1.309806e+06 5.834401e+06 6.992521e+06 8.782835e+06 1.149939e+07 4.530163e+06 3.012097e+06 2.335669e+06 1.949355e+07 3.218334e+06 1.284624e+06 7.765580e+05 3.038822e+06 4.866372e+06 4.821277e+05 2.782089e+06 3.232595e+06 2.718896e+06 2.140345e+06 1.417933e+06 1.155760e+06 3.017391e+06 3.188290e+06 6.797500e+06 6.427603e+06 2.433947e+06 2.412233e+06 3.891729e+06 2.276783e+05 4.900611e+06 3.865201e+06 4.216866e+06 3.467706e+06 4.016810e+06 3.015944e+06 2.680638e+06 4.074935e+06 2.570877e+06 1.508302e+06 3.223393e+06 2.999409e+06 2.498490e+06 1.292278e+06 2.654996e+05 6.987657e+05 6.365651e+05 4.775475e+06 3.743282e+06 7.373573e+06 9.577431e+06 4.539593e+06 5.061812e+06 3.732423e+06 1.465328e+07 1.446727e+07 1.470423e+07 3.123388e+06 7.203033e+06 3.879250e+06 5.974853e+06 5.904578e+06 8.026534e+06 4.011228e+06 4.216047e+06 4.143197e+06 5.447213e+06 3.453603e+06 2.875410e+06 3.505718e+06 4.278555e+06 8.595684e+06 6.550725e+06 3.815315e+06 6.368722e+06 3.783105e+06 1.113954e+07 1.383309e+06 5.566820e+05 2.533733e+06 4.514028e+06 3.452794e+06 4.304265e+05 4.215727e+05 3.459583e+06 2.537203e+06 1.217007e+07 2.802133e+06 1.543934e+07 3.600759e+05 9.523351e+05 2.124778e+06 6.488263e+05 2.841382e+06 2.337248e+07 2.627446e+06 3.187702e+06 1.966904e+07 1.425898e+07 5.683398e+06 1.228777e+07 2.369339e+06 1.480461e+06 8.561533e+05 1.141027e+06 2.391530e+06 4.935131e+06 2.185983e+06 7.901017e+05 2.119800e+06 6.380901e+06 2.333306e+06 6.109723e+05 1.817880e+06 1.912429e+07 6.821364e+06 3.456052e+05 1.611938e+06 3.213818e+06 1.236387e+06 3.468763e+06 5.522535e+06 8.103784e+05 3.633259e+06 2.171422e+06 3.028695e+05 3.078198e+06 1.804582e+06 1.500600e+06 1.712181e+06 1.000397e+06 1.422342e+06 5.002767e+06 1.889128e+06 2.915631e+06 1.031837e+06 4.833781e+06 3.743213e+06 3.804062e+06 2.568330e+06 2.577712e+06 1.117898e+07 3.584741e+06 4.619063e+06 9.671516e+06 1.541798e+07 1.006749e+07 8.273297e+06 2.457237e+06 3.621937e+06 3.484938e+06 6.958196e+06 8.742001e+06 2.488786e+06 6.447802e+06 4.195710e+06 1.048962e+06 3.235298e+05 1.033247e+07 7.749648e+06 C9 H7 N O5 S_2.316 1.162527e+05 1.469860e+07 1.991558e+07 2.121519e+07 1.605110e+05 1.222450e+07 2.158326e+07 1.447986e+07 170722.88 2.465471e+07 1.260452e+07 1.453536e+07 184590.98 2.083591e+07 1.656224e+07 2.036883e+07 1.855912e+05 1.497163e+07 1.779112e+07 1.554904e+07 2.676778e+05 2.902704e+07 1.484586e+07 6.177649e+06 345034.129 2.081697e+07 1.639812e+07 2.043021e+07 4.301137e+05 2.017114e+07 1.688778e+07 1.282272e+07 306791.34 2.188480e+07 1.846875e+07 1.487848e+07 4.036781e+05 2.334268e+07 1.478168e+07 9.124316e+06 3.999889e+05 2.902100e+07 1.184926e+07 1.465614e+07 1.544552e+05 2.504766e+07 2.504695e+07 7.797287e+06 8.464770e+06 5.320246e+07 3.264021e+07 1.128096e+07 1.359457e+07 1.655914e+07 2.198119e+07 1.793130e+07 3.679595e+07 2.517277e+07 2.168587e+07 2.832421e+07 2.104284e+07 3.074323e+07 3.460057e+07 5.587014e+07 4.748389e+06 2.075231e+07 1.911905e+07 2.233544e+07 3.560075e+07 4.387284e+07 6.115605e+06 2.972108e+07 3.211315e+07 1.956129e+07 2.952200e+07 7.845039e+06 3.323055e+07 2.794135e+07 6.937912e+05 1.914970e+07 2.451572e+07 3.306332e+07 5.577392e+07 2.829261e+07 2.627089e+07 3.563463e+07 1.966198e+07 4.374794e+07 4.945932e+07 5.455249e+07 2.386361e+07 1.472608e+07 3.970751e+07 3.809438e+07 3.836513e+07 2.207900e+07 1.332772e+07 8.066415e+06 4.018268e+06 2.075967e+07 3.796993e+07 9.785004e+06 6.662246e+06 5.859117e+06 3.140785e+07 4.646880e+07 4.451838e+07 5.964798e+07 2.629886e+07 2.116278e+07 1.148391e+07 9.950591e+07 2.570210e+07 7.148820e+06 4.276438e+06 2.014269e+07 2.495589e+07 3.384595e+06 1.442876e+07 1.762919e+07 1.419415e+07 1.331817e+07 4.694652e+06 3.765904e+06 1.501245e+07 1.695424e+07 3.590347e+07 1.926306e+07 1.613208e+07 1.297080e+07 1.900986e+07 4.944478e+05 2.411676e+07 1.908234e+07 2.553086e+07 1.489432e+07 2.116573e+07 1.519616e+07 1.473869e+07 2.382647e+07 1.103174e+07 8.835751e+06 1.532892e+07 1.578620e+07 1.432965e+07 6.944934e+06 1.567679e+06 4.802847e+06 4.567658e+06 1.854600e+07 3.341616e+07 4.219655e+07 4.055585e+07 2.733618e+07 2.484069e+07 2.550057e+07 5.971788e+07 8.101871e+07 8.204587e+07 2.474676e+07 3.928316e+07 2.111943e+07 2.925941e+07 3.063559e+07 4.654482e+07 2.012241e+07 2.659072e+07 1.918305e+07 3.097930e+07 2.026834e+07 1.591530e+07 1.991448e+07 2.673720e+07 4.017844e+07 3.181451e+07 2.063710e+07 3.050451e+07 2.438861e+07 4.432793e+07 9.783254e+06 2.908854e+06 1.319227e+07 2.970562e+07 1.499319e+07 2.379806e+06 2.420218e+06 2.337091e+07 1.300937e+07 6.567302e+07 1.390259e+07 8.900766e+07 2.135639e+06 4.409841e+06 1.170461e+07 4.907859e+06 1.256831e+07 7.053108e+07 1.379515e+07 1.702387e+07 9.337774e+07 9.255254e+07 2.905269e+07 6.513736e+07 1.305290e+07 1.203822e+07 3.277609e+06 4.791900e+06 1.256614e+07 2.582143e+07 1.391754e+07 4.775060e+06 1.153111e+07 3.478191e+07 1.209064e+07 5.158878e+06 8.252150e+06 1.422515e+08 3.742679e+07 2.496124e+06 7.647726e+06 2.065927e+07 6.628571e+06 1.825833e+07 2.535350e+07 4.205776e+06 1.859573e+07 1.170451e+07 3.167741e+06 1.393983e+07 8.331659e+06 6.491932e+06 1.042344e+07 4.085454e+06 7.347557e+06 2.468724e+07 9.999371e+06 1.752863e+07 5.824205e+06 2.775176e+07 2.016786e+07 2.580368e+07 2.184974e+07 1.750884e+07 5.655226e+07 2.135293e+07 2.438314e+07 4.669419e+07 7.881236e+07 4.977388e+07 3.829638e+07 1.233196e+07 1.703324e+07 3.088628e+07 3.928387e+07 5.231841e+07 1.298715e+07 3.526587e+07 2.397557e+07 5.773719e+06 1.805250e+06 4.798436e+07 3.878892e+07 C8 H9 N O2_2.355 1.731175e+07 1.386705e+06 1.415483e+06 1.303692e+06 7.635868e+04 1.355964e+06 1.513024e+06 1.278189e+06 81696.74 1.749270e+06 1.263684e+06 1.143589e+06 93322.71 1.521537e+06 1.300663e+06 1.381154e+06 9.664964e+04 1.414477e+06 1.180736e+06 1.347774e+06 1.343434e+05 2.266198e+06 1.225118e+06 7.251773e+05 167296.064 1.440224e+06 1.507922e+06 1.461418e+06 1.977638e+05 1.538276e+06 1.422568e+06 1.067134e+06 184197.53 1.447813e+06 1.543384e+06 1.518589e+06 2.841512e+05 1.316461e+06 1.325147e+06 1.124422e+06 2.080394e+05 1.683345e+06 1.241292e+06 1.710445e+06 6.482258e+04 1.247399e+06 1.733399e+06 1.041587e+06 2.961937e+05 1.244046e+05 2.967977e+05 2.737737e+05 2.536761e+05 2.524848e+05 1.418525e+05 3.012712e+05 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2.429797e+05 1.284662e+05 1.217604e+05 2.965305e+06 2.177803e+05 2.212765e+05 1.600734e+05 2.409076e+05 2.101747e+05 1.327181e+05 2.394561e+05 9.909597e+04 2.277729e+05 2.426464e+05 2.175576e+05 9.956746e+04 2.699541e+05 1.117579e+05 2.126122e+05 1.445074e+05 2.798701e+05 1.411254e+05 8.276796e+04 2.856663e+05 9.565846e+04 1.525017e+05 1.325895e+05 2.664321e+05 2.578371e+05 1.359566e+05 2.436666e+05 2.848079e+05 1.307928e+05 2.276333e+05 2.441710e+05 2.288874e+05 2.907105e+05 1.302485e+05 1.182256e+05 2.646360e+05 1.965717e+05 2.881323e+05 1.031195e+05 2.560960e+05 2.838620e+05 1.352437e+05 1.219286e+05 2.705483e+05 2.875637e+05 1.079021e+05 9.973810e+04 1.237174e+05 2.318916e+05 9.893834e+04 3.028689e+05 1.000280e+05 2.638509e+05 2.490314e+05 9.275487e+04 2.661571e+05 2.606576e+05 2.611635e+05 9.343429e+04 2.712071e+05 2.098639e+05 2.667749e+05 1.214698e+05 7.897915e+05 1.322305e+05 2.604435e+05 1.198268e+05 9.251789e+04 1.171474e+05 2.209779e+05 8.906406e+04 1.705287e+05 8.472379e+04 2.371571e+05 7.577021e+06 1.586811e+05 2.567005e+05 2.589780e+05 1.331215e+05 2.852747e+05 2.553555e+05 1.052181e+05 5.729054e+06 8.984631e+04 1.231093e+05 1.847437e+05 2.695298e+05 1.279433e+05 1.065459e+05 2.557876e+05 2.468353e+05 1.253611e+05 7.868477e+04 1.562552e+05 2.555245e+05 2.505423e+05 1.201925e+05 2.380530e+05 2.665925e+05 8.830229e+04 2.696719e+05 9.830020e+04 8.747053e+04 1.537162e+05 1.065414e+05 1.902491e+08 1.054195e+05 1.236405e+05 2.576806e+05 2.302349e+05 2.506007e+05 1.796364e+06 1.167592e+05 9.816130e+04 2.560843e+05 1.075828e+05 1.347295e+05 9.486850e+04 1.184734e+05 1.051658e+05 1.583370e+06 1.242225e+05 2.504360e+05 2.014652e+05 1.115041e+05 C33 H41 O4 P_2.417 5.752582e+04 2.428368e+06 2.501463e+06 2.514327e+06 7.307668e+04 2.341158e+06 1.495985e+06 3.196782e+06 89639.92 1.451295e+06 2.912727e+06 2.178200e+06 97802.01 2.707162e+06 1.523491e+06 2.539431e+06 7.404412e+04 2.450326e+06 2.273923e+06 2.689201e+06 9.398642e+04 2.205864e+06 2.767983e+06 1.908564e+06 69613.557 2.136796e+06 2.431676e+06 2.428052e+06 9.348702e+04 2.526743e+06 2.168702e+06 2.179498e+06 100881.26 2.419371e+06 2.368357e+06 2.416668e+06 1.389871e+05 2.208509e+06 1.998751e+06 2.580919e+06 8.754916e+04 2.382029e+06 2.810300e+06 2.120445e+06 3.010634e+04 2.239039e+06 2.341499e+06 2.270105e+06 4.516338e+06 1.487314e+05 1.323063e+07 1.174409e+05 1.181663e+05 1.401339e+05 1.166222e+05 1.034032e+07 1.366173e+05 8.362983e+04 1.260595e+05 1.155945e+05 1.780828e+05 1.298152e+07 6.326723e+07 1.848019e+07 1.421222e+06 3.343101e+06 9.113296e+04 1.205837e+05 8.575674e+04 3.949814e+06 9.392643e+04 5.873489e+05 1.305665e+06 8.972699e+04 1.044696e+05 1.241665e+05 6.866913e+05 9.971417e+04 1.730595e+06 1.466836e+05 9.448988e+04 8.371643e+04 1.335091e+07 1.730843e+05 8.769788e+04 5.033115e+07 2.131159e+07 1.286171e+05 1.065297e+05 8.537396e+04 6.125648e+05 9.841350e+04 2.716549e+07 1.019581e+05 1.680968e+06 1.104157e+05 1.256102e+05 4.274706e+06 8.511147e+05 1.233288e+05 1.395656e+05 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1.053056e+05 1.300996e+05 7.941905e+05 2.416010e+06 9.569361e+04 1.007927e+05 1.634379e+06 1.583955e+05 1.163699e+05 3.443066e+06 1.064582e+05 1.961342e+05 7.070913e+06 1.001658e+05 1.362926e+05 1.180473e+05 1.522201e+05 9.893123e+04 8.195227e+06 1.167135e+05 1.850419e+05 1.016821e+05 1.272921e+05 9.074795e+04 3.802947e+06 1.615559e+05 9.161086e+04 1.966639e+05 1.014462e+06 1.084170e+05 2.618019e+06 1.055206e+05 1.555130e+05 1.032758e+05 8.655585e+04 1.296791e+05 1.309044e+07 9.997960e+04 9.241419e+06 2.733564e+06 1.514244e+06 9.894453e+04 1.023998e+05 9.894052e+04 1.781601e+06 2.299289e+07 9.024062e+04 1.105953e+05 1.683691e+06 5.626791e+06 1.099130e+07 1.007981e+05 9.847404e+04 1.013969e+06 1.325675e+07 3.912502e+06 2.030245e+05 2.167188e+05 9.641870e+04 1.224443e+05 1.106520e+05 1.933526e+05 8.624958e+04 1.068577e+05 1.209697e+05 1.025774e+05 1.047570e+05 1.286600e+06 1.143403e+05 2.768090e+05 8.347118e+04 9.961609e+04 7.665329e+05 1.254351e+05 9.998267e+04 9.664490e+04 9.431039e+04 1.022245e+05 1.055154e+05 2.364370e+05 9.720948e+05 6.859975e+05 1.061242e+05 1.771964e+06 C12 H27 N O8_2.431 1.256788e+05 6.945195e+05 6.497860e+05 5.778152e+05 1.342394e+05 4.930844e+05 5.038094e+05 6.107831e+05 151940.96 7.327119e+05 6.725268e+05 6.994033e+05 205857.06 4.168764e+05 5.314924e+05 5.788485e+05 1.922781e+05 7.830390e+05 4.414434e+05 5.579396e+05 2.892256e+05 2.814316e+05 7.016212e+05 6.329632e+05 180396.396 6.440462e+05 3.368054e+05 4.664394e+05 2.554976e+05 7.128780e+05 3.301445e+05 5.303978e+05 294688.81 3.971522e+05 6.037263e+05 6.714634e+05 4.432928e+05 4.226994e+05 4.161995e+05 4.610911e+05 3.268250e+05 4.289084e+05 4.767762e+05 8.350936e+05 1.174746e+05 4.886659e+05 5.955761e+05 5.715520e+05 4.039417e+05 4.084997e+05 4.248727e+05 4.241113e+05 3.505401e+05 4.249769e+05 3.607431e+05 4.371231e+05 3.489524e+06 3.814823e+05 3.946756e+05 2.566042e+05 3.768675e+05 4.113905e+05 3.249678e+05 3.984995e+05 3.974986e+05 4.243763e+05 2.698638e+05 4.099354e+05 2.762325e+05 2.876030e+05 1.641603e+05 2.514448e+05 1.717347e+06 2.917740e+05 4.023172e+05 3.529971e+05 2.825591e+05 4.047717e+06 3.320535e+05 3.846623e+05 2.005894e+05 2.514672e+05 3.252653e+05 2.717075e+05 2.508574e+05 5.394216e+05 4.401651e+05 2.881065e+05 2.719852e+05 1.172169e+06 3.818948e+05 2.974855e+05 3.227139e+05 1.950462e+05 4.304568e+06 2.416405e+05 4.959456e+05 3.898827e+05 2.743091e+05 2.263138e+05 2.716050e+05 3.387965e+05 2.938372e+05 3.368970e+05 4.923744e+05 5.512171e+05 3.227560e+05 3.344526e+05 2.915223e+05 4.401958e+05 3.543002e+05 2.909348e+05 4.463068e+05 4.050281e+05 2.045999e+05 1.721965e+05 1.339404e+08 3.862593e+05 3.528343e+05 4.297716e+05 3.898570e+05 6.994275e+05 4.069915e+05 3.027138e+05 4.029550e+05 6.039491e+05 2.158587e+05 4.456123e+05 2.150871e+05 2.358247e+05 3.127502e+05 3.434665e+05 4.048712e+05 3.394282e+05 2.494247e+05 4.706270e+05 3.538731e+05 5.115685e+05 3.621570e+05 3.441351e+05 3.946782e+05 4.053616e+05 2.646253e+05 3.396284e+05 1.875209e+05 4.048215e+05 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4.253034e+05 2.721165e+05 3.418740e+05 6.045586e+05 4.482343e+05 4.064224e+05 1.815991e+05 3.846022e+05 4.829097e+05 3.797200e+05 2.653618e+05 3.019733e+05 3.977090e+05 1.598043e+05 4.851728e+05 2.027915e+05 2.868305e+05 4.173814e+05 1.909803e+05 3.154163e+05 1.688196e+05 2.507105e+05 3.686560e+05 3.928719e+05 3.789530e+05 1.049025e+06 2.335322e+05 3.498924e+05 3.670090e+05 1.770089e+05 1.960541e+05 1.978156e+05 3.195300e+05 4.612561e+05 4.071542e+05 2.464800e+05 3.560594e+05 3.244759e+05 4.753869e+05 794.83702_2.441 9.391661e+04 1.550642e+06 1.164913e+06 1.360850e+06 1.137779e+05 8.956883e+05 1.150762e+06 1.620014e+06 109143.90 1.286071e+06 1.068489e+06 1.519752e+06 129083.59 1.299479e+06 8.344998e+05 1.392306e+06 1.076964e+05 1.272978e+06 1.383076e+06 1.244906e+06 1.522238e+05 1.134204e+06 1.319133e+06 1.564838e+06 90326.918 1.063814e+06 1.067984e+06 1.536040e+06 1.403883e+05 1.089852e+06 1.513039e+06 1.455884e+06 168054.29 8.329302e+05 1.406618e+06 1.165819e+06 2.729777e+05 1.062595e+06 1.688009e+06 1.283430e+06 1.871854e+05 1.000372e+06 1.222455e+06 1.554909e+06 5.715409e+04 1.060733e+06 1.148112e+06 1.395354e+06 1.832740e+05 6.161320e+05 7.570437e+05 7.463679e+05 6.280618e+05 2.478769e+06 1.353390e+05 1.504394e+06 6.324447e+06 6.820575e+06 2.428004e+05 1.854040e+06 2.027819e+06 2.063970e+05 6.509384e+06 2.223830e+05 3.623535e+05 1.834153e+05 1.799799e+06 2.147936e+05 1.371993e+05 7.143252e+05 1.203171e+05 1.371648e+05 1.877394e+05 8.819768e+05 7.191020e+05 1.824882e+06 2.432684e+05 1.683793e+06 1.279221e+05 2.289744e+05 1.169577e+05 1.255638e+05 3.469277e+05 1.558947e+05 5.868315e+05 2.181554e+06 1.860112e+05 1.730822e+05 1.021114e+06 8.247559e+05 1.929147e+05 1.418516e+05 1.730645e+05 3.831713e+05 2.191063e+05 1.318742e+05 1.454676e+06 1.493800e+06 1.493690e+05 1.272663e+05 1.833571e+06 3.772797e+06 3.409831e+06 1.997035e+05 2.451822e+05 2.187234e+05 3.489843e+05 1.147629e+06 1.617725e+05 3.207915e+05 1.746341e+06 1.604640e+05 3.102350e+05 3.008232e+05 1.321874e+05 1.375035e+05 4.094423e+05 2.264860e+05 1.710052e+05 2.462182e+06 6.555395e+05 3.860938e+05 2.091235e+06 1.654456e+05 1.993991e+05 2.607594e+06 1.523643e+06 2.693520e+05 1.290046e+06 2.302529e+06 2.896234e+05 2.110470e+05 1.005735e+06 1.937838e+06 2.318277e+05 1.011973e+06 1.546072e+05 1.924538e+06 2.698062e+06 1.485696e+05 3.611482e+06 1.574107e+06 1.510319e+05 1.606412e+05 4.306831e+05 4.074252e+05 1.873187e+05 1.784680e+05 1.207990e+05 2.257934e+05 1.691440e+06 2.018454e+05 1.416903e+05 1.074129e+06 1.370347e+05 8.174348e+05 2.271230e+05 1.312743e+05 1.412874e+05 8.048128e+05 2.976738e+06 2.087707e+05 2.388774e+06 2.107972e+05 3.077553e+05 2.932594e+06 4.505169e+05 2.134349e+05 5.761121e+05 2.941974e+05 4.839256e+05 1.333857e+05 1.358057e+06 2.177673e+05 1.694575e+05 1.516186e+05 1.923079e+05 1.256387e+06 8.786854e+05 1.599532e+06 1.347537e+06 1.989086e+05 2.680101e+05 6.852469e+06 2.077963e+05 5.681261e+06 9.813088e+06 4.940441e+05 3.478280e+05 1.193117e+06 1.687807e+05 1.238709e+05 2.452425e+05 4.291513e+05 2.787627e+05 8.005188e+05 3.823507e+05 3.560954e+05 4.842188e+05 1.484318e+05 2.376772e+06 3.253373e+05 1.176604e+06 4.151194e+06 4.120619e+06 2.069255e+06 3.177355e+06 6.247151e+05 2.353383e+05 1.347403e+06 2.533803e+06 3.292272e+06 8.352227e+05 9.145941e+05 1.444689e+05 1.264585e+05 3.177528e+05 2.030863e+05 3.255396e+06 1.492654e+05 1.383655e+05 3.042702e+06 2.405115e+05 1.904903e+05 1.353927e+05 1.436559e+05 6.676457e+06 2.216675e+06 2.486738e+06 1.316791e+05 2.258959e+06 3.881574e+05 3.700007e+06 9.133852e+05 1.682268e+05 2.441370e+05 1.777672e+06 4.199101e+05 3.666986e+06 2.090991e+06 3.445059e+06 2.775001e+05 2.198952e+06 4.639762e+05 3.449596e+06 2.710320e+06 3.149784e+06 2.555398e+05 1.532062e+06 1.374124e+05 8.007502e+06 6.388616e+05 1.226883e+05 1.244313e+05 1.491482e+06 1.744992e+06 1.316302e+05 2.067833e+05 1.672981e+06 4.170285e+05 1.091986e+06 3.487774e+05 1283.46042_2.452 5.913405e+05 7.880418e+05 2.109723e+06 9.517480e+05 6.655043e+05 1.060312e+06 1.866118e+06 2.333799e+06 543456.87 1.348267e+06 1.536397e+06 1.865888e+06 562012.88 1.501755e+06 1.920784e+06 1.748024e+06 4.839492e+05 6.187404e+05 1.610190e+06 1.488023e+06 6.627497e+05 1.448494e+06 1.131127e+06 3.300897e+06 544390.889 5.151595e+05 1.133679e+06 1.588264e+06 6.566499e+05 1.243662e+06 2.245776e+06 1.817339e+06 634013.60 9.478856e+05 2.152825e+06 1.411504e+06 8.133207e+05 1.907051e+06 7.135679e+05 1.705797e+06 5.375024e+05 1.608140e+06 1.933223e+06 2.174965e+06 2.180556e+05 1.261522e+06 1.593226e+06 1.642960e+06 2.026488e+06 9.352770e+05 1.232058e+06 1.207504e+06 2.101696e+06 1.482102e+06 2.158581e+06 2.893747e+06 6.836181e+05 1.384004e+06 1.642223e+06 2.254768e+06 2.389185e+06 9.242025e+05 1.302718e+06 8.002845e+05 1.200661e+06 1.819916e+06 2.123557e+06 8.305136e+05 1.273126e+06 9.566430e+05 3.598233e+06 7.201138e+05 9.976931e+05 2.994179e+06 1.071395e+06 2.787869e+06 6.504088e+05 2.171757e+06 5.806221e+05 7.064774e+05 1.630537e+06 1.090223e+06 6.711785e+05 8.572928e+05 6.911023e+05 7.781470e+05 1.172581e+06 6.939593e+05 6.164735e+05 5.824654e+05 2.062743e+06 2.175225e+06 1.686419e+06 5.890201e+05 2.098188e+06 1.551800e+06 1.821369e+06 1.227047e+06 2.112717e+06 5.786658e+05 9.813785e+05 2.989145e+06 2.007426e+06 2.101880e+07 7.767879e+05 7.951184e+05 7.813058e+05 8.001409e+05 9.978927e+05 2.129153e+06 1.562885e+06 7.983869e+05 1.747649e+06 6.743650e+05 2.711789e+06 9.755308e+05 1.487027e+06 1.193845e+06 1.358596e+06 8.654818e+05 7.777211e+05 1.559382e+06 1.013017e+06 1.764103e+06 6.736565e+05 6.653578e+05 1.440201e+06 2.731977e+06 1.697871e+06 2.709992e+06 1.476257e+06 7.138958e+05 1.057820e+06 1.357954e+06 1.341713e+06 2.327102e+06 1.879753e+06 2.504364e+06 2.379986e+06 1.318920e+06 9.841002e+05 1.505676e+06 2.380671e+06 2.012118e+06 3.228294e+06 1.645580e+06 1.673882e+06 1.309769e+06 1.303182e+06 2.855340e+06 1.315234e+06 1.808162e+06 1.495108e+06 8.564737e+05 1.593397e+06 7.021970e+05 1.142641e+06 1.345339e+06 1.941264e+06 9.794574e+05 7.919824e+05 1.436581e+06 6.439375e+05 1.103265e+06 1.602171e+06 6.508422e+05 1.303679e+06 6.897257e+05 6.605263e+05 8.309657e+05 1.555691e+06 6.999348e+05 7.028284e+05 6.659588e+05 2.431047e+06 2.222216e+06 1.027136e+06 1.102236e+06 1.085359e+06 2.006235e+06 1.656193e+06 2.073518e+06 7.884060e+05 2.753116e+06 2.192944e+06 1.428010e+06 8.475395e+05 2.183302e+06 6.296519e+05 9.285510e+05 8.754266e+05 2.561633e+06 1.963548e+06 2.248211e+06 1.374615e+06 1.162494e+06 7.200008e+05 2.727720e+06 8.744470e+05 6.514152e+05 7.079079e+05 2.222071e+06 7.229708e+05 1.559544e+06 1.227959e+06 3.498344e+06 2.873208e+06 7.871395e+05 1.848497e+06 1.867076e+06 7.266607e+05 5.932770e+05 5.760942e+05 1.001560e+06 9.206011e+05 1.072713e+06 8.638704e+05 6.659904e+05 2.551670e+06 2.391594e+06 1.089438e+06 1.863710e+06 1.540930e+06 7.782456e+05 2.045934e+06 1.890439e+06 1.167631e+06 9.723380e+05 1.899521e+06 1.396393e+06 1.890467e+06 1.743848e+06 7.938895e+05 2.634164e+06 9.105782e+05 7.173756e+05 1.670123e+06 1.008123e+06 7.166927e+05 1.611572e+06 6.025111e+05 2.110905e+06 2.040219e+06 1.961430e+06 1.223690e+06 1.868667e+06 2.515139e+06 8.297965e+05 6.749376e+05 1.202828e+06 1.588147e+06 1.235979e+06 2.395140e+06 1.525881e+06 1.760799e+06 1.112422e+06 6.440053e+05 1.105091e+06 1.021009e+06 1.648074e+06 9.425693e+05 3.251363e+06 4-Piperidone_2.467 4.045054e+08 2.122789e+08 2.121682e+08 2.411745e+08 1.252828e+06 2.498809e+08 1.947584e+08 2.401738e+08 1289093.46 2.019415e+08 2.665238e+08 2.245513e+08 1199453.07 2.086225e+08 2.499980e+08 1.974340e+08 1.014236e+06 2.740425e+08 1.888080e+08 1.653983e+08 1.288070e+06 1.636586e+08 3.848109e+08 3.141974e+08 1016885.041 6.380460e+07 2.392082e+08 2.509097e+08 1.174094e+06 2.054360e+08 1.967209e+08 2.831050e+08 864432.45 1.979344e+08 2.304906e+08 2.494889e+08 4.034453e+06 2.047723e+08 2.403845e+08 3.236014e+08 8.678947e+05 4.718862e+07 2.218001e+08 3.085163e+08 4.699969e+05 2.433224e+08 1.665403e+08 2.407246e+08 5.979162e+08 1.170711e+08 2.566776e+07 8.276350e+07 1.694556e+08 5.706817e+08 1.298401e+07 3.764684e+08 9.365807e+08 1.257808e+08 1.225778e+09 1.678511e+08 9.478843e+07 3.948925e+08 5.009460e+08 1.861337e+08 7.324313e+07 1.990389e+08 9.806864e+08 1.458488e+08 7.477755e+08 2.302436e+08 5.886442e+08 1.339466e+07 3.931870e+07 1.931621e+08 4.958427e+08 3.722489e+08 1.629745e+07 2.836214e+07 1.811272e+07 5.453212e+08 4.777124e+08 2.502122e+07 1.333911e+08 3.757243e+08 3.464800e+06 4.521692e+06 3.911635e+07 1.241747e+08 3.321577e+08 2.836404e+08 7.230862e+07 4.253404e+08 1.460061e+08 3.831158e+08 1.149880e+08 7.049815e+08 6.894629e+08 5.823740e+07 5.660099e+08 3.794485e+07 2.563080e+08 4.245140e+08 7.925385e+07 1.659504e+08 7.546864e+07 5.646637e+07 5.366065e+07 1.670720e+08 4.083299e+08 8.448472e+08 6.573878e+07 4.287301e+08 3.137535e+08 3.530104e+08 1.995045e+08 2.375822e+08 8.426935e+08 7.364661e+06 1.135694e+08 5.333254e+08 1.093957e+08 1.203734e+08 1.915947e+08 3.028409e+08 1.097668e+07 1.060679e+08 1.830741e+08 1.032994e+08 1.991098e+07 5.059524e+07 2.677949e+08 6.530309e+08 1.498745e+08 6.191333e+08 1.705623e+08 1.500710e+08 5.498109e+08 8.385404e+07 4.352810e+08 4.340968e+08 2.035392e+08 2.332974e+07 7.683722e+06 1.021204e+08 2.011206e+08 1.021945e+07 8.810877e+07 2.440757e+08 1.663106e+08 4.840087e+08 3.460868e+08 1.034698e+08 2.682248e+07 8.197269e+07 2.416326e+07 7.980315e+07 9.602182e+07 5.067508e+07 8.481951e+07 1.941476e+08 1.797323e+07 3.322844e+07 1.285828e+08 2.717071e+08 2.446981e+08 3.794078e+06 1.386012e+08 4.110869e+08 4.295940e+06 7.136441e+07 5.312283e+08 1.254704e+07 4.365850e+07 3.207010e+08 2.183980e+07 4.720571e+08 1.447419e+07 1.207780e+08 1.010923e+09 4.729129e+07 1.942702e+07 5.313486e+06 5.659006e+08 1.785021e+08 6.211440e+08 7.684554e+06 7.640012e+07 1.499614e+08 2.321587e+08 3.017214e+08 8.337512e+07 7.280261e+07 1.368609e+08 1.498209e+08 5.628116e+08 2.216212e+07 1.279937e+08 1.221265e+08 1.037037e+08 9.600048e+08 2.063984e+08 1.238258e+08 1.978501e+07 3.819292e+08 3.966624e+08 2.849319e+07 8.702333e+07 4.256412e+06 5.578507e+08 5.029971e+08 4.916525e+07 1.199310e+07 3.067768e+08 1.656264e+08 1.249685e+08 4.944685e+08 4.072631e+07 3.019852e+08 1.935562e+08 2.945522e+08 9.561349e+08 1.300988e+08 3.519104e+08 5.184773e+07 3.723253e+08 8.624808e+07 2.536623e+08 1.257061e+07 1.674641e+08 4.786056e+08 1.943094e+08 1.714106e+08 8.445776e+07 4.684989e+07 8.018915e+07 1.632690e+08 5.657545e+08 8.227662e+07 3.597033e+06 7.709149e+07 8.656538e+07 1.072438e+09 1.313055e+07 1.950636e+07 1.527823e+07 2.525769e+07 1.696237e+08 9.658588e+07 7.547960e+07 2.635761e+08 2.592070e+06 1.125095e+08 3.458515e+08 4.291792e+08 4.320860e+08 6.206418e+06 2.349519e+08 3.925231e+07 5.311076e+08 2.451315e+07 5.250567e+07 4.530954e+07 THEOBROMINE (Peak 2) 1.844851e+08 4.661092e+07 6.100625e+07 8.108421e+07 3.205794e+05 4.343726e+07 5.831141e+07 5.774641e+07 284804.95 5.502945e+07 5.725833e+07 6.036221e+07 299998.25 7.915998e+07 4.876440e+07 6.229223e+07 2.919737e+05 4.991550e+07 6.300810e+07 3.970278e+07 4.474428e+05 6.382390e+07 5.877278e+07 6.633800e+07 240383.114 6.322506e+07 5.494439e+07 5.229041e+07 3.682945e+05 6.444952e+07 5.183396e+07 6.423326e+07 409206.41 6.569998e+07 5.942645e+07 4.265434e+07 5.608355e+05 6.398412e+07 5.824559e+07 5.087492e+07 4.333907e+05 6.783461e+07 5.518288e+07 7.220988e+07 1.636277e+05 5.384700e+07 5.630507e+07 5.666487e+07 3.826755e+06 4.920958e+07 7.544927e+07 2.856107e+07 4.048045e+07 2.014928e+08 4.558280e+06 8.688606e+07 4.448417e+08 3.094441e+08 7.272319e+06 7.107622e+07 4.066062e+07 1.003930e+07 3.256561e+08 6.786353e+05 1.019878e+07 2.187410e+06 6.491934e+07 1.782313e+07 4.178680e+05 7.812552e+07 3.791462e+05 1.322392e+06 1.558721e+07 3.113947e+07 4.544272e+07 7.335418e+07 3.208392e+07 9.237011e+07 8.263151e+06 5.403093e+05 3.448202e+06 3.902699e+05 4.731676e+07 3.307102e+06 4.488237e+07 1.482775e+08 7.764908e+06 1.065527e+06 1.124003e+08 1.176596e+08 1.654014e+07 9.453567e+06 4.610730e+05 3.725493e+07 1.644652e+07 3.642767e+05 5.055601e+07 6.112811e+07 3.921810e+05 4.495939e+06 9.764985e+07 1.144921e+08 1.950109e+08 5.094209e+05 4.174857e+07 1.124681e+07 2.105431e+07 1.648301e+08 2.685794e+06 4.909933e+07 7.441523e+07 7.669995e+06 1.351148e+07 6.950286e+06 2.315346e+06 2.201125e+07 2.125662e+07 1.259109e+06 2.629736e+06 1.078218e+08 3.594033e+07 2.316816e+07 8.188881e+07 2.274874e+07 5.298009e+05 1.803721e+08 8.622878e+07 1.171229e+07 5.684686e+07 6.834033e+07 1.242736e+07 5.359908e+05 8.764647e+07 1.672330e+08 9.076900e+06 4.986754e+07 4.486226e+06 3.195529e+07 9.371637e+07 2.490953e+06 1.734949e+08 6.617161e+07 9.566672e+05 4.034501e+06 3.272437e+07 1.672766e+07 5.714170e+05 8.119252e+05 2.750969e+05 5.583573e+05 1.638194e+08 1.774872e+06 5.072439e+05 7.376213e+07 1.325565e+07 4.217278e+07 6.520795e+05 3.270443e+05 2.965930e+06 4.580881e+07 2.103337e+08 5.199804e+06 1.839039e+08 1.084630e+07 1.435698e+07 1.606974e+08 5.287944e+07 5.667527e+05 4.208979e+07 1.969618e+07 3.457194e+07 4.681510e+05 8.269389e+07 1.311404e+06 4.001212e+07 5.760336e+06 5.049122e+05 8.242692e+07 4.714274e+07 3.309197e+07 4.101233e+07 1.088571e+07 8.562379e+07 1.044884e+08 1.875857e+07 1.924386e+08 1.108788e+09 4.842826e+07 4.239726e+07 7.913406e+07 2.217036e+07 1.040348e+07 1.890488e+06 4.868698e+07 4.952504e+06 3.288415e+07 6.577879e+07 4.621156e+06 3.022278e+07 9.661390e+06 5.316255e+08 6.522523e+06 1.585614e+08 1.766390e+08 2.019297e+08 5.452748e+07 1.471803e+08 1.263704e+08 6.595398e+06 6.410287e+07 1.162115e+08 2.314369e+08 1.537007e+08 4.587448e+07 5.493484e+05 7.866179e+06 2.529671e+07 5.816801e+06 6.144619e+07 8.128128e+06 1.267442e+07 1.034005e+08 1.242718e+07 5.275489e+05 1.227005e+07 3.486249e+05 2.720015e+08 1.010433e+08 5.772479e+07 6.432763e+06 1.069426e+08 2.838446e+07 7.278655e+07 3.992944e+07 6.041851e+06 7.424768e+05 1.483664e+08 1.242389e+07 4.178768e+08 1.527519e+08 1.475274e+08 2.045748e+07 5.838710e+07 4.108291e+07 1.108816e+08 1.883233e+08 1.403521e+08 4.774841e+07 1.382324e+08 8.116360e+06 1.488355e+08 3.646501e+07 3.184995e+05 3.879750e+05 6.242026e+07 2.013992e+08 6.385486e+06 6.138771e+05 1.111998e+08 1.181541e+07 6.854388e+07 2.854859e+07 BILIVERDIN (Peak 1) 9.182435e+05 3.258585e+05 4.022658e+05 3.356685e+05 6.280847e+04 2.490392e+05 4.039945e+05 3.060727e+05 77152.96 3.291302e+05 5.085093e+05 2.521570e+05 105707.19 2.790900e+05 3.276286e+05 2.847843e+05 1.018305e+05 3.874269e+05 3.819678e+05 3.279436e+05 1.418952e+05 2.890450e+05 4.058912e+05 3.231227e+05 81664.025 3.738538e+05 3.983845e+05 2.630834e+05 1.573109e+05 3.481440e+05 3.023251e+05 1.040030e+06 178703.40 3.043240e+05 3.671604e+05 2.694957e+05 2.094727e+05 3.155313e+05 2.411080e+05 3.118337e+05 1.579046e+05 3.681713e+05 2.415878e+05 3.577776e+05 7.567179e+04 9.570461e+05 3.155981e+05 4.298183e+05 2.868279e+05 2.345387e+05 1.040455e+06 2.946876e+05 3.538179e+05 2.903591e+05 3.571676e+05 3.047185e+05 1.515906e+05 2.838913e+05 2.566930e+05 2.989694e+05 1.751420e+06 1.776226e+06 5.242916e+05 9.405387e+05 6.142853e+05 2.631219e+05 1.475809e+05 1.895344e+06 1.312369e+05 5.243170e+05 4.844892e+05 9.642612e+05 4.853638e+05 1.495508e+05 1.962990e+05 6.344887e+05 8.959523e+05 1.230912e+05 3.140615e+06 2.397955e+05 1.639089e+05 1.320402e+05 1.093504e+06 2.814048e+05 1.197141e+06 2.205989e+05 3.753119e+05 1.216387e+05 1.512407e+05 6.909928e+05 2.350861e+05 1.143272e+05 1.782243e+05 3.370298e+05 4.083415e+05 5.960497e+05 2.938776e+05 1.339921e+06 2.385458e+05 7.031070e+05 2.661119e+05 2.656514e+05 8.163866e+05 2.710374e+05 5.070787e+05 7.221045e+05 7.035100e+05 2.214553e+05 5.842207e+06 2.714666e+05 3.131727e+05 2.036727e+05 2.044784e+05 4.291400e+05 1.393854e+05 1.697956e+05 2.953744e+05 2.333112e+05 2.308534e+05 2.952576e+06 2.441363e+05 2.437536e+05 2.363587e+05 2.007460e+05 2.616030e+05 3.284490e+05 8.955467e+04 5.721586e+05 1.104913e+05 6.114180e+05 1.937069e+05 7.067558e+05 4.039140e+05 9.909458e+05 3.935486e+05 1.377722e+05 2.546712e+05 3.175779e+05 1.696535e+05 1.060066e+06 2.762406e+05 3.794283e+05 1.371648e+05 2.938709e+05 1.055853e+05 2.728797e+05 2.707524e+05 2.617704e+05 8.656585e+04 2.854981e+05 1.140184e+05 5.871969e+05 1.647197e+05 4.057649e+05 2.661624e+05 8.926664e+04 2.902934e+05 1.493280e+05 2.023061e+05 5.938333e+05 6.437917e+05 6.384929e+05 1.171579e+05 2.620507e+05 3.501720e+05 1.275782e+06 1.550956e+06 2.358481e+05 3.070157e+05 5.020236e+05 2.728363e+05 2.144827e+05 6.882663e+05 1.682679e+05 3.215878e+05 1.032814e+05 7.369110e+05 7.136483e+05 1.421726e+05 1.288028e+05 2.522907e+05 3.947801e+05 3.150925e+05 1.516898e+05 2.539330e+05 6.638351e+05 6.324107e+05 4.697739e+05 1.016693e+06 9.880855e+05 6.940355e+05 7.628974e+04 2.789893e+05 2.411460e+05 6.640807e+05 2.670186e+05 5.520189e+05 3.608389e+05 2.291102e+05 8.591750e+05 9.024684e+05 2.527294e+05 6.114860e+05 7.484482e+05 1.127000e+05 2.159209e+05 1.644938e+05 2.021087e+05 1.305280e+06 1.312093e+05 1.856696e+06 1.422166e+05 3.102302e+05 4.073238e+05 3.990787e+05 1.181484e+05 3.630529e+05 4.053446e+05 1.145635e+05 9.640461e+05 3.809224e+05 9.973612e+04 1.791690e+05 4.551059e+05 1.607990e+05 5.496188e+05 3.057704e+05 2.444563e+05 1.900110e+05 9.912175e+04 3.402924e+05 2.747965e+05 2.814077e+05 1.224422e+05 9.177955e+05 2.707880e+05 1.851586e+05 4.548209e+05 2.693093e+05 2.196738e+05 1.466575e+05 8.527988e+05 2.328636e+05 6.157371e+05 1.221898e+05 1.201659e+06 2.044205e+05 1.440968e+06 2.168404e+05 1.370427e+05 2.670795e+05 9.710374e+05 2.964815e+05 2.120126e+05 4.709209e+05 2.195517e+06 7.456983e+05 2.062844e+06 1.189414e+05 2.527168e+05 9.970943e+05 1.455631e+06 C14 H31 N O9_2.495 2.217246e+05 7.111172e+05 8.794726e+05 7.694637e+05 1.558867e+05 6.286985e+05 7.673701e+05 7.502631e+05 168302.56 8.405818e+05 7.150849e+05 7.757689e+05 204345.91 7.186299e+05 8.894121e+05 7.220093e+05 1.889671e+05 7.874389e+05 5.666694e+05 6.658145e+05 2.812174e+05 8.185200e+05 8.214431e+05 1.002349e+06 157397.045 6.907247e+05 5.974862e+05 8.081911e+05 2.718870e+05 7.243855e+05 9.274163e+05 6.371086e+05 362139.35 6.095831e+05 7.848890e+05 1.154033e+06 4.811667e+05 5.497109e+05 5.259402e+05 6.296877e+05 3.122682e+05 8.938574e+05 9.767950e+05 7.784924e+05 1.003754e+05 5.984875e+05 7.874867e+05 4.295296e+05 3.288893e+05 2.181227e+05 3.290259e+05 4.921382e+05 4.571691e+05 6.068277e+05 2.227729e+05 3.076829e+05 2.259846e+06 2.782025e+05 4.674411e+05 2.366407e+05 4.905695e+05 3.639001e+05 2.516422e+05 4.626969e+05 4.534200e+05 3.272215e+05 2.547663e+05 4.810313e+05 2.727466e+05 3.281564e+05 2.001298e+05 2.704096e+05 3.269119e+06 2.943153e+05 3.911759e+05 3.505412e+05 2.609453e+05 4.950164e+06 2.080504e+05 5.876473e+05 2.106658e+05 3.738741e+05 4.663367e+05 2.393468e+05 2.514679e+05 3.613318e+05 6.417971e+05 2.535060e+05 3.384717e+05 9.019462e+05 4.034223e+05 2.795307e+05 3.521454e+05 2.247142e+05 5.562684e+06 2.442718e+05 4.684934e+05 3.878162e+05 2.521430e+05 1.987435e+05 2.390873e+05 4.019673e+05 2.818993e+05 5.283962e+05 4.634227e+05 4.270638e+05 4.759439e+05 4.954613e+05 3.433321e+05 4.407740e+05 3.938633e+05 2.830678e+05 3.455730e+05 3.425834e+05 1.819025e+05 1.906960e+05 1.768862e+08 4.039271e+05 5.133072e+05 5.023193e+05 3.547763e+05 3.422154e+05 3.649775e+05 3.377413e+05 3.483037e+05 4.419626e+05 2.035699e+05 3.409486e+05 2.101817e+05 2.191921e+05 3.647345e+05 4.553555e+05 3.519112e+05 4.242403e+05 2.235605e+05 2.703530e+05 2.810001e+05 1.097241e+06 3.231508e+05 3.011865e+05 3.636295e+05 5.842745e+05 2.471149e+05 3.119158e+05 1.737639e+05 4.426230e+05 3.900629e+05 4.243132e+05 2.086639e+05 4.702325e+05 2.204310e+05 4.449546e+05 2.687318e+05 5.329663e+05 5.443718e+05 3.098354e+05 4.815561e+05 2.295906e+05 5.768219e+05 2.121466e+05 4.762494e+05 4.415791e+05 2.569791e+05 3.123797e+05 9.150441e+06 2.407902e+05 4.424501e+05 3.824583e+05 3.930236e+05 4.907170e+05 7.187927e+05 5.009228e+05 4.778758e+05 3.218764e+05 3.423681e+05 2.055054e+05 4.437840e+05 4.923337e+05 2.697706e+05 2.190218e+05 4.100758e+05 3.062028e+05 2.457858e+05 2.885876e+05 2.681043e+05 4.445917e+05 2.415633e+05 3.067005e+05 1.970187e+05 3.769053e+05 5.428517e+05 1.715942e+05 5.440119e+05 4.314438e+05 5.048923e+05 1.942523e+05 3.268353e+05 4.017614e+05 3.906869e+05 5.102485e+05 2.419115e+06 2.913856e+05 4.744975e+05 2.367434e+05 1.833157e+05 2.627445e+05 3.405513e+05 2.015574e+05 2.899776e+05 2.253258e+05 4.789866e+05 3.318043e+05 2.825148e+05 4.182369e+05 3.029455e+05 2.332110e+05 3.871709e+05 3.508144e+05 2.246340e+05 3.375251e+05 2.805550e+05 1.959988e+05 3.631842e+05 5.128231e+05 3.026941e+05 2.229072e+05 4.673553e+05 3.319290e+05 2.700829e+05 1.829451e+05 3.723140e+05 3.735481e+05 4.871200e+05 2.641827e+05 3.770019e+05 4.953695e+05 1.798792e+05 7.188169e+05 1.979797e+05 1.852182e+05 5.911987e+05 2.039130e+05 3.295606e+05 1.901138e+05 2.252645e+05 3.118628e+05 4.155919e+05 5.540902e+05 2.255903e+06 2.121876e+05 1.988218e+05 4.456242e+05 1.853716e+05 1.920252e+05 1.911362e+05 2.321553e+05 1.840061e+05 4.876956e+05 2.181091e+05 4.266944e+05 4.308505e+05 3.533560e+05 C8 H5 Cl N O2 P_2.553 3.960480e+06 5.934893e+06 7.355403e+06 7.446218e+06 5.178020e+05 9.413399e+06 9.586862e+06 7.473138e+06 478666.42 8.331181e+06 8.987317e+06 6.505785e+06 678994.10 8.136288e+06 7.305095e+06 8.070056e+06 4.033039e+05 7.709748e+06 9.884567e+06 7.633276e+06 5.919777e+05 7.148187e+06 8.401351e+06 6.455261e+06 497463.131 7.446570e+06 1.015884e+07 7.504132e+06 5.581048e+05 6.869443e+06 8.452330e+06 7.479762e+06 578511.58 8.060777e+06 8.438068e+06 9.287646e+06 7.969097e+05 6.784673e+06 7.497306e+06 7.431178e+06 5.771899e+05 8.321928e+06 6.616267e+06 1.083469e+07 2.562444e+05 7.584897e+06 7.928660e+06 6.912375e+06 5.978778e+06 1.001716e+07 8.771827e+06 6.037236e+06 6.095826e+06 7.422213e+06 2.863400e+06 7.002826e+06 1.037195e+07 7.680169e+06 1.084259e+07 8.899676e+06 7.929810e+06 8.672537e+06 9.449365e+06 1.194310e+07 5.154644e+06 8.920769e+06 6.930520e+06 1.033584e+07 1.166291e+07 1.155497e+07 4.641886e+06 1.035025e+07 9.292231e+06 8.689900e+06 1.027472e+07 4.914419e+06 1.043470e+07 8.411845e+06 4.598676e+06 7.134136e+06 6.806262e+06 8.408393e+06 1.165450e+07 7.412296e+06 8.280597e+06 8.999842e+06 7.722630e+06 1.163761e+07 1.239108e+07 1.899346e+07 8.530700e+06 4.788036e+06 1.020678e+07 9.923710e+06 9.149054e+06 5.850829e+06 6.930687e+06 4.309002e+06 2.813780e+06 7.079553e+06 1.266358e+07 5.110674e+06 4.321984e+06 5.552483e+06 9.424272e+06 1.216225e+07 1.104085e+07 1.461144e+07 8.490735e+06 5.706774e+06 6.302618e+06 1.893666e+07 1.043977e+07 3.094109e+06 2.747095e+06 8.754648e+06 1.013696e+07 3.173906e+06 7.368026e+06 8.430400e+06 5.460491e+06 5.185013e+06 4.008756e+06 5.840780e+06 5.970991e+06 8.629818e+06 9.826434e+06 5.539481e+06 6.535688e+06 4.418418e+06 6.259020e+06 2.789724e+06 7.490837e+06 7.773690e+06 6.351583e+06 7.401766e+06 8.554976e+06 6.777696e+06 6.263760e+06 8.043281e+06 5.197850e+06 7.847648e+06 6.066176e+06 2.416505e+06 4.823482e+06 4.588164e+06 2.525094e+06 4.474780e+06 5.209576e+06 8.491723e+06 8.488380e+06 1.253903e+07 1.381496e+07 8.624851e+06 8.220340e+06 1.039018e+07 1.302496e+07 1.491463e+07 1.829631e+07 7.938416e+06 1.266064e+07 9.230353e+06 8.720097e+06 9.234321e+06 1.339062e+07 7.904580e+06 8.595833e+06 5.820740e+06 8.753441e+06 7.767204e+06 6.318343e+06 7.171592e+06 9.071540e+06 1.252912e+07 1.056961e+07 5.859015e+06 1.229863e+07 9.258084e+06 1.175209e+07 4.566221e+06 2.921058e+06 1.159847e+07 1.338444e+07 6.243675e+06 4.367611e+06 5.337066e+06 1.243852e+07 9.812862e+06 1.657825e+07 9.071502e+06 1.590881e+07 4.222208e+06 6.781540e+06 9.326393e+06 5.991010e+06 7.529904e+06 1.413204e+07 7.799786e+06 7.726967e+06 1.578208e+07 1.492602e+07 9.323588e+06 1.307663e+07 7.750842e+06 7.769695e+06 3.069366e+06 6.617022e+06 9.370661e+06 1.804756e+07 9.822268e+06 6.978119e+06 1.197822e+07 1.312356e+07 9.779971e+06 7.592030e+06 9.208233e+06 1.506860e+07 1.186935e+07 3.555545e+06 1.156754e+07 1.172318e+07 6.159944e+06 1.044271e+07 1.154316e+07 6.877249e+06 1.137337e+07 9.088717e+06 6.643051e+06 1.091275e+07 7.354428e+06 6.788738e+06 1.067537e+07 6.819344e+06 6.183185e+06 1.497014e+07 8.091673e+06 1.266736e+07 6.806716e+06 1.739481e+07 6.741706e+06 7.883043e+06 7.811031e+06 7.404378e+06 1.223418e+07 5.740670e+06 7.437071e+06 1.142515e+07 1.326387e+07 1.332847e+07 8.098926e+06 4.317298e+06 6.445051e+06 8.472234e+06 1.006178e+07 1.335113e+07 4.425882e+06 9.558079e+06 7.173552e+06 7.097365e+06 4.246668e+06 1.552201e+07 1.217748e+07 C10 H22 O6_2.608 3.278259e+05 2.693086e+06 2.732349e+06 2.793925e+06 1.900582e+05 2.435366e+06 2.224348e+06 2.354885e+06 262296.90 3.806231e+06 2.535217e+06 2.932293e+06 750873.40 3.042705e+06 2.341032e+06 2.879063e+06 9.751418e+05 2.497018e+06 2.548591e+06 2.120876e+06 3.086609e+05 2.254137e+06 3.175750e+06 3.248777e+06 721837.455 2.775301e+06 2.370476e+06 2.392063e+06 3.635701e+05 2.807695e+06 3.475962e+06 2.756501e+06 289798.77 2.090253e+06 2.455473e+06 2.975983e+06 2.976222e+05 3.092743e+06 2.274151e+06 2.528127e+06 2.977467e+05 2.794383e+06 2.640780e+06 3.184481e+06 5.523949e+05 2.510351e+06 2.683957e+06 2.643601e+06 2.745805e+06 1.899271e+06 1.246529e+06 1.195711e+06 7.148181e+05 1.125936e+06 1.718813e+06 1.342395e+06 1.681267e+07 1.322759e+06 3.391315e+06 2.030002e+06 1.374527e+06 1.840821e+06 2.076010e+06 1.465819e+06 2.830818e+06 2.498226e+06 2.869341e+06 1.218465e+06 1.398338e+06 1.235633e+06 1.847699e+06 2.024776e+06 2.731736e+06 3.561470e+06 2.464422e+06 2.048404e+06 1.915828e+06 3.936421e+06 4.872108e+06 1.969888e+06 1.643843e+06 2.133368e+06 1.104999e+06 1.739917e+06 1.583660e+06 2.430932e+06 5.150853e+06 1.911229e+06 1.490877e+06 2.703991e+06 1.792937e+06 1.493291e+06 3.059821e+06 1.659339e+06 4.882165e+06 1.530367e+06 3.608982e+06 1.761204e+06 1.107776e+06 1.326832e+06 1.356183e+06 1.097486e+06 1.053247e+06 1.448509e+06 1.923500e+06 1.351814e+06 1.752362e+06 1.679294e+06 1.308535e+06 8.653130e+05 7.044988e+05 2.330047e+06 1.511407e+06 3.109405e+06 1.531056e+06 9.090731e+05 6.171758e+07 1.719284e+06 7.804280e+05 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2.027055e+06 7.315296e+06 3.316463e+06 3.747816e+06 2.669804e+06 1.931473e+06 1.404443e+06 5.023321e+06 2.494353e+06 3.193186e+06 5.745998e+06 1.641358e+06 4.502389e+06 5.032598e+06 6.689641e+06 1.847437e+06 5.490769e+06 4.866513e+06 5.759201e+06 2.949077e+06 4.728489e+06 4.873824e+06 2.700438e+06 4.518724e+06 2.204168e+06 2.993576e+06 1.920842e+06 1.618285e+06 4.311729e+06 4.971962e+06 7.920677e+06 2.027706e+06 1.672539e+06 5.271534e+06 3.187309e+06 3.503989e+06 3.014577e+06 3.609085e+06 1.729267e+06 1.711177e+06 1.266833e+06 8.375949e+06 1.082799e+06 7.527290e+05 3.931273e+06 6.742359e+06 2.754680e+06 4.112699e+06 2.391925e+06 3.104228e+06 1.321128e+07 1.090974e+07 5.110644e+06 2.869699e+06 6.647827e+06 4.675240e+06 1.802737e+06 3.412411e+06 2.725755e+06 2.819240e+06 5.905681e+06 2.187617e+06 1.909314e+06 2.388138e+06 2.016257e+06 9.715499e+05 7.752572e+06 2.072245e+06 2.714666e+06 1.083794e+06 2.954257e+06 4.261371e+06 9.544190e+05 3.631344e+06 3.647489e+06 7.602914e+05 3.904167e+05 6.985934e+05 3.354510e+06 5.824113e+06 2.290042e+06 6.525618e+06 3.555833e+06 8.669578e+05 2.454849e+06 1.705046e+06 1.001741e+07 3.613351e+06 1.662581e+06 8.214293e+06 1.292433e+06 2.064938e+06 2.031123e+06 2.319340e+06 5.752353e+06 7.196736e+05 1.007339e+06 7.249901e+05 C4 H2 N8 P2_2.638 2.342757e+07 8.578381e+06 8.512495e+06 9.795287e+06 3.410377e+05 1.085658e+07 1.129628e+07 1.281567e+07 300634.65 9.761963e+06 9.701209e+06 9.348966e+06 256951.45 1.029070e+07 9.705361e+06 9.941650e+06 2.557972e+05 9.423449e+06 9.650623e+06 8.766295e+06 3.986798e+05 1.207565e+07 1.449704e+07 8.245443e+06 291003.582 5.618895e+06 1.034544e+07 1.210054e+07 2.548757e+05 1.076127e+07 9.976215e+06 5.833939e+06 273205.81 1.290491e+07 1.201577e+07 6.803358e+06 3.097408e+05 1.243084e+07 9.535858e+06 8.702232e+06 2.628866e+05 1.185077e+07 9.444762e+06 1.076841e+07 1.317353e+05 1.111810e+07 1.015860e+07 8.742951e+06 7.600646e+06 1.468204e+07 1.208815e+07 5.589757e+06 8.748996e+06 2.253258e+07 1.129121e+07 9.725269e+06 2.605091e+07 2.123534e+07 1.450247e+07 1.309752e+07 1.319803e+07 1.495070e+07 1.208653e+07 3.204029e+07 8.421790e+06 1.064848e+07 1.079259e+07 1.568955e+07 1.564543e+07 1.323947e+07 4.796414e+06 2.215616e+07 1.304213e+07 2.718332e+06 1.493718e+07 4.024902e+06 1.566325e+07 1.412453e+07 1.064647e+07 5.234696e+06 9.264286e+06 1.014898e+07 1.739086e+07 7.397814e+06 1.041695e+07 2.010911e+07 9.021293e+06 1.293195e+07 1.435554e+07 9.152654e+06 1.241789e+07 2.791802e+06 1.727995e+07 1.803673e+07 1.532051e+07 4.942101e+06 9.256459e+06 6.383934e+06 3.442060e+06 1.457597e+07 1.598343e+07 4.871516e+06 8.466712e+06 6.306601e+06 1.977694e+07 1.706606e+07 1.323627e+07 2.235097e+07 5.733052e+06 1.027204e+07 7.581502e+06 2.203880e+07 1.754362e+07 7.370870e+06 2.246079e+06 9.902289e+06 1.297087e+07 2.975900e+06 1.348938e+07 1.321714e+07 1.219942e+07 5.583688e+06 8.511786e+06 1.836591e+07 8.398220e+06 1.504799e+07 2.006091e+07 1.101949e+07 7.569732e+06 9.044938e+06 9.145296e+06 1.657705e+07 1.454351e+07 9.143605e+06 4.687474e+06 9.339438e+06 1.986923e+07 6.976496e+06 1.155014e+07 7.228393e+06 6.887771e+06 2.155696e+07 6.172339e+06 9.268364e+06 7.314814e+06 9.409795e+06 3.538573e+06 5.507281e+06 1.191345e+07 8.266872e+06 1.644533e+07 1.373819e+07 9.936262e+06 1.131575e+07 1.622587e+07 6.447447e+06 1.768368e+07 2.399664e+07 1.247612e+07 1.110667e+07 2.633398e+07 1.619991e+07 1.525381e+07 1.706476e+07 1.074843e+07 1.651355e+07 1.127397e+07 1.565075e+07 8.043326e+06 2.719298e+07 1.249498e+07 2.365732e+07 1.654595e+07 2.138886e+07 9.898825e+06 7.555906e+06 1.406515e+07 7.574992e+06 8.775269e+06 1.818704e+06 7.235904e+05 1.207999e+07 1.707762e+07 4.527962e+06 5.470709e+06 5.894819e+06 2.289315e+07 1.547129e+07 2.168086e+07 1.307864e+07 1.747612e+07 3.174240e+06 1.455608e+07 7.559973e+06 1.385883e+06 6.470403e+06 3.382104e+07 5.453465e+06 1.612812e+07 2.940604e+07 1.995329e+07 1.242819e+07 2.344454e+07 1.369947e+07 1.275858e+07 3.605554e+06 3.498143e+06 2.184841e+07 7.676008e+06 1.403536e+07 5.837640e+06 9.748436e+06 1.644908e+07 1.517680e+07 1.263527e+07 1.124718e+07 1.526287e+07 1.523965e+07 3.181203e+06 5.567921e+06 1.627362e+07 7.525453e+06 1.056043e+07 7.098549e+06 4.454500e+06 5.802173e+06 2.371276e+07 6.744549e+06 9.764361e+06 1.116962e+07 6.028684e+06 2.138760e+07 1.473085e+07 7.790271e+06 9.166779e+06 6.861243e+06 1.415421e+07 1.492056e+07 9.909575e+06 1.670074e+07 2.554879e+07 1.387760e+07 6.056168e+06 2.825997e+07 1.480918e+07 4.292907e+06 2.489644e+07 1.846074e+07 1.491014e+07 1.178187e+07 9.473715e+06 6.756827e+06 1.353164e+07 1.557765e+07 1.334903e+07 5.248035e+06 7.284911e+06 1.263600e+07 1.792036e+07 4.111309e+06 1.390790e+07 1.955552e+07 C7 H26 N9 O2 P_2.659 2.620730e+05 1.945961e+06 1.939531e+06 2.194763e+06 8.437549e+04 1.993277e+06 1.608210e+06 2.507163e+06 110734.79 1.841135e+06 2.148032e+06 2.197819e+06 784277.91 1.801657e+06 1.832053e+06 1.979003e+06 3.053545e+06 1.987463e+06 2.059460e+06 2.103208e+06 1.555962e+05 1.838221e+06 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8.857925e+04 2.983810e+06 2.751105e+06 1.611093e+06 98629.32 1.612751e+06 2.959440e+06 2.968246e+06 1.146948e+05 1.334788e+06 1.620681e+06 1.602685e+05 1.117568e+05 2.256583e+06 2.149788e+05 1.577674e+05 4.793969e+04 2.532340e+06 1.945176e+06 2.333365e+05 2.834857e+06 1.021798e+06 1.595429e+06 4.031039e+06 2.449087e+06 1.816095e+06 1.754847e+06 3.911532e+06 2.865984e+06 3.885139e+06 1.321630e+06 1.546680e+06 3.989218e+06 3.139894e+06 2.626320e+06 1.665706e+06 8.065615e+06 4.143377e+06 3.350023e+06 1.592641e+06 2.050119e+06 2.516095e+06 5.284151e+06 4.522140e+06 3.105155e+06 7.331501e+06 9.996434e+05 5.860268e+06 2.371371e+06 3.081558e+06 8.107257e+04 1.756188e+06 3.204595e+06 3.145750e+06 3.931988e+05 2.844773e+06 2.124602e+06 2.455469e+06 1.356138e+06 7.253316e+05 1.628990e+06 1.016982e+06 8.164616e+05 4.640824e+06 1.395014e+06 1.186071e+06 3.047364e+06 2.759875e+06 1.466288e+06 4.986405e+06 5.311497e+06 1.516612e+06 1.132076e+06 4.790472e+06 2.206345e+06 2.912797e+06 1.085803e+06 6.283674e+05 5.007068e+05 6.142911e+05 1.269105e+06 1.671395e+06 1.389090e+06 3.898703e+05 8.502500e+05 5.998547e+06 4.419563e+06 1.309413e+06 2.202270e+06 3.675003e+06 8.719379e+05 1.658624e+06 3.988476e+06 8.225147e+05 1.703631e+05 1.970401e+06 2.453289e+06 1.753763e+06 1.661820e+06 1.679325e+06 2.374442e+06 3.568788e+06 3.318088e+06 1.459423e+05 2.245864e+06 3.406728e+06 2.151690e+06 2.633857e+06 1.106884e+06 3.874347e+06 2.622341e+06 2.622341e+06 1.970963e+06 2.946308e+06 2.299676e+06 1.991481e+06 1.771990e+06 1.392028e+06 3.850513e+06 1.641520e+06 1.544048e+06 9.880768e+05 1.377286e+06 2.078722e+06 1.659351e+06 3.002114e+06 3.219796e+06 2.084922e+06 1.224831e+06 1.831048e+06 3.074979e+06 2.495945e+06 6.252796e+05 1.401901e+05 1.143377e+06 6.326433e+05 1.166179e+06 1.306366e+06 2.183102e+06 2.545865e+06 8.144650e+05 5.356904e+05 1.243134e+06 1.024750e+06 1.709977e+05 1.074140e+06 2.523284e+05 2.841427e+06 9.134464e+05 3.643972e+06 1.825889e+06 7.803639e+06 5.864210e+06 1.195482e+06 6.442727e+05 4.000707e+06 6.622102e+06 3.725705e+06 9.627051e+05 2.034990e+05 2.026269e+06 1.328421e+06 4.870787e+05 3.788760e+06 1.747803e+06 2.403569e+06 7.791832e+06 1.736300e+06 1.837570e+05 4.852881e+06 8.517166e+05 1.276519e+06 2.940604e+05 4.404668e+06 5.497664e+05 1.620772e+06 2.467813e+06 3.831894e+06 2.527305e+06 9.917901e+05 1.033141e+06 1.883896e+06 5.180480e+05 1.355222e+06 6.184507e+05 9.633903e+05 4.324643e+06 2.341027e+06 1.038102e+06 7.454364e+05 3.165018e+06 1.550264e+06 8.541534e+05 2.388203e+06 1.325574e+06 9.060365e+05 2.703060e+06 2.027299e+06 3.277338e+05 3.184261e+05 1.908569e+06 1.999102e+06 2.521459e+06 2.935042e+06 1.318961e+06 3.071524e+06 5.563358e+05 2.271451e+06 1.169509e+06 1.164237e+06 1.037415e+06 2.560720e+06 2.884324e+06 1.708837e+06 5.252815e+06 1.117465e+06 2.804639e+06 2.991221e+06 1.285622e+06 6.985813e+05 1.189267e+06 3.679044e+06 3.597095e+06 1.201069e+06 2.931889e+06 1.523310e+06 2.202049e+06 3.525376e+06 1.047331e+06 2.563411e+06 1.067611e+06 7.412590e+06 1.119636e+06 1.764330e+06 1239.44723_2.7 6.883617e+04 2.618266e+06 2.458629e+06 3.892162e+06 7.771439e+04 3.260751e+06 3.060379e+06 2.440946e+06 72689.42 3.486309e+06 3.433655e+06 2.883051e+06 66482.15 3.495745e+06 2.665153e+06 3.153269e+06 6.467649e+04 2.813245e+06 3.419057e+06 1.772410e+06 9.017250e+04 4.088801e+06 3.620577e+06 1.093852e+05 64676.714 2.673694e+06 2.879699e+06 3.899952e+06 1.005658e+05 2.780044e+06 1.947983e+06 3.235101e+06 119781.54 2.873171e+06 3.735897e+06 4.222434e+06 1.315973e+05 3.160070e+06 6.581600e+05 7.434187e+05 1.286444e+05 4.041717e+06 1.793388e+05 1.969133e+05 6.102893e+04 3.849426e+06 2.332526e+06 3.436403e+05 6.558492e+06 1.642721e+06 1.830863e+06 9.517401e+06 5.267343e+06 2.059621e+06 3.038469e+06 1.083542e+07 2.824466e+06 3.146615e+06 2.208940e+06 3.572201e+06 6.132104e+06 5.202539e+06 3.348058e+06 3.230490e+06 3.709480e+06 3.410987e+06 2.310296e+06 2.754942e+06 1.857057e+06 2.526572e+06 3.944895e+06 3.093931e+06 1.322539e+07 4.012529e+06 2.068485e+06 5.404865e+06 2.337897e+06 3.631960e+06 8.221644e+04 6.578179e+06 3.456041e+06 3.462032e+06 6.427403e+05 3.201562e+06 1.751067e+06 2.950056e+06 1.535167e+06 1.197318e+06 2.217877e+06 8.029632e+05 1.670455e+06 6.870327e+06 1.814782e+06 2.383862e+06 2.769869e+06 3.058675e+06 4.192996e+05 3.649001e+06 4.355308e+06 2.498557e+06 1.545184e+06 3.139903e+06 2.112867e+06 5.242811e+06 1.402382e+06 1.937428e+06 1.121036e+06 1.005745e+06 1.307065e+06 2.033816e+06 2.238822e+06 6.762391e+05 2.164474e+06 4.769069e+06 2.743516e+06 3.154043e+06 2.111634e+06 1.012074e+07 1.760784e+06 3.064174e+06 1.121332e+06 1.158482e+06 2.053332e+05 1.674942e+06 3.074527e+06 3.015920e+06 2.746114e+06 3.071029e+06 3.386373e+06 4.052085e+06 3.080333e+06 1.684356e+05 4.029411e+06 4.969146e+06 2.429760e+06 3.569615e+06 2.157546e+06 3.187973e+06 2.732853e+06 1.859791e+06 4.251857e+06 3.845574e+06 3.516534e+06 2.141187e+06 2.730534e+06 1.978843e+06 8.167307e+06 3.617724e+05 2.947946e+06 1.519675e+06 2.130685e+06 5.774955e+06 2.203728e+06 2.609015e+06 3.493157e+06 3.718515e+06 1.957426e+06 2.246376e+06 3.436696e+06 2.264401e+06 1.429320e+06 1.637635e+05 1.913603e+06 2.427662e+06 1.912962e+06 1.875968e+06 3.302023e+06 2.912949e+05 1.186347e+06 1.958045e+06 2.000971e+06 1.117838e+06 1.009758e+06 9.129245e+05 3.219397e+05 3.643602e+06 1.068250e+06 5.678336e+06 2.595101e+06 5.104726e+06 5.223083e+05 4.201783e+05 5.138356e+05 3.958114e+06 2.759593e+06 4.336762e+06 1.545370e+06 3.061093e+05 1.708308e+06 1.248909e+06 2.642330e+05 4.616886e+06 3.509247e+06 3.476673e+06 5.586732e+06 3.279464e+06 1.277313e+06 2.814278e+06 1.481959e+06 9.102912e+05 1.419943e+05 2.678639e+06 6.071491e+05 2.961223e+06 4.169885e+06 4.439655e+06 4.236289e+06 1.692143e+06 1.146437e+06 3.998415e+06 2.351760e+05 1.500089e+06 7.333615e+05 1.105682e+06 5.224676e+06 2.124471e+06 1.340626e+06 2.044834e+05 2.447905e+06 1.449790e+06 1.201234e+06 3.612556e+06 2.194938e+06 1.241363e+06 1.626169e+06 2.610489e+06 8.655062e+05 3.065484e+06 2.336494e+06 3.519617e+06 2.557194e+06 5.712024e+06 1.459524e+06 3.091322e+06 1.513995e+06 1.759122e+06 3.772125e+06 2.603506e+06 3.479329e+06 3.054578e+06 2.500851e+06 4.430659e+06 5.451624e+06 2.074710e+06 4.326612e+06 3.867445e+06 1.522317e+06 1.220561e+06 1.626177e+06 4.262389e+06 2.894823e+06 3.455859e+06 4.152416e+06 2.593283e+06 3.600927e+06 2.563301e+06 2.006808e+06 3.733453e+06 1.474671e+06 4.992056e+06 2.157140e+06 2.312732e+06 C18 H39 N O11_2.702 3.330124e+04 1.437470e+05 2.826510e+05 4.620262e+05 4.043035e+04 2.623420e+05 2.053606e+05 2.893161e+05 50161.50 2.572221e+05 3.688953e+05 2.596073e+05 55632.65 2.730118e+05 2.404891e+05 2.043952e+05 6.392617e+04 4.134161e+05 2.267117e+05 1.907898e+05 9.646954e+04 3.441650e+05 2.314316e+05 2.964003e+05 57088.620 3.841458e+05 1.562633e+05 1.173419e+05 7.634029e+04 4.270982e+05 1.778099e+05 2.241071e+05 101334.98 3.547793e+05 2.706731e+05 2.060496e+05 1.273242e+05 3.487272e+05 3.307380e+05 1.815373e+05 1.173377e+05 2.422373e+05 3.039445e+05 2.041530e+05 7.141597e+04 2.194305e+05 3.184144e+05 2.706893e+05 2.094479e+05 7.713705e+04 2.235398e+05 1.867928e+05 1.330015e+05 1.745901e+05 2.923377e+05 2.382547e+05 4.220940e+05 1.021391e+05 1.697267e+05 9.538701e+04 1.163620e+05 2.360078e+05 8.581438e+04 2.126444e+05 1.643771e+05 2.142688e+05 1.148110e+05 1.544250e+05 9.846139e+04 1.057412e+05 6.011605e+04 9.291986e+04 5.409708e+06 9.600802e+04 1.243721e+05 1.363932e+05 9.548866e+04 2.143807e+06 7.742869e+04 2.000004e+05 5.786222e+04 8.234800e+04 1.791788e+05 9.295023e+04 8.523305e+04 2.252902e+05 6.573244e+05 7.263717e+04 1.089170e+05 9.894466e+04 1.384449e+05 7.417481e+04 1.413072e+05 6.458769e+04 3.168796e+06 8.688517e+04 2.422982e+05 1.807037e+05 8.939262e+04 7.283035e+04 9.898894e+04 1.388692e+05 1.005030e+05 1.350529e+05 1.626177e+05 1.381480e+05 1.478333e+05 1.257538e+05 1.294410e+05 1.280435e+05 1.160662e+05 1.098246e+05 1.170164e+05 1.797068e+05 6.722467e+04 5.647738e+04 7.863906e+07 1.915085e+05 1.530561e+05 2.410662e+05 1.794459e+05 3.046829e+05 2.154333e+05 1.044086e+05 2.123226e+05 1.728681e+05 5.946478e+04 2.429994e+05 6.944859e+04 6.199842e+04 1.033498e+05 1.625776e+05 2.178289e+05 1.205180e+05 7.713573e+04 9.393229e+04 2.033456e+05 7.160218e+05 9.616797e+04 1.156832e+05 1.929596e+05 1.029459e+05 8.234275e+04 9.951092e+04 6.190268e+04 1.215484e+05 1.890541e+05 1.470568e+05 6.799278e+04 1.812894e+05 7.370380e+04 1.218757e+05 1.056294e+05 1.280844e+05 1.434113e+05 5.867850e+04 1.571246e+05 6.118995e+04 1.539803e+05 7.043765e+04 1.461329e+05 2.000715e+05 9.588308e+04 2.191900e+05 2.360932e+06 7.399910e+04 1.707688e+05 3.554992e+05 1.856457e+05 1.706507e+05 2.642910e+05 9.359786e+04 1.908060e+05 1.017211e+05 2.146104e+05 7.050374e+04 1.361121e+05 1.968197e+05 1.055235e+05 8.662792e+04 1.901827e+05 2.193686e+05 9.912213e+04 6.955628e+04 1.065299e+05 1.472329e+05 5.409923e+04 2.127329e+05 6.069499e+04 2.235864e+05 1.189757e+05 7.180605e+04 1.792285e+05 1.832755e+05 2.062608e+05 6.196594e+04 2.361743e+05 1.248376e+05 1.107350e+05 1.063733e+05 6.388996e+05 1.092742e+05 1.730138e+05 7.055130e+04 5.169401e+04 8.699357e+04 1.186058e+05 5.418443e+04 1.084462e+05 7.671523e+04 2.853548e+05 1.036012e+05 1.014078e+05 1.082052e+05 2.319507e+05 9.641475e+04 2.319571e+05 2.065513e+05 8.478239e+04 1.034669e+05 6.885390e+04 6.614270e+04 1.129856e+05 2.310651e+05 1.178672e+05 6.974155e+04 1.853011e+05 2.550632e+05 1.006719e+05 6.053305e+04 1.017194e+05 2.419324e+05 1.545042e+05 9.889423e+04 1.220108e+05 1.583314e+05 5.551926e+04 1.423505e+05 5.834149e+04 4.927714e+04 9.511741e+04 7.205373e+04 1.084449e+05 5.503869e+04 9.001780e+04 2.355123e+05 1.006214e+05 1.351790e+05 1.426983e+06 1.471311e+05 5.956139e+04 1.143002e+05 7.258627e+04 6.576714e+04 6.453910e+04 8.094697e+04 8.737421e+04 1.626173e+05 8.939871e+04 1.857740e+05 1.192340e+05 1.139144e+05 C9 H10 N2 O3_2.704 5.638959e+05 6.768513e+05 6.533048e+05 6.820825e+05 7.234880e+04 5.667790e+05 6.706046e+05 6.368694e+05 40040.24 6.612426e+05 6.461255e+05 5.775223e+05 40877.94 6.540625e+05 8.121874e+05 4.612102e+05 4.649982e+04 7.184690e+05 7.722179e+05 5.548770e+05 7.575652e+04 5.953552e+05 5.936219e+05 2.071638e+05 60515.148 9.050727e+05 5.847767e+05 5.707355e+05 1.114763e+05 7.769662e+05 3.750511e+05 2.557007e+05 133442.33 6.665941e+05 1.271227e+06 1.446357e+05 1.178996e+05 4.826272e+05 1.482743e+05 2.651826e+05 8.216996e+04 5.082425e+05 6.307727e+05 2.236973e+05 3.035738e+04 8.328340e+05 5.662899e+05 1.149183e+05 9.632790e+04 4.824347e+05 1.021558e+05 1.403377e+05 2.901427e+05 1.836137e+05 4.192637e+05 2.303118e+05 6.133082e+05 3.916900e+05 1.624738e+05 3.008877e+05 1.182359e+06 3.378969e+05 8.100359e+05 5.465375e+05 1.294952e+05 9.988514e+04 1.614471e+05 3.206575e+05 4.526679e+05 2.939552e+05 2.105011e+05 7.105437e+05 3.390970e+05 8.359775e+04 7.239495e+05 2.361215e+05 3.224117e+05 7.936923e+05 7.364925e+05 7.381032e+05 5.267725e+05 5.028450e+05 1.788842e+05 3.302751e+05 2.023502e+05 1.211568e+05 9.574417e+04 4.720552e+05 5.722477e+05 2.454776e+05 3.027659e+05 2.024194e+05 1.562765e+05 3.376959e+05 1.169414e+05 2.004096e+05 2.023472e+05 1.945007e+05 6.122906e+04 2.854205e+05 2.877831e+05 1.960549e+05 1.050528e+05 3.648428e+05 1.801893e+05 5.132627e+05 6.321654e+05 1.056486e+06 1.645462e+05 2.392500e+05 3.118015e+05 3.281630e+05 2.691656e+05 1.764042e+06 7.893855e+05 2.067439e+05 3.840144e+05 1.453171e+05 2.040693e+05 1.765440e+05 1.758284e+05 1.106547e+05 1.174729e+05 1.575195e+05 1.208933e+05 3.792221e+05 3.975318e+05 1.707492e+05 1.207760e+05 2.973651e+05 1.045239e+06 1.569934e+05 1.008467e+05 6.120287e+05 3.143535e+05 6.968782e+04 2.227125e+05 1.338902e+05 2.182095e+05 2.191153e+05 2.639058e+05 2.635039e+05 5.346630e+05 1.186597e+05 2.544547e+05 2.806732e+05 1.177833e+05 2.157510e+05 2.953436e+05 3.598553e+05 1.853190e+05 3.609684e+05 6.520049e+05 4.356683e+05 1.514324e+05 3.743246e+05 2.061957e+05 3.694027e+05 2.380143e+05 2.251582e+05 4.833427e+05 1.384217e+05 1.885066e+05 1.864350e+05 3.190820e+05 1.104505e+05 5.853987e+06 1.274789e+05 1.245898e+05 1.404698e+05 1.336901e+06 1.909364e+05 2.472144e+05 4.163154e+05 1.624399e+05 3.115650e+05 1.913734e+05 1.602396e+05 5.793796e+05 1.707375e+05 1.463914e+05 9.730582e+04 3.329388e+05 1.385242e+05 2.487142e+05 1.616266e+05 3.034508e+05 1.850321e+05 8.229142e+05 3.383287e+05 5.845422e+05 3.607522e+05 1.861229e+05 4.000506e+05 1.606392e+05 4.484171e+05 1.206255e+05 3.075290e+05 1.495595e+06 3.679114e+05 5.362134e+05 3.467907e+05 4.584223e+05 1.961766e+05 2.132385e+05 2.166124e+05 3.352991e+05 1.724967e+05 2.397714e+05 2.163230e+05 1.849346e+05 2.448001e+05 6.748175e+05 1.646379e+05 1.086310e+05 3.705622e+05 1.007986e+05 1.210402e+05 1.141010e+05 2.421909e+05 3.964419e+05 3.056793e+05 5.740558e+05 1.178563e+05 3.475040e+05 3.347676e+05 3.013461e+05 1.431176e+05 2.590387e+05 3.735988e+05 2.727683e+05 1.266824e+05 1.871445e+05 3.770704e+05 4.842672e+05 2.040759e+05 4.471389e+05 8.268862e+05 2.122702e+06 4.458246e+05 8.799978e+05 3.074188e+07 4.243036e+05 1.106850e+06 3.749732e+05 1.063213e+05 3.271365e+05 1.158287e+07 6.208389e+05 3.547065e+05 1.983980e+07 2.748116e+05 2.399710e+05 7.747795e+05 5.022046e+05 3.647229e+05 5.194813e+04 2.048422e+05 4.267060e+05 2.307170e+05 8.703851e+05 4.001629e+05 C8 H11 N7 O2 P2_2.723 1.072118e+05 5.503884e+05 5.783042e+05 5.667739e+05 1.160278e+05 6.533665e+05 7.491449e+05 6.037487e+05 113327.17 6.879638e+05 5.702379e+05 5.379435e+05 116072.33 7.441781e+05 5.230763e+05 6.179465e+05 1.069206e+05 6.407628e+05 6.278296e+05 4.893874e+05 1.610046e+05 8.962598e+05 4.506509e+05 1.962462e+05 107816.413 6.924564e+05 6.577145e+05 4.665332e+05 1.251561e+05 6.796009e+05 5.047520e+05 3.896096e+05 126534.13 9.439225e+05 6.896002e+05 4.084243e+05 1.428838e+05 9.390984e+05 5.471165e+05 3.186892e+05 1.330185e+05 7.793408e+05 2.694832e+05 5.516186e+05 8.527881e+04 7.971991e+05 5.558604e+05 5.087874e+05 3.089423e+05 4.918431e+05 3.894148e+05 2.049416e+05 2.383853e+05 4.462121e+05 1.326881e+05 3.138478e+05 2.173871e+05 1.739210e+05 2.097287e+05 2.045109e+05 2.539539e+05 3.592137e+05 3.462573e+05 8.056435e+05 1.953047e+05 2.735917e+05 2.489085e+05 2.532454e+05 5.701637e+05 5.724391e+05 1.514698e+05 4.462381e+05 4.352213e+05 2.800290e+05 2.453370e+05 2.271200e+05 1.550090e+05 2.511666e+05 2.406347e+07 3.006110e+05 1.297918e+05 1.333165e+05 1.908238e+05 1.480740e+05 1.485453e+05 2.471604e+05 3.422607e+05 1.739677e+05 2.896548e+05 5.147382e+05 3.057624e+05 1.546114e+05 3.720481e+05 7.545842e+05 8.312659e+05 1.392225e+05 5.307722e+05 2.044274e+05 1.479143e+05 2.435185e+05 2.926823e+05 2.865598e+05 1.825862e+05 1.674193e+05 3.530942e+05 5.834323e+05 6.591447e+05 2.102205e+06 2.650702e+05 2.703792e+05 1.924050e+05 2.517562e+06 7.426895e+05 2.264347e+05 1.434946e+05 2.236125e+05 2.151723e+05 2.177156e+05 2.055010e+05 2.634891e+05 2.280821e+05 2.076824e+05 2.481311e+05 2.451220e+05 2.800627e+05 2.040800e+05 1.788257e+05 2.926707e+05 1.551644e+05 1.239703e+05 3.318826e+05 4.440358e+06 5.084526e+05 2.494375e+05 2.913100e+05 1.781883e+05 3.914355e+05 1.758306e+05 2.586671e+05 4.414824e+05 2.873534e+05 3.576172e+05 2.322727e+05 5.769281e+05 5.230536e+05 3.992033e+05 4.936837e+05 4.309446e+05 8.072701e+05 1.300267e+06 2.059317e+06 4.071975e+05 6.706021e+05 2.400110e+05 2.371667e+05 1.683285e+05 3.012510e+05 8.515020e+05 6.767150e+05 1.833879e+05 2.756223e+05 2.551743e+05 1.585847e+05 4.835291e+05 6.394625e+05 3.463142e+05 3.523623e+05 3.778211e+05 3.947370e+05 4.509218e+05 5.373601e+05 1.500367e+05 5.102719e+05 7.617568e+05 6.247368e+05 5.060162e+05 1.981870e+05 3.211002e+05 5.200285e+05 1.449466e+05 1.894683e+06 2.889873e+05 5.793840e+05 3.578356e+06 2.483925e+05 1.936989e+05 3.116964e+05 2.710567e+05 1.650038e+07 3.831913e+05 2.075956e+07 1.585259e+05 2.185448e+05 4.425519e+05 2.137224e+06 2.351697e+05 1.659007e+07 4.019758e+06 1.941185e+05 1.368636e+07 1.751529e+07 5.489316e+06 3.682983e+05 2.110115e+05 1.385039e+05 1.342358e+05 2.983039e+05 3.175503e+05 5.260818e+05 2.046648e+05 2.147503e+05 1.890372e+05 3.055002e+05 2.816619e+05 3.254049e+05 1.839470e+05 2.956865e+07 4.602516e+05 1.469093e+05 5.455813e+05 6.170701e+05 2.106660e+05 3.097958e+05 3.974658e+05 2.685682e+05 3.380345e+05 2.260674e+05 2.868732e+05 2.553127e+05 9.806175e+05 1.797483e+05 2.999476e+05 1.923755e+05 1.450922e+05 3.604377e+05 1.829895e+05 6.384291e+05 1.965680e+05 2.361224e+05 3.849511e+05 7.323353e+05 4.786114e+05 2.626594e+05 1.475224e+06 2.653670e+05 3.280706e+05 8.318322e+05 1.566359e+06 1.191607e+06 5.161632e+05 2.228242e+05 2.373761e+05 4.878416e+05 4.540106e+05 1.401285e+06 1.770454e+05 7.940899e+05 3.221690e+05 1.573679e+05 2.078717e+05 1.747951e+06 8.868542e+05 C9 H N6 O6 P3 S2_2.734 5.592390e+04 2.613980e+05 2.139295e+05 2.541432e+05 5.067149e+04 1.713629e+05 2.644677e+05 3.214234e+05 48129.36 2.140934e+05 2.485190e+05 2.528250e+05 49830.83 1.678581e+05 2.462451e+05 2.763757e+05 4.052988e+04 2.181689e+05 2.517813e+05 2.360300e+05 6.463164e+04 2.538646e+05 2.713675e+05 8.980602e+04 39560.622 2.602589e+05 3.112773e+05 2.885242e+05 2.836354e+04 2.437551e+05 2.175873e+05 2.401020e+05 53223.80 1.651227e+05 2.381426e+05 2.813380e+05 5.108925e+04 2.294855e+05 2.613444e+05 7.611103e+04 4.340263e+04 2.160808e+05 2.484008e+05 2.983551e+05 2.913074e+04 1.653873e+05 3.504049e+05 1.398965e+05 4.784486e+05 1.827532e+05 1.994642e+05 7.488762e+05 3.012131e+05 1.914099e+05 1.705595e+05 5.354329e+05 1.723977e+05 3.420975e+05 1.950249e+05 2.369463e+05 5.831233e+05 3.004057e+05 3.980280e+05 2.028877e+05 4.293075e+05 1.275943e+05 2.343200e+05 1.066369e+05 2.095636e+05 1.459720e+05 3.007654e+05 2.551550e+05 9.302298e+05 5.293677e+05 2.032437e+05 5.924074e+05 3.202069e+05 3.114795e+05 4.360436e+04 3.618342e+05 3.528424e+05 4.001570e+05 1.248785e+05 3.597686e+05 2.319358e+05 4.594620e+05 3.441991e+05 1.246024e+05 1.935742e+05 1.011473e+05 1.885091e+05 5.546761e+05 2.326587e+05 1.638207e+05 3.122952e+05 1.705507e+05 1.591263e+05 2.602501e+05 1.519599e+05 1.055976e+05 9.449208e+04 3.683912e+05 1.796634e+05 3.014657e+05 8.069543e+04 1.342964e+05 8.882954e+04 1.641088e+05 7.318824e+04 2.392562e+05 1.894138e+05 9.614870e+04 7.916945e+04 3.446134e+05 3.365406e+05 1.402780e+05 1.486635e+05 3.743421e+05 1.097835e+05 1.315752e+05 2.117226e+05 1.542812e+05 2.285274e+05 2.879306e+05 2.346389e+05 1.263983e+05 2.010437e+05 6.048488e+05 3.169062e+05 2.493078e+05 1.959856e+05 7.145519e+04 1.242512e+05 1.388119e+05 1.590660e+05 2.476485e+05 2.695999e+05 2.817322e+05 9.895420e+04 1.060706e+05 1.367948e+05 2.604187e+05 2.181316e+05 1.183119e+05 9.958448e+04 1.639300e+05 3.619579e+05 2.517536e+05 1.392190e+05 1.886602e+05 1.250488e+05 3.277969e+05 3.217523e+05 2.688895e+05 1.451421e+05 1.725759e+05 1.792616e+05 2.211324e+05 2.549396e+05 1.736214e+05 1.633182e+05 2.076719e+05 2.455844e+05 9.894213e+04 1.623246e+05 2.626775e+05 1.908835e+05 2.240378e+05 1.461478e+05 1.729020e+05 1.400492e+05 1.864608e+05 1.891750e+05 1.478497e+05 2.830625e+05 2.207459e+05 9.989305e+04 2.143294e+05 8.557988e+04 4.779821e+05 1.386914e+06 1.198754e+05 6.679597e+04 5.269804e+05 3.023468e+05 3.207818e+05 7.908845e+04 1.029699e+05 1.730854e+05 1.067984e+05 7.325611e+04 2.225496e+05 9.008027e+04 1.795188e+05 9.883490e+05 1.886059e+05 9.998491e+04 4.531551e+05 9.065444e+04 5.241308e+04 8.730450e+04 4.533859e+05 7.541017e+04 1.294227e+05 1.095217e+05 2.077693e+05 1.966746e+05 6.515487e+04 7.667794e+04 1.166398e+05 1.630611e+05 5.967805e+04 6.286961e+04 8.375767e+04 4.840868e+05 2.138886e+05 2.464417e+05 1.214976e+05 2.558444e+05 1.801654e+05 1.057424e+05 1.846686e+05 9.021425e+04 8.859650e+04 8.971426e+04 1.947355e+05 1.093272e+05 1.336705e+05 1.486691e+05 1.952315e+05 1.335470e+05 1.314114e+05 2.264571e+05 2.483024e+05 1.067483e+05 7.406671e+04 7.756405e+04 8.425353e+04 8.805432e+04 1.075989e+05 3.356222e+05 2.139132e+05 3.907855e+05 1.846272e+05 2.072906e+05 2.902475e+05 1.151761e+05 9.099067e+04 8.529486e+04 2.455788e+05 2.836308e+05 1.509907e+05 2.026043e+05 9.513792e+04 1.924125e+05 2.923274e+05 1.184336e+05 1.392523e+05 1.286365e+05 5.593946e+05 1.713977e+05 1.240286e+05 149.52274_2.735 1.171604e+05 4.685568e+05 4.751740e+05 4.902481e+05 1.094888e+05 7.170661e+05 6.534163e+05 4.919552e+05 123583.06 6.074841e+05 5.132867e+05 4.068028e+05 129749.08 6.770091e+05 5.201457e+05 5.366535e+05 1.045923e+05 5.725619e+05 6.032925e+05 4.696726e+05 1.608775e+05 6.793459e+05 4.751323e+05 1.814996e+05 102509.023 5.337807e+05 6.381248e+05 4.761889e+05 9.527503e+04 5.190591e+05 4.599992e+05 3.983626e+05 117498.12 8.666906e+05 5.581925e+05 3.876117e+05 1.703445e+05 6.761262e+05 5.624354e+05 4.451541e+05 1.223925e+05 5.335484e+05 2.534662e+05 5.752357e+05 8.570098e+04 4.458840e+05 6.120946e+05 3.204464e+05 2.613430e+05 5.574560e+05 3.613538e+05 1.914905e+05 1.871384e+05 3.823791e+05 1.402882e+05 3.526228e+05 2.187947e+05 1.628156e+05 1.934218e+05 2.377603e+05 2.586763e+05 2.654109e+05 3.684577e+05 7.100570e+05 1.967057e+05 2.763428e+05 2.410341e+05 2.956004e+05 6.119574e+05 5.938600e+05 1.467346e+05 5.402331e+05 3.833836e+05 2.113493e+05 2.002731e+05 2.018185e+05 2.025419e+05 3.038711e+05 2.494473e+07 2.685711e+05 1.402289e+05 1.397842e+05 1.838322e+05 1.455781e+05 1.688243e+05 2.163673e+05 3.224083e+05 1.968245e+05 3.157938e+05 5.410988e+05 2.904253e+05 1.536640e+05 2.447403e+05 7.134500e+05 4.578885e+05 1.442644e+05 2.710907e+05 1.939455e+05 1.342078e+05 2.925816e+05 3.348114e+05 2.498971e+05 1.413520e+05 1.666843e+05 3.261757e+05 6.159127e+05 6.541588e+05 1.355416e+06 1.966902e+05 2.389946e+05 1.898616e+05 1.593178e+06 6.470647e+05 2.383890e+05 1.564775e+05 2.415661e+05 2.282233e+05 1.918778e+05 1.811782e+05 2.250267e+05 1.981576e+05 1.890697e+05 2.311626e+05 2.238043e+05 2.169594e+05 1.730509e+05 2.267280e+05 2.582730e+05 1.595131e+05 1.350576e+05 3.225846e+05 3.104456e+06 4.048798e+05 1.971303e+05 3.368113e+05 2.562505e+05 3.963301e+05 1.841279e+05 3.587632e+05 3.718609e+05 2.700965e+05 2.969658e+05 3.222562e+05 5.967415e+05 5.862707e+05 3.901306e+05 2.350439e+05 3.026227e+05 6.832877e+05 6.387776e+05 1.754516e+06 4.007212e+05 6.696609e+05 2.161894e+05 1.700074e+05 1.656832e+05 2.770564e+05 6.555628e+05 5.358396e+05 1.939513e+05 2.021326e+05 1.560722e+05 1.413996e+05 4.449995e+05 2.905106e+05 3.544121e+05 2.924305e+05 2.240311e+05 2.091315e+05 2.379763e+05 6.436981e+05 1.547851e+05 5.061867e+05 6.206556e+05 4.625419e+05 5.960808e+05 1.843722e+05 3.143354e+05 4.725123e+05 1.176983e+05 1.423893e+06 2.905335e+05 6.771812e+05 3.273818e+06 2.301225e+05 1.855794e+05 3.402063e+05 2.644399e+05 1.362776e+07 2.055820e+05 1.387566e+07 1.608384e+05 2.031044e+05 3.307381e+05 1.529818e+06 2.785553e+05 9.378545e+06 2.211327e+06 1.760921e+05 1.096080e+07 1.437331e+07 4.447869e+06 3.483508e+05 2.301363e+05 1.576469e+05 1.381512e+05 2.626309e+05 2.771800e+05 3.588808e+05 2.029622e+05 1.829222e+05 1.545206e+05 3.158568e+05 1.766703e+05 3.789049e+05 2.011403e+05 2.089021e+07 4.571089e+05 1.387886e+05 5.886752e+05 5.555699e+05 2.348136e+05 2.690885e+05 3.832525e+05 2.176988e+05 4.247459e+05 2.210709e+05 2.756143e+05 2.837000e+05 8.390454e+05 1.602862e+05 2.840176e+05 1.849246e+05 1.450798e+05 4.145249e+05 1.946814e+05 6.063990e+05 2.748631e+05 2.712668e+05 4.159448e+05 6.454889e+05 4.958457e+05 2.374451e+05 1.111640e+06 3.413795e+05 2.975614e+05 6.586880e+05 7.758464e+05 7.373009e+05 6.144942e+05 2.584343e+05 2.446027e+05 4.780178e+05 4.811632e+05 1.159614e+06 1.350385e+05 7.919288e+05 3.364948e+05 1.569238e+05 1.935179e+05 1.503884e+06 6.736603e+05 "5-Ethyl-3-methoxy-1,2-benzenediol_2.737" 9.784818e+04 1.353389e+06 1.310298e+06 1.225052e+06 6.505800e+04 1.161301e+06 1.336510e+06 1.325098e+06 89597.64 1.245563e+06 1.453278e+06 1.195999e+06 86115.52 1.349975e+06 1.170249e+06 1.227379e+06 9.278800e+04 1.351599e+06 1.326597e+06 1.279153e+06 1.305508e+05 1.295921e+06 1.399518e+06 8.568152e+05 82209.796 1.413417e+06 1.407901e+06 1.386847e+06 1.259314e+05 1.462955e+06 1.114411e+06 9.941641e+05 117853.21 1.276491e+06 1.477103e+06 1.278034e+06 1.739361e+05 1.392902e+06 1.309002e+06 8.158985e+05 1.264955e+05 1.838891e+06 1.077282e+06 1.056938e+06 1.735134e+05 1.396406e+06 2.041135e+06 6.240980e+05 3.765313e+05 5.985177e+05 4.021559e+05 1.970671e+05 2.781134e+05 7.176561e+05 2.491181e+05 8.324246e+05 4.388542e+05 2.510685e+05 3.480847e+05 6.443089e+05 6.372520e+05 7.846973e+05 6.171830e+05 8.666999e+05 5.321013e+05 4.881049e+05 6.243296e+05 5.186328e+05 8.585649e+05 7.352166e+05 4.775360e+05 1.052607e+06 1.850430e+06 6.869603e+05 2.220524e+05 2.002970e+05 4.908356e+05 3.133521e+05 1.927352e+07 3.493023e+05 2.732059e+05 4.270259e+05 3.964135e+05 3.166797e+05 3.327571e+05 5.563071e+05 4.052205e+05 2.927906e+05 4.885642e+05 5.939230e+05 7.591270e+05 3.175260e+05 6.046899e+05 9.751897e+05 1.241533e+06 3.604078e+05 8.404935e+05 3.338126e+05 4.719353e+05 6.045627e+05 5.573436e+05 4.808371e+05 1.127469e+05 2.914778e+05 7.349879e+05 1.116769e+06 8.135641e+05 2.107994e+06 4.032346e+05 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3.719819e+05 9.875793e+05 2.119200e+07 6.001764e+05 1.970033e+07 4.314605e+05 2.602493e+05 4.064313e+05 1.238734e+07 2.841696e+05 3.134413e+07 1.157215e+07 2.218670e+05 2.018293e+07 2.238477e+07 1.434957e+07 3.346755e+05 1.665962e+05 2.440642e+05 9.934059e+04 3.417638e+05 1.617537e+05 3.375856e+05 2.734763e+05 2.675360e+05 3.302372e+05 4.031336e+05 3.320497e+05 1.981266e+06 3.962359e+05 6.821690e+07 5.968646e+05 1.758970e+05 8.448658e+05 6.060614e+05 2.061862e+05 1.530000e+05 8.048429e+05 3.000585e+05 6.024134e+05 4.279153e+05 3.190875e+05 5.768721e+05 1.568276e+06 2.869996e+05 5.640944e+05 6.370094e+05 2.511878e+05 4.669163e+05 6.738905e+05 7.948713e+05 5.678327e+05 2.084056e+05 4.569748e+05 1.711446e+06 1.032544e+06 1.064489e+06 1.606443e+06 7.226442e+05 1.626777e+06 1.490839e+06 1.977968e+06 1.495904e+06 1.598020e+06 9.371875e+05 7.252665e+05 1.083293e+06 5.860328e+05 2.553471e+06 5.381572e+05 7.749339e+05 5.917899e+05 2.136925e+05 7.221907e+05 2.009416e+06 1.537170e+06 C8 H9 N7 O P2_2.737 1.580244e+05 2.691580e+05 3.093060e+05 2.931726e+05 1.227975e+05 3.257244e+05 3.847494e+05 3.785399e+05 98014.26 3.569449e+05 3.569437e+05 3.381876e+05 104603.20 3.562527e+05 2.146566e+05 3.009940e+05 9.345117e+04 2.851467e+05 4.813774e+05 2.981375e+05 1.422815e+05 3.720360e+05 2.481611e+05 1.495965e+05 83216.079 3.239069e+05 4.047489e+05 3.043617e+05 6.325019e+04 3.033907e+05 2.306883e+05 1.640356e+05 90978.38 4.561680e+05 2.878382e+05 3.436564e+05 1.389615e+05 4.130053e+05 2.503012e+05 1.980578e+05 1.101128e+05 3.726639e+05 2.022492e+05 2.948365e+05 8.063035e+04 2.370857e+05 4.260984e+05 2.813657e+05 2.281637e+05 1.842681e+05 2.053960e+05 1.694837e+05 1.315521e+05 1.701656e+05 1.494035e+05 2.838741e+05 1.546387e+05 1.143507e+05 1.658588e+05 1.294672e+05 1.722055e+05 3.538081e+05 1.434101e+05 3.214349e+05 1.747639e+05 2.564853e+05 1.279760e+05 1.863997e+05 3.161829e+05 1.886158e+05 1.648779e+05 1.921968e+05 3.139308e+05 1.921660e+05 1.849213e+05 1.536506e+05 1.229199e+05 1.546925e+05 5.634103e+06 1.605688e+05 1.095616e+05 1.246943e+05 2.072525e+05 1.332949e+05 1.634628e+05 2.317529e+05 2.197540e+05 1.221822e+05 1.420530e+05 1.522771e+05 1.825091e+05 1.255212e+05 2.500430e+05 2.853271e+05 4.181472e+05 1.268513e+05 2.406872e+05 1.776266e+05 1.206476e+05 1.689031e+05 1.777002e+05 2.361155e+05 1.127462e+05 1.183089e+05 1.419272e+05 2.682096e+05 1.593324e+05 6.701696e+05 1.740225e+05 1.469894e+05 1.364858e+05 9.884359e+05 2.778400e+05 2.170497e+05 1.229131e+05 1.296472e+05 1.951907e+05 1.692844e+05 1.274257e+05 1.700634e+05 1.820076e+05 1.755366e+05 2.172166e+05 1.459385e+05 2.028071e+05 1.470548e+05 1.311257e+05 2.231949e+05 1.264747e+05 1.167973e+05 1.586486e+05 2.527237e+06 3.937916e+05 1.935962e+05 1.192615e+05 1.326551e+05 3.404048e+05 1.546095e+05 1.665988e+05 4.559253e+05 2.568455e+05 3.256906e+05 1.864713e+05 1.458856e+05 1.521150e+05 2.169387e+05 2.096403e+05 1.716797e+05 4.844266e+05 4.492457e+05 9.379324e+05 1.877400e+05 2.910815e+05 1.317660e+05 2.205957e+05 1.765726e+05 1.881186e+05 4.470649e+05 3.665936e+05 1.747673e+05 2.155492e+05 2.051636e+05 1.434264e+05 3.320018e+05 2.583615e+05 1.612332e+05 1.871531e+05 2.101924e+05 1.872994e+05 4.399646e+05 1.052852e+05 1.363633e+05 2.236253e+05 3.359514e+05 4.985651e+05 2.472320e+05 1.325002e+05 1.680194e+05 2.325360e+05 1.404526e+05 9.884860e+05 2.619030e+05 3.084004e+05 1.855924e+06 1.720788e+05 1.458581e+05 2.204237e+05 2.445939e+05 8.846044e+06 2.349717e+05 1.044673e+07 9.850018e+04 1.611386e+05 2.166250e+05 8.163318e+05 1.276742e+05 8.728627e+06 1.852645e+06 2.012554e+05 8.196544e+06 1.019945e+07 3.005533e+06 3.171256e+05 1.084060e+05 1.352658e+05 1.219985e+05 1.915556e+05 1.969856e+05 1.380544e+05 1.567158e+05 1.455944e+05 1.259030e+05 1.346622e+05 1.709193e+05 3.864207e+05 1.529099e+05 1.716526e+07 2.307438e+05 1.190673e+05 1.341692e+05 2.166908e+05 1.148154e+05 1.593935e+05 3.165780e+05 1.774209e+05 1.796718e+05 1.968815e+05 2.155145e+05 1.818102e+05 3.988262e+05 1.754538e+05 2.303306e+05 1.803817e+05 1.683097e+05 1.952449e+05 1.723637e+05 2.338140e+05 1.811340e+05 1.249958e+05 1.488844e+05 2.691814e+05 1.842270e+05 2.103079e+05 7.420167e+05 1.695989e+05 2.423027e+05 3.602732e+05 6.017040e+05 5.051591e+05 1.539504e+05 1.702338e+05 1.672115e+05 2.337528e+05 1.435562e+05 6.278011e+05 1.953286e+05 2.003216e+05 2.052188e+05 1.693302e+05 1.509884e+05 5.142930e+05 4.317602e+05 C52 H110 N3 P S2_2.737 7.258462e+04 5.334472e+05 4.569801e+05 2.866836e+05 6.220193e+04 3.986435e+05 6.194107e+05 4.998503e+05 50312.70 4.488549e+05 4.481622e+05 5.062169e+05 50686.95 5.432411e+05 3.435408e+05 4.833049e+05 4.842007e+04 4.665929e+05 4.687479e+05 5.008906e+05 8.216712e+04 4.982889e+05 4.202515e+05 3.092068e+05 48461.286 4.912314e+05 4.961127e+05 4.454327e+05 4.114122e+04 5.964625e+05 4.460386e+05 3.361924e+05 52363.29 6.333397e+05 3.973394e+05 3.403988e+05 8.819382e+04 6.464373e+05 5.952154e+05 3.182129e+05 7.599583e+04 4.436009e+05 2.669060e+05 4.325889e+05 5.202667e+04 7.163555e+05 4.364016e+05 1.788993e+05 1.450660e+05 2.729678e+05 1.424697e+05 1.340739e+05 7.809836e+04 2.004166e+05 1.137502e+05 2.919320e+05 1.446919e+05 1.085438e+05 1.016558e+05 2.491364e+05 1.182817e+05 3.381690e+05 1.511286e+05 5.654462e+05 1.140026e+05 1.969773e+05 9.024157e+04 7.774001e+04 2.955026e+05 2.434301e+05 9.136368e+04 4.229484e+05 2.996545e+05 1.605871e+05 9.649295e+04 8.697516e+04 1.162435e+05 7.360739e+04 4.859828e+04 3.034893e+05 8.908579e+04 1.249965e+05 9.906837e+04 6.037941e+04 1.440265e+05 1.366984e+05 1.400182e+05 5.081856e+04 1.423020e+05 1.323968e+05 8.698370e+04 6.134349e+04 1.579690e+05 4.298044e+05 8.650151e+05 6.799322e+04 1.634120e+05 1.236978e+05 6.508838e+04 2.686169e+05 2.331516e+05 2.737356e+05 9.229315e+04 1.927905e+05 2.813240e+05 2.929116e+05 1.547334e+05 5.514256e+05 2.704515e+05 7.940034e+04 7.332398e+04 6.696913e+05 4.557989e+05 1.509961e+05 8.430900e+04 6.640157e+04 1.155910e+05 1.138955e+05 1.676112e+05 1.226760e+05 1.874233e+05 1.214492e+05 1.762831e+05 7.582714e+04 1.716805e+05 1.317415e+05 1.593300e+05 1.862273e+05 6.172553e+04 5.214958e+04 2.580580e+05 1.158393e+05 2.363355e+05 9.770834e+04 2.936164e+05 1.018442e+05 2.308379e+05 1.640588e+05 1.071925e+05 2.324845e+05 2.057071e+05 2.140522e+05 2.542101e+05 3.888480e+05 5.615577e+05 9.571351e+04 1.799248e+05 4.025410e+05 5.893383e+05 5.891627e+05 1.138172e+06 4.248705e+05 6.379966e+05 1.853689e+05 8.139408e+04 9.848664e+04 1.658112e+05 4.353623e+05 6.513244e+05 1.750666e+05 8.253849e+04 7.665233e+04 7.184902e+04 1.428653e+05 3.201772e+05 2.875883e+05 1.837080e+05 3.575446e+05 3.301976e+05 1.871974e+05 3.015557e+05 1.022103e+05 1.984995e+05 5.091910e+05 5.417866e+05 4.054091e+05 7.368221e+04 2.384284e+05 3.477985e+05 5.619016e+04 2.318609e+06 2.707664e+05 1.729360e+05 2.005131e+06 8.684162e+04 1.056185e+05 7.347623e+04 1.501436e+05 2.438454e+06 2.078733e+05 8.545800e+05 1.435379e+05 1.622823e+05 1.412375e+05 1.430718e+06 6.052537e+04 7.412375e+05 1.637609e+06 7.413895e+04 2.340628e+06 1.207746e+06 3.542172e+06 1.077642e+05 8.818948e+04 6.907375e+04 5.911909e+04 8.187810e+04 1.743950e+05 8.698575e+04 9.880961e+04 1.842318e+05 7.419705e+04 7.619195e+04 6.950554e+04 5.160786e+05 7.265085e+04 6.235976e+06 2.152195e+05 7.511817e+04 3.866567e+05 2.342228e+05 7.482602e+04 1.124105e+05 3.606517e+05 7.498199e+04 3.333633e+05 1.913248e+05 3.569098e+05 3.164363e+05 7.225750e+05 9.025743e+04 4.279288e+05 1.358172e+05 1.638832e+05 1.822716e+05 2.147988e+05 6.973803e+05 1.182745e+05 6.283569e+04 7.661742e+04 7.374596e+05 2.960209e+05 2.625940e+05 6.444910e+05 3.152265e+05 3.696193e+05 3.839448e+05 4.415567e+05 8.858845e+05 4.336409e+05 2.739903e+05 1.672257e+05 3.675327e+05 2.856295e+05 1.008267e+06 2.051331e+05 4.492471e+05 1.016552e+05 1.250459e+05 9.752536e+04 6.633969e+05 5.537174e+05 C11 H9 N O5 S_2.737 1.566641e+05 5.029265e+05 1.303101e+06 9.367579e+05 8.961572e+04 9.702752e+05 1.478427e+06 8.147091e+05 95088.01 8.388681e+05 1.050010e+06 9.983000e+05 101430.83 9.042564e+05 9.468808e+05 1.141550e+06 7.882870e+04 1.093796e+06 9.355866e+05 7.337287e+05 1.322484e+05 1.231927e+06 9.211605e+05 8.142202e+05 95479.259 1.093551e+06 1.123840e+06 9.184662e+05 1.102757e+05 9.074791e+05 7.332851e+05 8.511871e+05 119865.87 1.666317e+06 9.081649e+05 6.470495e+05 1.734224e+05 1.114412e+06 1.060688e+06 6.129110e+05 1.238890e+05 1.323445e+06 8.014252e+05 8.659860e+05 6.539166e+04 1.477659e+06 1.204974e+06 5.435768e+05 1.494084e+06 1.656012e+06 1.172485e+06 4.153993e+05 8.729318e+05 1.050420e+06 8.652514e+05 4.920181e+05 2.831131e+06 9.642897e+05 1.090496e+06 1.663123e+06 1.211792e+06 2.702686e+05 1.050060e+06 3.177987e+06 9.498886e+05 1.622590e+06 6.109611e+05 1.212161e+06 1.390432e+06 1.102624e+06 1.701001e+06 2.014888e+06 1.606145e+06 6.255111e+05 1.113701e+06 5.334448e+05 9.429018e+05 1.441473e+06 2.662245e+05 4.027058e+05 6.887781e+05 7.769282e+05 2.092198e+06 1.007946e+06 1.218286e+06 1.088222e+06 6.305803e+05 9.632987e+05 1.110355e+06 1.544654e+06 1.167727e+06 1.165835e+05 1.475708e+06 1.908851e+06 9.907836e+05 3.993398e+05 8.992436e+05 2.583498e+05 3.113953e+05 8.051896e+05 1.929549e+06 8.928402e+05 8.257866e+05 3.913351e+05 1.155328e+06 1.539809e+06 1.011448e+06 1.386285e+06 7.135383e+05 1.534705e+06 1.366345e+06 4.967774e+06 1.422148e+06 6.110142e+05 4.493770e+05 8.354406e+05 1.023676e+06 1.875054e+05 1.073193e+06 8.966963e+05 4.603231e+05 8.584020e+05 1.109995e+06 1.850277e+05 7.797464e+05 1.109824e+06 2.019061e+06 4.887182e+05 7.218328e+05 1.639055e+06 8.055068e+05 4.703244e+05 9.030737e+05 1.043717e+06 5.697044e+05 6.554135e+05 8.966037e+05 4.649062e+05 5.446982e+05 1.241984e+06 4.959981e+05 3.441256e+05 9.513919e+05 1.223084e+06 7.260046e+05 7.614136e+05 2.387334e+05 2.258335e+05 1.113898e+05 6.044040e+05 2.021186e+06 1.080728e+06 1.206178e+06 1.411072e+06 1.245857e+06 7.897853e+05 1.720888e+06 6.630656e+06 2.152072e+06 7.805479e+05 1.725710e+06 9.966608e+05 1.351068e+06 1.098348e+06 1.359827e+06 1.274482e+06 9.537596e+05 1.875685e+06 9.869986e+05 1.987006e+06 2.270986e+06 3.166820e+06 1.584142e+06 2.332805e+06 1.087351e+06 5.905888e+05 2.777221e+05 3.279826e+05 1.272800e+06 2.289402e+05 1.563027e+05 2.385165e+05 1.167331e+06 3.646755e+05 1.685587e+05 3.378615e+05 1.487567e+06 8.001006e+05 1.208405e+06 7.915938e+05 9.735864e+05 1.213528e+05 2.206383e+05 6.530808e+05 2.278765e+05 9.628814e+05 2.134717e+05 2.300351e+05 9.381167e+05 1.584093e+06 1.416476e+06 1.326981e+06 1.531936e+06 1.617350e+06 1.036778e+06 1.185983e+05 3.968447e+05 2.301739e+06 2.156153e+06 2.457787e+06 3.474354e+05 1.201542e+06 1.257705e+06 1.295048e+06 2.430889e+05 7.932928e+05 2.196004e+06 1.570229e+06 3.900551e+05 4.058667e+05 1.584972e+06 6.332247e+05 8.776603e+05 1.163670e+06 7.017086e+05 2.123082e+06 1.860478e+06 2.307603e+05 1.220774e+06 8.433406e+05 1.087134e+06 3.661435e+05 2.416674e+05 6.984136e+05 1.132188e+06 9.204698e+05 1.301230e+06 1.867402e+05 1.470272e+06 1.533369e+06 1.733835e+06 1.103921e+06 3.870871e+05 4.063549e+06 1.053842e+06 6.649984e+05 1.364096e+06 2.850598e+06 9.750549e+05 9.494996e+05 1.221057e+06 4.400388e+05 8.515091e+05 2.218271e+06 2.162455e+06 3.861565e+05 1.022269e+06 1.393296e+06 1.179552e+05 1.978064e+05 1.456076e+06 1.449361e+06 C4 H13 P3_2.739 2.151138e+05 7.961670e+05 1.011204e+06 8.385436e+05 1.613025e+05 1.123493e+06 8.724927e+05 1.054280e+06 151001.51 9.630216e+05 1.045097e+06 9.668854e+05 155563.26 1.025158e+06 8.019581e+05 1.078663e+06 1.320422e+05 8.848226e+05 8.727611e+05 7.983501e+05 2.147763e+05 1.198252e+06 1.195217e+06 7.277210e+05 148068.724 8.457874e+05 1.122422e+06 8.989309e+05 1.775065e+05 7.742313e+05 1.121693e+06 9.901990e+05 189612.97 8.462525e+05 9.712488e+05 8.867294e+05 2.630323e+05 1.231898e+06 9.637223e+05 5.654119e+05 2.098427e+05 1.232688e+06 9.304926e+05 6.297806e+05 1.220988e+05 1.424828e+06 8.356883e+05 5.127108e+05 1.014742e+06 1.873338e+06 1.412525e+06 3.648551e+05 7.924888e+05 5.608305e+05 1.022516e+06 7.990938e+05 2.734165e+06 9.425741e+05 1.082633e+06 1.119600e+06 1.892993e+06 1.455006e+06 1.859717e+06 2.144348e+06 1.386550e+06 1.081096e+06 6.390728e+05 1.246220e+06 1.723053e+06 1.358136e+06 6.288574e+05 1.595637e+06 1.006549e+06 6.028980e+05 1.255576e+06 4.740595e+05 1.665719e+06 1.240646e+06 2.724975e+05 3.568816e+05 7.480022e+05 1.705290e+06 2.036136e+06 1.012833e+06 1.120923e+06 1.381976e+06 5.713212e+05 1.204220e+06 1.378393e+06 1.551208e+06 1.554354e+06 2.856418e+05 2.156511e+06 2.704275e+06 1.509407e+06 5.146513e+05 5.995679e+05 3.308155e+05 5.122516e+05 7.845215e+05 1.692581e+06 8.358030e+05 1.065540e+06 7.534945e+05 1.578232e+06 1.423320e+06 1.913298e+06 2.287989e+06 7.972413e+05 1.170309e+06 1.401264e+06 4.707410e+06 1.665519e+06 7.768658e+05 3.150500e+05 7.595371e+05 1.588106e+06 3.063333e+05 8.753786e+05 4.909953e+05 5.968167e+05 6.159151e+05 8.313635e+05 2.976863e+05 1.028149e+06 8.601873e+05 3.886675e+06 6.079132e+05 5.632233e+05 9.198287e+05 7.887154e+05 3.562460e+05 1.338292e+06 7.942486e+05 5.169609e+05 7.571033e+05 1.155431e+06 6.849714e+05 9.099312e+05 1.363055e+06 5.507671e+05 4.770073e+05 8.807130e+05 1.311039e+06 6.997867e+05 8.316242e+05 3.853937e+05 4.988602e+05 1.665215e+05 1.098982e+06 1.772447e+06 1.034689e+06 1.177253e+06 1.667198e+06 1.186097e+06 7.918631e+05 2.010509e+06 6.539009e+06 2.479939e+06 7.409205e+05 1.814153e+06 1.183788e+06 1.533807e+06 1.462801e+06 1.291556e+06 1.602288e+06 1.144257e+06 1.157650e+06 1.477104e+06 2.604359e+06 1.433809e+06 2.812185e+06 1.616177e+06 2.739458e+06 6.438849e+05 5.471748e+05 7.432795e+05 5.491084e+05 2.798070e+06 3.349966e+05 2.402640e+05 4.225378e+05 1.603938e+06 4.365048e+05 2.341592e+05 5.514100e+05 3.139172e+06 8.840630e+05 1.179602e+06 8.116332e+05 1.674540e+06 1.682460e+05 3.216867e+05 3.550640e+05 3.681802e+05 8.459864e+05 3.972915e+05 3.703967e+05 1.561484e+06 1.695471e+06 1.834534e+06 9.899495e+05 1.942721e+06 1.875632e+06 1.663483e+06 2.424038e+05 3.338661e+05 2.140959e+06 1.020844e+06 2.253980e+06 3.764075e+05 1.343641e+06 1.578617e+06 1.509388e+06 3.856777e+05 9.228154e+05 9.026731e+05 2.357462e+06 3.934382e+05 5.688234e+05 1.748369e+06 5.196644e+05 6.205978e+05 8.508807e+05 8.044273e+05 1.283280e+06 1.828476e+06 3.337852e+05 1.573126e+06 1.183389e+06 1.051979e+06 5.137053e+05 3.597866e+05 6.581706e+05 1.407683e+06 6.445654e+05 1.804943e+06 2.994614e+05 2.307544e+06 1.371598e+06 1.552726e+06 1.674068e+06 5.149085e+05 3.789851e+06 1.117211e+06 9.547911e+05 1.631995e+06 2.787520e+06 1.187852e+06 1.465531e+06 1.137838e+06 7.788216e+05 7.775420e+05 1.993967e+06 2.337552e+06 3.825472e+05 1.140120e+06 6.557118e+05 2.924507e+05 2.655924e+05 1.425761e+06 1.633689e+06 C9 H16 O5_2.74 4.121384e+04 1.109642e+06 1.344097e+06 1.217740e+06 3.952151e+04 1.198739e+06 1.415889e+06 1.290784e+06 49765.99 1.272469e+06 1.098256e+06 9.888984e+05 56557.96 1.418040e+06 1.349864e+06 1.315086e+06 5.055841e+04 1.252833e+06 1.366666e+06 1.112483e+06 1.010181e+05 1.300447e+06 1.286109e+06 4.519543e+05 75362.778 1.615305e+06 1.331406e+06 1.259841e+06 6.670321e+04 1.404328e+06 1.268967e+06 7.613223e+05 89935.12 1.531854e+06 1.504116e+06 1.138938e+06 1.377956e+05 1.489946e+06 9.408915e+05 7.125285e+05 9.926631e+04 2.048288e+06 1.186902e+06 6.271755e+05 6.129760e+04 1.431627e+06 1.476457e+06 2.284149e+05 2.531392e+05 7.364424e+05 3.607965e+05 2.907170e+05 2.087876e+05 7.100198e+05 2.581164e+05 2.155218e+05 9.209540e+05 3.378480e+05 2.725810e+05 7.542052e+05 5.459522e+05 4.919427e+05 7.611908e+05 7.592612e+05 3.702901e+05 2.636863e+05 5.241465e+05 4.910641e+05 7.637946e+05 6.711471e+05 4.223122e+05 8.702637e+05 1.090719e+06 6.664451e+05 3.182050e+05 3.613258e+05 3.906765e+05 3.773258e+05 1.528777e+07 2.761716e+05 2.150271e+05 3.546095e+05 1.972268e+05 2.782078e+05 3.303798e+05 4.686133e+05 3.224795e+05 2.238644e+05 4.661886e+05 5.600357e+05 5.327410e+05 3.425204e+05 5.122999e+05 1.139824e+06 1.645066e+06 2.765985e+05 4.557778e+05 1.861994e+05 4.473663e+05 4.936488e+05 3.997362e+05 5.892797e+05 1.546982e+05 2.748419e+05 6.902202e+05 9.489027e+05 1.075160e+06 2.151045e+06 2.586172e+05 1.968339e+05 1.785952e+05 2.768568e+06 9.240946e+05 2.210635e+05 1.282098e+05 1.397676e+05 2.356424e+05 2.734987e+05 1.692363e+05 8.474359e+05 2.026514e+05 1.638278e+05 1.777505e+05 2.009252e+05 2.723031e+05 2.146500e+05 2.927530e+05 2.388940e+05 9.655147e+04 1.904428e+05 7.755895e+05 5.937967e+06 6.191979e+05 7.126529e+05 7.860556e+05 3.759791e+05 5.753998e+05 9.846831e+05 6.043101e+05 1.121527e+06 1.376923e+06 7.539933e+05 1.080379e+06 5.009100e+05 1.330648e+06 1.212831e+06 1.073015e+06 1.903604e+06 2.218289e+06 2.489163e+06 1.893049e+06 6.384276e+05 1.479337e+06 3.205309e+05 1.775287e+05 3.613469e+05 2.811955e+05 1.357829e+06 1.211643e+06 5.310327e+05 4.603096e+05 3.035416e+05 2.865048e+05 4.723956e+05 5.890276e+05 6.805874e+05 2.143442e+05 2.087235e+05 6.207430e+05 7.574391e+05 9.575827e+05 1.853724e+05 1.922292e+06 1.292483e+06 8.285227e+05 1.506733e+06 3.692686e+05 5.754201e+05 9.412767e+05 4.832966e+05 1.638414e+07 3.020539e+05 4.682497e+05 1.120852e+07 5.986963e+05 3.163872e+05 2.861328e+05 5.627492e+05 2.152515e+07 2.416031e+05 3.176873e+07 3.909745e+05 2.367715e+05 6.389302e+05 1.345162e+07 3.862196e+05 2.290710e+07 9.695505e+06 2.260519e+05 2.155454e+07 1.950814e+07 2.043337e+07 2.865681e+05 1.638720e+05 2.564864e+05 1.291618e+05 3.213937e+05 9.397630e+04 4.826812e+05 3.699477e+05 2.017610e+05 3.324590e+05 2.812177e+05 4.294886e+05 1.018626e+06 5.089212e+05 5.701325e+07 6.634517e+05 1.990995e+05 1.136766e+06 6.679608e+05 2.444796e+05 3.144687e+05 7.806218e+05 3.954798e+05 6.078683e+05 6.001997e+05 5.669071e+05 4.604304e+05 1.079323e+06 4.785529e+05 7.444197e+05 3.508019e+05 2.369119e+05 3.145428e+05 6.186109e+05 7.701491e+05 5.275611e+05 1.525267e+05 5.510267e+05 1.594152e+06 1.309095e+06 1.031558e+06 1.301550e+06 8.793178e+05 1.165523e+06 1.463104e+06 1.686335e+06 1.429260e+06 1.709252e+06 9.767593e+05 3.262982e+05 1.198117e+06 8.128300e+05 1.790796e+06 7.097017e+05 1.065720e+06 9.092494e+05 4.205811e+05 1.022011e+06 1.530095e+06 1.024748e+06 C9 H14 O4_2.744 5.885246e+04 1.538465e+06 1.524655e+06 1.461866e+06 5.413798e+04 1.339729e+06 1.687338e+06 1.554407e+06 66384.60 1.264952e+06 1.628184e+06 1.460968e+06 74343.12 1.632361e+06 1.515646e+06 1.380552e+06 7.301981e+04 1.493826e+06 1.484454e+06 1.515622e+06 1.277840e+05 1.601437e+06 1.604005e+06 5.488819e+05 80747.516 1.855269e+06 1.898807e+06 1.712663e+06 7.806801e+04 1.339025e+06 1.484050e+06 1.056251e+06 100100.43 1.580892e+06 1.750017e+06 1.303473e+06 1.495097e+05 1.884261e+06 1.766436e+06 7.882052e+05 1.196637e+05 2.139255e+06 1.020756e+06 8.332839e+05 1.000601e+05 1.613488e+06 1.974182e+06 2.151535e+05 3.495392e+05 8.205673e+05 4.078441e+05 3.537354e+05 3.031517e+05 8.091698e+05 2.955317e+05 3.614881e+05 7.378061e+05 3.437539e+05 4.021640e+05 8.541717e+05 7.056142e+05 7.232197e+05 8.164162e+05 8.788687e+05 9.711180e+05 4.161555e+05 6.070399e+05 5.705030e+05 1.022196e+06 7.618918e+05 4.522613e+05 1.018027e+06 1.159516e+06 7.521556e+05 3.643654e+05 3.062990e+05 5.774465e+05 4.495304e+05 2.441087e+07 3.969746e+05 2.273110e+05 4.279093e+05 2.879278e+05 3.923666e+05 4.657299e+05 8.235861e+05 4.884114e+05 3.287522e+05 6.527294e+05 8.571182e+05 7.864400e+05 3.860202e+05 5.684395e+05 1.260484e+06 1.823955e+06 3.561434e+05 8.297284e+05 3.347915e+05 6.761500e+05 5.336077e+05 5.902292e+05 7.528410e+05 1.453263e+05 3.310114e+05 9.669492e+05 1.114232e+06 1.194607e+06 1.958608e+06 3.841831e+05 2.315365e+05 2.009608e+05 3.402799e+06 1.340005e+06 3.571899e+05 1.710793e+05 1.277719e+05 3.019570e+05 3.344778e+05 1.655017e+05 7.655902e+05 3.275598e+05 3.290671e+05 2.512992e+05 2.068033e+05 3.655734e+05 2.162914e+05 3.580246e+05 2.879536e+05 1.872767e+05 2.514161e+05 8.077809e+05 6.768743e+06 7.592258e+05 6.475113e+05 8.880403e+05 4.528651e+05 1.032072e+06 7.840665e+05 7.015078e+05 1.042297e+06 1.165857e+06 7.756079e+05 1.030557e+06 6.809610e+05 1.136933e+06 1.489989e+06 1.900225e+06 1.781541e+06 2.399774e+06 2.830038e+06 2.721670e+06 6.040116e+05 1.647109e+06 4.088804e+05 3.656288e+05 4.477392e+05 6.154464e+05 1.470703e+06 1.633075e+06 5.412612e+05 4.847012e+05 6.425454e+05 3.787520e+05 7.424368e+05 8.022567e+05 8.404627e+05 3.081299e+05 5.931964e+05 1.048031e+06 6.505333e+05 9.636779e+05 3.731370e+05 1.099220e+06 1.220846e+06 3.052408e+05 1.499582e+06 5.295010e+05 8.065763e+05 1.069266e+06 4.532753e+05 1.777261e+07 4.102751e+05 5.633922e+05 1.302235e+07 6.721222e+05 3.411932e+05 3.488771e+05 7.699717e+05 2.558392e+07 4.541409e+05 3.121855e+07 4.355386e+05 2.974334e+05 6.421808e+05 1.460909e+07 4.763153e+05 3.432652e+07 1.309491e+07 2.880628e+05 2.570728e+07 2.538536e+07 2.103609e+07 3.510356e+05 2.654897e+05 2.893451e+05 1.782575e+05 3.723598e+05 1.685232e+05 6.291151e+05 4.632528e+05 2.320647e+05 5.325092e+05 4.196300e+05 5.482872e+05 1.274217e+06 7.746053e+05 6.736318e+07 7.088897e+05 2.923479e+05 1.208368e+06 5.845169e+05 3.616482e+05 2.852247e+05 9.810455e+05 5.890119e+05 5.398293e+05 8.082105e+05 7.006956e+05 4.521402e+05 1.416432e+06 4.357422e+05 9.662102e+05 5.795337e+05 2.774320e+05 3.632094e+05 7.309864e+05 7.475932e+05 6.274298e+05 2.945448e+05 4.635154e+05 1.986003e+06 1.318735e+06 1.074931e+06 1.901014e+06 9.653324e+05 1.268053e+06 1.912832e+06 2.026695e+06 1.518170e+06 1.969380e+06 1.091668e+06 1.457538e+06 1.255939e+06 7.769507e+05 2.651874e+06 7.606732e+05 9.431428e+05 7.872146e+05 5.734095e+05 1.014349e+06 2.162889e+06 1.508890e+06 Metrizoic acid (peak 1)_2.748 9.456215e+04 4.010028e+06 4.268086e+06 3.125997e+06 8.603483e+04 3.048286e+06 3.414629e+06 4.030305e+06 97020.96 3.498432e+06 3.615379e+06 3.923429e+06 97355.61 3.394032e+06 3.890208e+06 3.573725e+06 7.874216e+04 3.456067e+06 3.706951e+06 2.991325e+06 1.099454e+05 3.778861e+06 3.805661e+06 4.356104e+06 58917.805 3.364147e+06 3.409902e+06 3.342563e+06 5.870391e+04 3.728068e+06 3.583764e+06 3.866002e+06 75429.15 4.255613e+06 2.955976e+06 3.629089e+06 1.178592e+05 3.293383e+06 4.129194e+06 3.259777e+06 6.885957e+04 4.091747e+06 3.418938e+06 3.485074e+06 4.360194e+04 3.486534e+06 4.017231e+06 3.520027e+06 4.011411e+06 2.150815e+06 2.620772e+06 4.919146e+06 4.555079e+06 1.821894e+06 3.268992e+06 6.456643e+06 2.958206e+06 3.938408e+06 1.431976e+06 3.000699e+06 4.393954e+06 4.773052e+06 3.988046e+06 2.770135e+06 7.670531e+06 5.275428e+06 3.748733e+06 2.866574e+06 2.216346e+06 2.694927e+06 7.383341e+06 3.539370e+06 5.402162e+06 5.464326e+06 2.033247e+06 5.548599e+06 1.789691e+06 3.805119e+06 9.392622e+04 4.412709e+06 5.449662e+06 4.763570e+06 1.262999e+06 4.611930e+06 3.805368e+06 3.903719e+06 3.778084e+06 1.703250e+06 2.446780e+06 7.909531e+05 3.806582e+06 6.728369e+06 3.693095e+06 2.937025e+06 3.950066e+06 4.834041e+06 5.825407e+06 7.029482e+06 8.009948e+06 3.343851e+06 2.021269e+06 5.964635e+06 4.888507e+06 6.958170e+06 3.036610e+06 2.612115e+06 1.815890e+06 1.334718e+06 2.584563e+06 2.984535e+06 4.687593e+06 8.520577e+05 3.194195e+06 7.243037e+06 6.530452e+06 4.037343e+06 1.606468e+06 6.596415e+06 2.840060e+06 3.798841e+06 4.948849e+06 4.636902e+06 4.381907e+06 3.950937e+06 4.798054e+06 3.253522e+06 4.020847e+06 4.668671e+06 4.963561e+06 5.787396e+06 4.368092e+06 1.588333e+05 4.057429e+06 3.856604e+06 3.848749e+06 4.638340e+06 3.561389e+06 5.323967e+06 4.269696e+06 3.882049e+06 4.865701e+06 4.067118e+06 5.492674e+06 3.657571e+06 6.149489e+06 5.680774e+06 9.213068e+06 5.139026e+06 5.991852e+06 5.075969e+06 3.586578e+06 2.196093e+06 1.980454e+06 2.709785e+06 2.628729e+06 2.810021e+06 2.078213e+06 3.182104e+06 2.178201e+06 2.866192e+06 2.182397e+06 2.679257e+06 2.292842e+06 2.314017e+06 1.772891e+06 2.420000e+06 2.452366e+06 2.424512e+06 2.237998e+06 1.933094e+06 2.248451e+06 2.725859e+06 2.732551e+06 1.028861e+06 3.180864e+06 3.952647e+06 2.407869e+06 3.917834e+06 2.418792e+06 6.325394e+06 1.142838e+07 2.076972e+06 2.197573e+05 6.589058e+06 3.680695e+06 4.060127e+06 1.533069e+06 1.956869e+06 1.288583e+06 1.320138e+06 2.772317e+05 4.363597e+06 2.665530e+06 3.389816e+06 9.702995e+06 2.082957e+06 1.117858e+06 3.789095e+06 9.776579e+05 1.082855e+06 2.864276e+05 5.783431e+06 5.603916e+05 2.386065e+06 3.306654e+06 3.639658e+06 3.258912e+06 1.460614e+06 7.736766e+05 2.697868e+06 2.828898e+06 1.070859e+06 6.557160e+05 2.204517e+06 4.086543e+06 1.904160e+06 1.381023e+06 7.088567e+05 4.767204e+06 2.332427e+06 9.989992e+05 3.073144e+06 8.894208e+05 1.590311e+06 2.975174e+06 2.703251e+06 1.676845e+06 3.736674e+06 2.218975e+06 3.171946e+06 2.756494e+06 2.848589e+06 2.836292e+06 3.246278e+06 1.058688e+06 2.729240e+06 2.377600e+06 2.932372e+06 1.465495e+06 2.989349e+06 4.774851e+06 3.229736e+06 4.210364e+06 2.091816e+06 3.959752e+06 3.496862e+06 2.116865e+06 6.940776e+05 1.248640e+06 3.006646e+06 4.210774e+06 2.237478e+06 3.215273e+06 2.026945e+06 3.850766e+06 5.978409e+06 3.442557e+06 2.487364e+06 1.437850e+06 6.324672e+06 2.610155e+06 2.066984e+06 644.81151_2.753 5.813159e+04 2.771058e+06 3.083249e+06 2.026475e+06 4.411420e+04 1.869417e+06 2.260137e+06 2.670125e+06 55182.34 2.427257e+06 2.387527e+06 2.586428e+06 53483.10 2.295984e+06 2.726927e+06 2.409365e+06 4.186128e+04 2.283839e+06 2.488965e+06 1.949270e+06 5.451325e+04 2.465978e+06 2.499052e+06 3.328658e+06 28087.636 2.354031e+06 2.470713e+06 2.496125e+06 3.836943e+04 1.207349e+06 2.584282e+06 2.520993e+06 41570.00 3.368637e+06 1.871457e+06 2.512020e+06 6.142415e+04 2.239929e+06 2.821202e+06 2.144816e+06 4.541733e+04 2.819555e+06 2.123917e+06 2.136043e+06 2.276794e+04 2.536540e+06 2.893023e+06 2.252401e+06 2.665156e+06 1.627453e+06 1.921273e+06 1.789893e+06 3.167528e+06 9.143034e+05 2.266265e+06 4.010468e+06 2.064656e+06 2.691042e+06 8.634904e+05 2.031772e+06 2.995597e+06 3.319577e+06 2.691568e+06 2.045733e+06 4.654909e+06 3.605424e+06 2.153706e+06 2.050682e+06 1.365793e+06 1.895106e+06 4.654128e+06 2.254495e+06 3.525982e+06 3.206566e+06 1.597158e+06 3.624214e+06 1.158948e+06 2.545135e+06 5.025029e+04 2.842320e+06 3.809101e+06 3.272683e+06 1.037206e+06 3.080826e+06 2.551886e+06 2.508134e+06 2.809397e+06 1.363678e+06 1.634633e+06 5.190356e+05 2.749939e+06 4.647688e+06 2.809893e+06 2.145791e+06 2.818147e+06 3.150676e+06 4.044707e+06 4.440535e+06 4.660761e+06 2.469177e+06 1.425196e+06 3.880027e+06 3.313294e+06 4.281243e+06 2.246012e+06 2.147947e+06 1.498811e+06 1.199769e+06 1.800076e+06 2.331092e+06 3.380570e+06 5.742998e+05 2.350202e+06 4.874769e+06 3.489923e+06 3.085761e+06 7.528226e+05 3.823100e+06 2.062702e+06 2.579051e+06 3.379595e+06 3.400346e+06 3.011712e+06 3.023207e+06 3.358093e+06 2.184585e+06 2.914042e+06 3.228936e+06 3.187121e+06 3.635342e+06 2.903019e+06 8.302653e+04 2.859472e+06 2.685951e+06 2.572847e+06 2.793351e+06 2.460313e+06 3.548616e+06 2.928939e+06 2.629252e+06 3.331554e+06 2.336570e+06 3.710278e+06 2.605970e+06 4.096743e+06 4.028018e+06 5.878064e+06 3.269510e+06 3.979461e+06 3.363834e+06 2.499520e+06 1.692539e+06 1.279140e+06 2.046796e+06 1.849377e+06 2.128559e+06 1.550416e+06 2.695839e+06 1.463049e+06 1.980695e+06 1.818851e+06 1.926067e+06 1.663663e+06 1.797544e+06 1.183980e+06 1.659069e+06 1.711792e+06 1.621591e+06 1.705822e+06 1.426925e+06 1.618311e+06 1.968982e+06 2.090156e+06 6.322134e+05 2.098701e+06 2.916025e+06 2.070006e+06 2.461962e+06 1.628984e+06 3.641942e+06 6.654505e+06 1.662747e+06 4.995549e+04 4.593222e+06 2.246914e+06 2.764312e+06 1.254802e+06 1.430627e+06 1.010958e+06 1.091341e+06 2.232489e+05 2.650233e+06 1.895683e+06 2.594102e+06 6.069077e+06 1.524531e+06 8.687874e+05 2.185999e+06 7.775003e+05 8.504813e+05 2.205923e+05 3.791840e+06 3.833581e+05 1.649400e+06 2.459271e+06 2.102738e+06 2.390764e+06 1.115493e+06 4.917939e+05 1.867174e+06 2.021220e+06 6.980363e+05 5.316746e+05 1.632911e+06 2.768893e+06 1.248972e+06 1.050132e+06 3.846586e+05 2.977362e+06 1.576305e+06 7.250393e+05 1.999711e+06 5.682338e+05 1.137084e+06 1.964983e+06 2.007827e+06 1.148731e+06 2.592249e+06 1.460453e+06 2.320726e+06 1.610073e+06 1.962471e+06 2.098900e+06 1.972205e+06 1.002963e+06 1.907414e+06 1.803470e+06 2.245979e+06 1.052300e+06 1.956425e+06 3.036002e+06 2.162966e+06 2.593337e+06 2.057161e+06 2.682140e+06 1.778227e+06 1.683432e+06 5.310392e+05 7.936111e+05 1.902711e+06 2.755670e+06 1.808996e+06 2.292705e+06 1.534935e+06 3.058985e+06 3.959720e+06 2.610390e+06 1.630750e+06 1.087610e+06 3.896337e+06 2.435484e+06 1.412767e+06 763.75674_2.755 6.803174e+04 9.424957e+05 1.002082e+06 9.376620e+05 4.710542e+04 9.485200e+05 1.325240e+06 1.108946e+06 43807.44 9.510822e+05 1.175105e+06 9.433953e+05 41758.98 9.908829e+05 9.651526e+05 1.102517e+06 3.249346e+04 1.009423e+06 9.324932e+05 9.655284e+05 4.430744e+04 1.462953e+06 9.527679e+05 8.372461e+05 22860.281 9.463117e+05 1.076923e+06 1.198395e+06 3.043609e+04 1.130937e+06 6.729765e+05 9.553463e+05 31970.62 1.298114e+06 1.167909e+06 8.758656e+05 4.511708e+04 1.042794e+06 1.081090e+06 9.786903e+05 3.397804e+04 1.298432e+06 8.733019e+05 7.099758e+05 1.804276e+04 1.195311e+06 1.152218e+06 1.031992e+06 1.115674e+06 7.094902e+05 1.097293e+06 1.492920e+06 1.300313e+06 5.814046e+05 1.041395e+06 1.415798e+06 1.213898e+06 1.087395e+06 9.658613e+05 8.727034e+05 1.435441e+06 1.534472e+06 1.169012e+06 1.035719e+06 1.313744e+06 1.510309e+06 1.326195e+06 1.120476e+06 8.699843e+05 1.335698e+06 1.958944e+06 1.249481e+06 1.645950e+06 1.957762e+06 8.417366e+05 1.793466e+06 1.225438e+06 1.501227e+06 3.924023e+04 1.371091e+06 1.259646e+06 1.246237e+06 6.023814e+05 1.173208e+06 1.269385e+06 1.304686e+06 1.135057e+06 6.424569e+05 1.093997e+06 5.591192e+05 1.251591e+06 1.771487e+06 1.474648e+06 9.285603e+05 1.443516e+06 1.243500e+06 1.336030e+06 1.715457e+06 1.589178e+06 1.039663e+06 7.250977e+05 1.643070e+06 1.786757e+06 1.677547e+06 1.170251e+06 1.217205e+06 6.690658e+05 5.364577e+05 1.351707e+06 1.292861e+06 1.326998e+06 6.222144e+05 1.278558e+06 1.840978e+06 1.765368e+06 1.289180e+06 1.019646e+06 2.052581e+06 1.114073e+06 1.142344e+06 1.492760e+06 1.151568e+06 9.919052e+05 1.272396e+06 1.490447e+06 1.395535e+06 1.116543e+06 1.858094e+06 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8.819857e+05 1.004793e+06 5.329978e+05 3.304516e+05 7.807483e+05 9.060327e+05 5.969192e+05 3.712039e+05 8.896190e+05 1.200538e+06 8.263301e+05 3.215982e+05 3.457986e+05 9.322179e+05 8.286571e+05 3.046148e+05 8.462732e+05 5.433681e+05 7.197579e+05 9.747997e+05 6.754624e+05 7.002190e+05 8.947989e+05 6.939491e+05 1.013996e+06 1.086282e+06 8.618116e+05 8.450607e+05 8.969602e+05 4.626802e+05 7.175764e+05 6.763351e+05 8.433026e+05 6.315509e+05 9.563419e+05 1.857600e+06 7.848144e+05 1.320418e+06 6.893989e+05 9.016557e+05 9.320941e+05 6.589257e+05 3.947711e+05 6.850735e+05 9.052125e+05 9.682602e+05 7.948097e+05 9.807568e+05 7.104219e+05 7.362595e+05 1.395353e+06 1.025199e+06 9.694485e+05 4.185210e+05 1.407616e+06 7.074745e+05 6.725129e+05 C18 H20 N2 O6_2.756 5.521673e+04 1.274856e+05 1.194655e+05 1.133225e+05 3.645257e+04 1.431248e+05 1.876496e+05 2.708996e+05 31100.33 5.063774e+04 1.696751e+05 1.964964e+05 34897.15 8.711319e+04 1.369065e+05 1.665620e+05 3.407064e+04 7.094752e+04 1.612993e+05 1.881079e+05 4.479850e+04 1.021032e+05 1.730191e+05 1.844500e+05 21172.330 1.142370e+05 1.636762e+05 1.667333e+05 3.457001e+04 8.458470e+04 1.276695e+05 2.339564e+05 44815.85 1.333781e+05 9.877621e+04 2.213042e+05 7.544395e+04 1.347480e+05 1.277520e+05 1.800086e+05 4.820435e+04 1.704702e+05 1.080041e+05 1.910515e+05 2.025652e+04 5.236954e+04 1.413998e+05 1.420907e+05 7.296721e+04 3.953797e+04 5.168556e+04 6.317937e+04 7.944444e+04 8.541818e+04 4.512027e+04 7.576309e+04 4.217794e+04 5.634455e+04 1.172417e+05 6.335206e+04 1.511209e+05 9.172045e+04 5.079186e+04 7.443620e+04 1.306385e+05 6.966208e+04 5.308260e+04 9.150585e+04 4.089508e+04 5.350161e+04 7.194210e+04 9.480841e+04 5.245469e+04 4.324477e+04 6.282368e+04 5.633824e+04 8.676549e+04 3.272301e+04 3.056892e+05 8.321986e+04 4.314241e+04 3.982644e+04 8.000111e+04 5.969538e+04 1.004099e+05 4.791275e+04 4.666647e+04 4.268777e+04 3.700796e+04 4.852782e+04 1.157456e+05 4.896336e+04 4.689302e+04 3.785422e+04 6.327211e+04 4.481693e+04 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4.463414e+04 5.428742e+04 3.762812e+04 6.214540e+04 8.297537e+04 6.822987e+04 3.792046e+04 5.658639e+04 5.580504e+04 4.113032e+04 4.895693e+04 4.045000e+04 6.220678e+04 3.014509e+04 5.409240e+04 3.805992e+04 1.335334e+05 6.084655e+04 2.826997e+04 7.167717e+04 8.663370e+04 9.323508e+04 2.777074e+04 7.016233e+04 7.035046e+04 8.513077e+04 4.809452e+04 7.915233e+04 4.174970e+04 8.010334e+04 3.469703e+04 4.572978e+04 4.480478e+04 5.194508e+04 4.521954e+04 7.848107e+04 4.782126e+04 1.261946e+05 3.655297e+04 4.684714e+04 5.934698e+04 4.786317e+04 5.147986e+04 5.664835e+04 8.459395e+04 3.535796e+04 4.530996e+04 4.652964e+04 3.371200e+04 6.457024e+04 7.589903e+04 4.343366e+04 3.389050e+04 7.934975e+04 6.414950e+04 6.022763e+04 3.833477e+04 4.671342e+04 5.808893e+04 7.803308e+04 4.690685e+04 8.302925e+04 7.447145e+04 5.142178e+04 7.686888e+04 6.359822e+04 4.087006e+04 5.469312e+04 1.360479e+05 4.442294e+04 5.964463e+04 3.792076e+04 5.338924e+04 6.491081e+04 1.262789e+05 4.204387e+04 3.801759e+04 7.110718e+04 7.038748e+04 5.828279e+04 4.212583e+04 8.943255e+04 7.258800e+04 6.485895e+04 3.756168e+05 4.552087e+04 7.157941e+04 5.270884e+04 1.579827e+05 C18 H46 N5 O4 P3_2.756 1.253745e+05 1.693909e+05 1.500692e+05 1.704168e+05 3.759378e+04 1.100309e+05 1.212529e+05 2.199351e+05 45441.29 1.112536e+05 1.474482e+05 1.785456e+05 51926.58 1.496445e+05 1.556767e+05 1.209464e+05 4.421869e+04 1.544799e+05 1.395519e+05 1.261885e+05 6.254953e+04 1.554290e+05 1.612424e+05 2.180134e+05 32939.445 1.194360e+05 1.470974e+05 1.542952e+05 4.570276e+04 1.369195e+05 1.161825e+05 1.601691e+05 52640.60 1.894356e+05 9.888111e+04 3.483660e+05 7.151062e+04 1.977602e+05 1.542601e+05 1.893781e+05 5.173278e+04 1.041508e+05 8.632744e+04 1.346476e+05 2.303850e+04 1.282596e+05 1.628507e+05 1.626529e+05 7.864044e+04 5.241355e+04 6.947749e+04 7.270759e+04 8.832623e+04 8.951756e+04 3.933204e+05 6.820351e+04 1.579680e+05 5.565261e+04 1.129104e+05 4.731877e+04 7.441720e+04 9.040379e+04 7.109566e+04 7.083269e+04 7.619561e+04 6.103511e+04 9.135068e+04 9.055691e+04 5.583553e+04 8.150895e+04 5.486706e+04 5.150100e+04 1.637679e+06 5.183508e+04 1.805609e+05 8.706292e+04 5.140983e+04 7.403663e+05 5.036137e+04 1.111125e+05 4.299632e+04 5.257738e+04 7.734657e+04 5.588373e+04 5.560029e+04 5.538095e+04 3.303442e+05 8.198649e+04 5.415828e+04 7.183888e+04 6.808338e+04 4.817899e+04 6.985413e+04 5.506762e+04 1.890322e+06 5.984072e+04 1.126361e+05 7.286137e+04 7.349624e+04 4.262462e+04 8.679500e+04 1.092951e+05 6.312735e+04 9.351586e+04 7.268156e+04 8.192803e+04 9.325659e+04 1.024735e+05 8.436952e+04 1.200093e+05 7.682858e+04 7.163634e+04 8.044832e+04 8.530540e+04 4.270447e+04 5.216090e+04 2.443577e+07 1.852948e+05 9.578821e+04 1.251850e+05 6.914035e+04 8.699418e+04 7.245428e+04 7.840630e+04 7.670379e+04 6.897111e+04 4.785303e+04 5.035743e+04 4.030631e+04 4.253738e+04 7.531443e+04 9.826014e+04 5.832600e+04 9.003311e+04 4.631136e+04 5.212466e+04 7.176794e+04 4.510237e+05 7.596152e+04 9.639900e+04 7.821084e+04 6.287495e+04 5.488110e+04 6.831818e+04 4.309836e+04 7.202222e+04 7.155895e+04 9.655537e+04 4.057760e+04 1.056699e+05 4.289474e+04 7.509272e+04 4.944935e+04 9.044205e+04 1.602689e+05 5.672085e+04 7.823440e+04 5.389226e+04 5.665741e+04 5.403073e+04 8.165804e+04 7.356573e+04 7.432342e+04 7.320861e+04 2.155721e+06 4.743096e+04 8.051606e+04 9.640552e+04 8.766120e+04 8.106288e+04 9.745993e+04 1.253303e+05 7.474485e+04 6.104332e+04 5.506332e+04 5.384588e+04 7.563305e+04 8.127905e+04 8.975879e+04 5.024545e+04 5.741431e+04 5.710512e+04 7.178870e+04 4.400356e+04 6.374004e+04 6.718557e+04 4.168916e+04 5.390733e+04 5.151303e+04 8.819818e+04 7.885611e+04 4.490687e+04 8.587559e+04 1.015701e+05 9.389102e+04 4.048766e+04 8.084518e+04 9.386950e+04 7.763943e+04 7.425995e+04 3.069580e+05 8.935455e+04 7.564227e+04 4.898812e+04 5.373820e+04 4.540925e+04 7.027120e+04 5.432373e+04 7.998632e+04 5.113556e+04 7.888807e+04 5.035680e+04 6.415107e+04 7.621947e+04 4.687553e+04 9.153444e+04 1.236673e+05 6.751400e+04 4.563428e+04 6.604798e+04 6.805378e+04 4.782182e+04 9.742480e+04 7.356109e+04 6.058120e+04 5.217761e+04 1.142818e+05 1.178852e+05 5.599318e+04 4.881950e+04 5.502062e+04 6.712346e+04 8.758856e+04 4.999701e+04 8.703997e+04 7.030993e+04 5.902928e+04 1.316906e+05 5.163292e+04 5.012699e+04 5.162170e+04 5.163319e+04 6.058543e+04 4.152511e+04 5.427285e+04 5.242812e+04 8.699425e+04 9.981422e+04 1.841310e+06 5.265628e+04 3.827861e+04 9.009034e+04 4.101964e+04 4.841651e+04 6.155507e+04 5.255220e+04 9.651885e+04 6.703197e+04 6.820820e+04 6.930331e+04 6.849469e+04 7.363859e+04 1175.91939_2.758 8.053605e+04 1.036435e+05 1.593966e+05 7.182452e+04 5.864848e+04 7.680178e+04 1.094189e+05 6.969967e+04 58945.09 6.002927e+04 1.583769e+05 1.050978e+05 48418.74 9.001552e+04 8.735442e+04 1.515058e+05 3.324945e+04 5.092829e+04 1.630347e+05 1.109487e+05 4.295173e+04 1.289501e+05 7.033963e+04 1.162915e+05 19446.862 1.029408e+05 1.037291e+05 9.058558e+04 1.915508e+04 1.004382e+05 1.385808e+05 9.695122e+04 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1.575379e+05 9.244088e+04 4.687423e+04 7.831309e+04 5.154558e+04 4.423125e+04 8.434851e+05 1.303172e+05 1.278824e+05 2.035304e+04 6.399154e+04 3.096374e+05 1.009838e+06 4.277479e+05 1.793399e+05 3.276260e+05 8.697021e+04 7.913186e+05 9.017047e+04 4.232627e+04 9.535976e+04 9.697646e+04 3.358450e+04 1.406264e+05 1.742702e+05 1.480764e+05 8.321845e+05 3.380211e+05 1.720647e+05 9.636558e+04 6.942309e+04 4.984474e+05 4.016753e+04 5.050986e+05 3.217659e+05 4.468574e+05 7.270726e+04 2.912688e+04 3.189092e+04 8.910472e+04 1.992205e+05 2.708647e+05 4.776205e+04 5.263846e+05 3.048428e+04 1.483605e+05 5.733582e+04 6.661538e+05 5.889456e+04 4.780684e+05 5.267771e+04 5.944937e+04 1.252439e+05 3.783858e+05 1.647785e+05 7.440878e+05 5.531268e+04 4.826344e+05 1.901059e+05 1.308187e+05 2.468121e+04 1.707022e+05 7.842467e+05 2.728937e+04 2.225622e+05 2.152353e+05 6.049957e+04 7.371314e+05 1.312731e+05 4.363868e+05 9.268390e+04 2.115837e+04 1.292674e+06 7.854867e+04 2.480160e+05 2.227796e+05 2.068005e+04 6.462163e+05 1.067220e+05 6.808235e+04 1.026287e+06 4.806376e+04 4.796996e+04 2.424428e+04 1.035293e+05 3.448769e+04 4.648793e+04 2.437727e+05 4.100534e+04 1.194553e+05 2.550125e+05 2.224840e+05 2.055726e+05 2.673088e+04 5.164257e+04 1.134929e+05 3.548513e+04 6.457091e+05 1.269973e+05 2.291146e+05 1.439059e+05 2.048848e+05 6.411910e+04 9.604038e+04 2.949228e+05 8.725826e+04 4.772366e+04 1.006421e+05 4.184944e+05 3.688475e+04 1.263366e+06 9.972321e+05 4.774099e+04 3.428295e+04 8.344986e+04 5.731289e+04 1.639344e+05 3.107423e+04 3.400998e+05 4.011039e+04 3.990462e+05 3.730508e+04 3.327047e+04 3.731074e+04 8.616454e+04 8.471327e+05 2.477057e+04 8.945849e+04 2.708981e+04 6.268606e+04 1.669373e+05 3.676525e+04 3.512634e+05 8.120455e+04 1.898434e+05 4.715148e+04 1.173919e+05 2.245827e+05 2.003585e+05 1.398374e+05 3.337425e+05 3.979757e+04 1.599513e+05 4.949927e+04 5.813457e+04 4.371473e+05 3.829368e+04 2.748356e+05 1.110629e+05 3.576001e+05 2.502885e+04 6.233719e+05 7.579532e+05 C9 H30 N9 O3 P_2.759 6.733448e+05 3.213096e+06 3.358525e+06 3.089246e+06 7.689444e+04 2.832552e+06 3.016517e+06 3.788277e+06 209920.25 2.824885e+06 3.383236e+06 3.755160e+06 1237587.41 2.762189e+06 3.074817e+06 3.253257e+06 2.233828e+06 2.755424e+06 3.156436e+06 2.938495e+06 1.643396e+05 3.416223e+06 3.459107e+06 3.331629e+06 26936.233 2.710587e+06 3.650562e+06 2.671204e+06 1.357020e+05 3.206205e+06 3.158810e+06 3.436504e+06 119181.21 3.607253e+06 2.578272e+06 3.179213e+06 2.995758e+05 2.986537e+06 3.447472e+06 3.426446e+06 1.248632e+05 2.900060e+06 3.179504e+06 3.389372e+06 2.683056e+05 2.956715e+06 3.217557e+06 3.161232e+06 5.068518e+05 7.021842e+05 6.263865e+05 6.236206e+05 4.963739e+05 3.676735e+05 1.719752e+06 4.713297e+05 1.112042e+07 4.525263e+05 1.007533e+06 6.691900e+05 5.755382e+05 8.200383e+05 4.162298e+05 5.000014e+05 5.361129e+05 5.038089e+05 6.054204e+05 1.892856e+05 4.180167e+05 7.746369e+05 5.868914e+05 5.960375e+05 6.417302e+06 6.153910e+05 1.058650e+06 6.436364e+05 5.564599e+05 1.332574e+07 2.896629e+06 8.635046e+05 6.200181e+05 9.294347e+05 4.079766e+05 5.748929e+05 4.968565e+05 6.106424e+05 4.421780e+06 6.346892e+05 1.111721e+06 2.943879e+06 9.049625e+05 5.282634e+05 1.721495e+06 8.347811e+05 1.468921e+07 6.453821e+05 5.615631e+05 7.494305e+05 3.334464e+05 4.952675e+05 8.690295e+05 6.664753e+05 6.680626e+05 6.562507e+05 9.906875e+05 1.958608e+06 6.843217e+05 1.828451e+06 6.875440e+05 5.676706e+05 3.710979e+05 8.607822e+05 7.009451e+05 9.005852e+05 4.707003e+05 3.252513e+05 3.894067e+08 9.363739e+05 6.590275e+05 7.379808e+05 6.121204e+05 1.989462e+06 3.999678e+05 7.881599e+05 3.936472e+05 1.081704e+06 7.677614e+05 4.916687e+05 4.371113e+05 1.117240e+06 5.491866e+05 2.667914e+05 4.668819e+05 7.923208e+05 5.433643e+05 9.831092e+05 9.666609e+05 3.896239e+06 9.326102e+05 1.051637e+06 1.287011e+06 1.537850e+06 2.385774e+06 1.059515e+06 4.875664e+05 3.882145e+05 7.512077e+05 3.975543e+05 7.773888e+05 5.556815e+05 8.473951e+06 3.357196e+06 2.942972e+06 7.856449e+05 7.423571e+06 1.481970e+06 6.715559e+05 1.321847e+06 1.760374e+06 5.743353e+05 7.668594e+05 8.636845e+05 5.135503e+05 1.034425e+06 1.812449e+07 5.232982e+05 5.469536e+05 1.581427e+06 9.270187e+05 7.128026e+05 3.897101e+06 4.100354e+06 1.097959e+06 8.708270e+05 5.298958e+05 3.694578e+05 4.702303e+05 3.715790e+05 5.847159e+05 8.247919e+05 8.249037e+05 4.711322e+05 6.704034e+05 1.995358e+06 7.477016e+05 5.445629e+05 6.177955e+05 1.344146e+06 1.736938e+06 7.995976e+05 9.970268e+05 9.422436e+05 8.304375e+05 7.124247e+05 2.072681e+06 6.754750e+05 2.411266e+06 8.694546e+05 7.331017e+05 1.002302e+06 8.042886e+06 2.403661e+06 8.221923e+05 4.850791e+05 6.117352e+05 6.413552e+05 4.619641e+05 1.551856e+06 1.000733e+06 5.642930e+05 1.010126e+06 6.530052e+05 2.995422e+05 1.583050e+06 4.606071e+05 4.432379e+05 2.773231e+06 8.546272e+05 3.966432e+05 7.924562e+05 1.400659e+06 4.517577e+05 1.186280e+06 1.080027e+06 6.708557e+05 9.818780e+05 2.079004e+06 1.637298e+06 1.240906e+06 6.559635e+05 9.718605e+05 6.312919e+05 5.585348e+05 3.657617e+05 7.121675e+05 7.290240e+05 8.761796e+05 8.059338e+05 1.072715e+06 5.379052e+05 4.007169e+05 5.486167e+05 4.331821e+05 5.338288e+05 3.719303e+05 5.574689e+05 6.965325e+05 8.088097e+05 3.382146e+06 2.055590e+06 5.607893e+05 3.042121e+05 4.801553e+05 6.615562e+05 1.090977e+06 3.512117e+05 1.155887e+06 4.577236e+05 5.070411e+05 5.081982e+05 3.447646e+05 5.338132e+06 4-ACETAMIDOBUTANOATE (Peak 2) 2.841390e+06 7.949601e+05 7.729817e+05 7.271320e+05 3.903821e+04 7.880395e+05 6.894499e+05 7.831819e+05 51817.15 7.752007e+05 8.325578e+05 8.074928e+05 59171.81 7.603373e+05 6.810130e+05 7.897938e+05 5.123488e+04 7.562014e+05 7.826971e+05 8.453591e+05 8.332919e+04 7.765364e+05 8.772324e+05 2.195287e+05 49564.803 8.622374e+05 9.367407e+05 8.728902e+05 6.299028e+04 7.934569e+05 1.009381e+06 1.758829e+05 70893.99 7.585820e+05 8.538012e+05 1.026671e+06 1.096868e+05 7.925604e+05 9.392034e+05 3.395066e+05 1.018812e+05 1.022488e+06 4.149467e+05 4.849618e+05 6.526750e+04 1.024063e+06 1.234321e+06 5.029453e+05 1.145553e+06 1.122940e+06 1.826789e+06 1.141631e+06 7.750037e+05 1.397627e+06 9.630501e+05 2.300634e+06 2.680350e+06 2.184450e+06 2.199478e+06 1.690709e+06 1.573251e+06 2.382375e+06 1.388781e+06 1.530866e+06 9.180799e+05 1.264159e+06 6.197228e+05 1.397431e+06 1.059048e+06 1.112515e+06 8.436323e+05 1.250842e+06 2.872308e+06 4.954278e+05 1.582488e+06 5.652015e+05 9.337987e+05 9.867916e+05 2.706439e+06 1.173034e+06 1.272352e+06 1.009303e+06 1.575691e+06 9.066747e+05 1.182243e+06 2.165409e+06 9.278943e+05 1.184391e+06 1.250708e+06 1.188591e+06 1.454725e+06 4.656452e+05 1.174216e+06 8.408181e+05 6.722387e+05 7.070589e+05 4.404742e+05 1.019192e+06 4.490678e+05 7.294424e+05 7.787327e+05 7.780037e+05 7.808023e+05 6.930960e+05 1.144949e+06 1.304926e+06 1.266955e+06 1.270707e+06 7.986345e+05 1.354053e+06 4.918484e+05 1.458567e+06 1.017634e+06 1.247189e+06 4.917079e+05 5.582078e+05 1.414529e+06 7.784478e+05 1.399570e+06 1.069540e+06 1.022923e+06 2.736165e+05 1.868894e+05 1.021654e+06 8.673611e+05 1.341708e+06 7.115684e+05 6.051268e+05 1.241497e+06 6.270180e+05 1.437157e+06 2.047303e+06 1.158172e+06 7.969825e+05 4.674899e+05 5.445180e+05 2.999160e+05 9.000002e+05 9.051092e+05 1.152870e+06 1.555172e+06 1.453514e+06 5.969418e+05 5.918616e+05 8.925331e+05 1.180469e+06 5.834392e+05 4.986522e+05 5.836090e+05 4.322134e+05 7.094153e+05 1.534750e+06 1.260964e+06 1.125484e+06 1.255035e+06 8.850009e+05 1.291710e+06 8.828199e+05 7.703883e+05 9.261283e+05 1.133529e+06 2.323572e+05 7.111856e+05 1.540243e+06 1.516011e+06 1.058423e+06 9.973841e+05 1.280042e+06 1.327758e+06 1.130738e+06 1.207227e+06 9.554466e+05 1.461636e+06 1.295605e+06 5.254662e+05 6.235196e+05 4.293433e+05 1.160148e+06 1.238401e+06 4.462163e+05 1.518368e+05 2.273576e+05 1.159891e+06 7.485693e+05 3.863813e+05 8.906678e+05 1.170362e+06 3.549534e+05 1.112371e+06 1.451043e+06 2.178175e+06 4.567801e+05 5.061194e+05 8.619580e+05 2.179216e+05 9.464449e+05 3.714855e+06 6.536090e+05 1.423904e+06 1.141332e+06 1.580313e+06 1.171077e+06 1.706830e+06 8.449550e+05 6.326434e+05 4.783097e+05 9.391087e+05 1.247114e+06 7.867602e+05 4.203694e+05 8.303078e+05 1.139582e+06 2.006977e+06 7.957098e+05 1.572077e+06 8.858306e+05 2.624915e+06 1.532455e+06 4.417756e+05 1.134871e+06 5.249148e+05 9.797760e+05 1.228759e+06 1.530524e+06 8.226471e+05 6.242622e+05 6.235228e+05 8.461536e+05 1.203793e+06 5.853033e+05 8.485462e+05 1.387625e+06 1.096415e+06 5.397322e+05 1.073858e+06 8.204259e+05 4.720200e+05 1.075091e+06 1.113455e+06 1.257609e+06 1.606868e+06 6.063969e+05 8.535765e+05 1.071731e+06 6.262319e+05 1.824850e+06 1.512487e+06 1.557211e+06 2.386678e+06 9.354682e+05 9.533510e+05 1.189609e+06 9.989912e+05 1.577735e+06 8.299373e+05 4.939312e+05 4.998327e+05 9.994062e+05 1.035759e+06 5.694830e+05 1.211491e+06 1.163947e+06 C10 H18 N2 O2_2.759 5.112079e+06 5.233480e+05 4.143100e+05 4.052168e+05 9.388467e+03 3.612081e+05 5.459008e+05 4.806396e+05 10654.88 3.240643e+05 5.288620e+05 4.440276e+05 11344.37 4.258818e+05 4.978240e+05 4.996371e+05 9.255411e+03 4.080129e+05 3.940515e+05 1.130762e+05 1.526528e+04 3.090839e+05 4.465211e+05 6.777892e+05 4171.327 3.816257e+05 4.003364e+05 4.462508e+05 7.489127e+03 4.265460e+05 4.321775e+05 4.421358e+05 10848.26 5.238944e+05 4.399815e+05 3.631512e+05 1.751603e+04 4.230668e+05 4.527761e+05 4.983071e+05 8.522776e+03 4.136226e+05 4.981695e+05 4.894994e+05 4.640108e+03 4.257661e+05 3.401779e+05 5.034138e+05 8.576949e+05 2.038605e+05 1.439441e+04 3.342263e+04 4.674159e+05 2.589074e+06 1.019468e+04 1.793591e+06 6.890041e+06 2.622612e+05 5.889849e+06 2.987272e+05 1.609888e+04 3.216121e+06 3.836660e+06 7.125177e+05 2.411266e+04 1.611786e+05 6.265122e+06 4.214836e+05 3.418917e+06 7.658140e+05 1.596258e+06 1.146430e+04 1.701003e+04 2.434667e+05 3.098023e+06 7.638274e+05 1.093430e+04 1.105792e+04 1.152158e+04 1.945269e+06 1.098267e+06 1.116082e+04 3.686924e+05 9.449469e+05 1.137090e+04 1.215164e+04 1.276220e+04 3.508759e+05 1.095072e+06 1.405406e+06 3.743755e+04 9.743780e+05 1.319826e+05 1.979500e+06 9.298225e+04 1.384109e+06 5.623457e+06 1.786744e+04 1.385548e+06 5.043542e+04 9.588241e+05 2.693132e+06 1.062697e+04 1.619218e+05 4.398668e+04 2.645441e+04 6.208837e+04 2.115469e+06 1.357115e+06 5.943190e+06 3.217368e+04 9.133461e+05 6.713679e+05 9.577925e+05 1.651621e+05 4.660900e+05 8.374707e+05 1.468125e+04 2.758906e+05 3.407160e+06 9.722731e+04 7.906197e+04 2.673792e+05 4.615512e+05 1.651875e+04 1.430508e+05 3.241906e+05 1.386421e+05 9.052152e+03 4.830212e+04 9.004722e+05 5.712604e+06 1.027476e+06 3.648658e+06 2.044849e+05 2.235069e+05 2.572963e+06 1.378105e+04 1.619256e+06 6.328412e+06 1.624609e+05 1.079513e+04 8.256039e+03 1.028000e+05 2.885964e+05 1.330631e+04 1.430191e+04 2.005665e+05 2.165017e+05 1.834776e+06 8.947607e+05 1.459620e+05 1.059638e+04 2.157476e+04 1.288145e+04 1.079045e+04 1.128820e+05 1.101722e+04 1.955751e+05 4.022709e+05 1.774174e+04 1.480963e+04 8.047477e+05 6.874595e+05 6.265176e+05 9.477189e+03 1.878804e+05 1.837700e+06 1.114629e+04 5.310747e+04 2.092814e+06 1.365810e+04 1.462876e+04 9.444094e+05 1.544608e+04 1.465044e+06 1.434981e+04 1.405894e+05 8.677963e+06 1.015265e+04 1.069710e+04 1.250073e+04 3.738720e+06 1.578401e+05 2.004580e+06 1.484177e+04 1.514695e+05 5.264063e+04 6.836426e+05 1.029339e+06 8.752647e+04 9.019491e+03 8.966171e+04 2.042668e+05 1.959850e+06 9.480036e+03 1.208185e+05 7.629841e+04 3.661209e+04 8.269217e+06 1.442486e+06 2.353147e+05 5.940039e+04 1.474606e+06 1.106640e+06 9.523288e+03 2.326807e+04 1.445661e+04 1.969974e+06 2.198335e+06 1.728550e+04 1.171758e+04 1.200111e+06 1.655221e+05 2.812606e+04 3.248191e+06 1.140430e+04 8.386688e+05 1.941394e+05 5.347992e+05 8.049403e+06 1.345789e+05 9.890092e+05 2.213023e+04 7.236813e+05 7.776735e+04 2.975175e+05 1.549759e+04 1.972168e+05 2.066447e+06 1.848498e+05 3.301525e+05 5.139391e+04 1.173020e+04 8.471878e+04 3.806277e+05 3.015934e+06 1.874334e+05 1.071063e+04 4.455197e+04 1.590903e+05 6.796845e+06 1.048355e+04 1.015225e+04 8.702236e+03 1.191380e+04 3.878925e+05 6.533381e+05 3.126023e+04 5.497600e+05 9.183839e+03 4.304896e+04 4.948827e+05 1.733173e+06 1.828251e+06 1.185535e+04 8.232283e+05 1.307285e+05 2.449315e+06 1.219906e+04 4.316660e+04 3.894137e+04 C4 H7 N O_2.759 1.353246e+07 1.921538e+07 2.070574e+07 1.838665e+07 5.854030e+04 1.811113e+07 1.968531e+07 2.106525e+07 87420.69 1.771261e+07 2.077290e+07 2.064961e+07 123393.47 1.904235e+07 1.818835e+07 1.963532e+07 8.260072e+04 1.896141e+07 1.952804e+07 1.952454e+07 1.032354e+05 1.727283e+07 2.049479e+07 2.032176e+07 183445.512 2.006869e+07 1.978740e+07 1.960909e+07 2.086367e+05 1.790064e+07 1.809733e+07 1.975017e+07 259578.80 1.862410e+07 2.306752e+07 1.916709e+07 3.905814e+05 1.775745e+07 1.956424e+07 2.178976e+07 3.769378e+05 1.606214e+07 1.752745e+07 2.393951e+07 8.050629e+04 1.524507e+07 2.304134e+07 1.762210e+07 1.314296e+06 4.283995e+06 5.495879e+06 1.580974e+06 2.297764e+06 6.096994e+06 3.100220e+06 4.438448e+06 1.042498e+07 7.707117e+06 8.548338e+06 4.480012e+06 3.761604e+06 3.088497e+06 4.318749e+06 4.443585e+06 4.139812e+06 2.082068e+06 2.995008e+06 3.697006e+06 3.536451e+06 2.830794e+06 4.782196e+06 6.703009e+06 6.290359e+06 2.587148e+06 4.071131e+06 3.006075e+06 3.326036e+06 4.901771e+06 3.778939e+07 3.617550e+06 5.574058e+06 2.576875e+06 2.661112e+06 4.743516e+06 3.804473e+06 2.429330e+06 2.006854e+06 3.664157e+06 2.944235e+06 3.214874e+06 2.616262e+06 1.538016e+06 5.368304e+06 2.573361e+06 4.063320e+06 4.021720e+06 3.186443e+06 2.570230e+06 2.631482e+06 3.828736e+06 3.586772e+06 2.370473e+06 2.457696e+06 2.180135e+06 3.196029e+06 2.550864e+06 2.560298e+06 3.011940e+06 2.266221e+06 4.425729e+06 2.898562e+06 5.604777e+06 2.553280e+06 3.717543e+06 4.193762e+06 4.005292e+06 1.031918e+07 2.397985e+06 8.542356e+06 3.604625e+06 2.553564e+06 2.386561e+06 1.837518e+06 2.704079e+06 2.192957e+06 2.622512e+06 5.209618e+06 1.268973e+06 5.556670e+06 2.502120e+06 3.837916e+06 2.322130e+07 3.001325e+06 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1.173080e+06 1.474278e+06 1.394605e+06 1.063786e+06 3.073777e+06 5.421041e+06 2.053719e+06 1.945336e+06 4.287303e+06 7.548867e+06 2.235619e+06 1.113266e+06 2.004176e+06 1.777795e+06 1.416657e+06 1.357297e+06 2.035724e+06 2.269178e+06 1.081082e+06 1.362530e+06 1.922696e+06 1.739252e+06 1.686089e+06 1.484843e+06 1.552978e+06 6.895383e+06 1.718685e+06 1.071607e+06 1.478171e+06 2.858353e+06 7.885125e+05 1.998636e+06 1.369834e+06 1.297991e+06 2.122428e+06 1.495059e+06 1.019792e+06 1.807855e+06 2.353078e+06 7.366858e+05 1.444723e+06 1.459072e+06 1.728459e+06 2.097890e+06 1.607978e+06 2.299293e+06 1.363707e+06 3.176232e+06 1.872500e+06 1.460897e+06 1.536958e+06 7.493002e+05 3.005723e+06 2.227934e+06 2.063227e+06 2.466400e+06 1.951863e+06 2.178542e+06 1.845284e+06 1.679783e+06 1.914827e+06 2.795585e+06 1.953569e+06 2.343820e+06 1.291066e+06 2.522093e+06 1.960597e+06 1.902051e+06 1.115259e+06 2.059374e+06 2.147689e+06 C8 H14 N3 O16 P3 S_2.764 3.846053e+04 9.068093e+05 8.382220e+05 9.605600e+05 2.034735e+04 1.085032e+06 9.221454e+05 1.327817e+06 40355.60 6.908983e+05 8.627050e+05 8.668688e+05 60612.27 7.814678e+05 9.681124e+05 1.114800e+06 4.696376e+04 8.271594e+05 8.468293e+05 9.676607e+05 6.170449e+04 1.288989e+06 1.024896e+06 5.647268e+05 28203.619 8.905278e+05 7.756882e+05 1.161258e+06 2.998018e+04 9.316829e+05 9.905135e+05 1.088998e+06 27017.15 1.001881e+06 5.992477e+05 9.934514e+05 3.974597e+04 9.010171e+05 1.041613e+06 1.119518e+06 2.714887e+04 7.737562e+05 1.023529e+06 9.611668e+05 1.499405e+04 8.210818e+05 1.018775e+06 8.843969e+05 7.357179e+05 6.118216e+05 2.873842e+05 3.314319e+05 2.582825e+05 2.396526e+05 4.133278e+05 1.741733e+05 3.154869e+05 3.819026e+05 2.467113e+05 8.870306e+05 1.836099e+05 3.803941e+05 4.550179e+05 3.139203e+05 3.613524e+05 3.013801e+05 3.122293e+05 2.956637e+05 1.464402e+05 3.471510e+05 2.274759e+05 3.121813e+05 2.556846e+05 2.925962e+05 3.512555e+05 1.949074e+05 2.386244e+05 3.223796e+05 5.646501e+04 2.866944e+05 2.485468e+05 2.783855e+05 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3.133936e+05 2.803907e+05 2.199170e+05 4.446465e+05 4.853948e+05 4.946404e+05 6.970933e+05 5.112991e+05 4.182050e+05 5.648271e+05 3.989808e+05 3.688380e+05 6.924809e+05 5.605764e+05 5.280881e+05 4.870935e+05 3.653068e+05 3.604386e+05 3.222245e+05 3.534839e+05 3.481936e+05 4.743994e+05 1.627351e+05 1.527111e+05 2.716696e+05 2.357797e+05 1.348791e+05 2.690928e+05 1.606051e+05 1.491761e+06 3.361813e+05 1.776639e+06 1.990112e+05 4.182775e+05 3.034956e+05 2.744762e+05 4.404625e+05 1.304651e+06 4.409938e+05 3.242729e+05 1.248375e+06 2.315789e+06 4.962645e+05 1.432371e+05 2.308783e+05 1.618657e+05 2.877545e+05 1.759654e+05 2.159181e+05 2.820566e+05 1.728157e+05 2.853220e+05 1.867355e+05 2.845625e+05 2.666027e+05 1.318344e+05 2.136069e+05 1.068135e+06 2.513581e+05 2.695170e+05 2.800168e+05 6.239425e+05 1.850599e+05 1.880987e+05 1.419186e+05 8.829906e+04 2.757939e+05 3.005386e+05 2.445589e+05 2.692371e+05 3.831223e+05 1.541236e+05 1.955356e+05 1.805038e+05 2.136599e+05 2.674283e+05 2.069527e+05 2.713734e+05 1.451221e+05 3.705639e+05 3.156525e+05 1.285082e+05 2.304733e+05 2.516643e+05 3.883177e+05 3.800647e+05 3.293814e+05 3.982930e+05 3.222866e+05 2.434556e+05 3.871214e+05 3.874563e+05 3.022300e+05 5.266804e+05 3.252801e+05 3.341668e+05 3.077856e+05 2.493804e+05 3.063434e+05 2.461298e+05 2.891792e+05 4.368636e+05 3.627268e+05 C20 H40 O12_2.764 2.319173e+05 2.435564e+05 2.324645e+05 2.509612e+05 9.043885e+04 1.869315e+05 1.967869e+05 3.124648e+05 107743.77 1.820771e+05 2.264624e+05 2.628572e+05 120926.66 2.278464e+05 2.417455e+05 2.028965e+05 9.924530e+04 2.170703e+05 2.184618e+05 2.037663e+05 1.434236e+05 2.401483e+05 2.468679e+05 3.039053e+05 82340.842 1.799804e+05 2.258014e+05 2.352767e+05 9.046181e+04 2.147373e+05 2.000242e+05 2.356797e+05 91128.93 2.864046e+05 1.759451e+05 4.068964e+05 1.411468e+05 2.636527e+05 2.303872e+05 2.831908e+05 1.033677e+05 1.851176e+05 1.756382e+05 1.993048e+05 4.841250e+04 1.992824e+05 2.562509e+05 2.409902e+05 1.690057e+05 1.210691e+05 1.497324e+05 1.298444e+05 1.676425e+05 1.807665e+05 4.797453e+05 1.514172e+05 2.661763e+05 1.321870e+05 2.212368e+05 1.089727e+05 1.405534e+05 1.921115e+05 1.658874e+05 1.557632e+05 1.468496e+05 1.304349e+05 2.091405e+05 1.728220e+05 1.672131e+05 1.740454e+05 1.475334e+05 1.052730e+05 1.793992e+06 1.215211e+05 2.721800e+05 1.665293e+05 1.136159e+05 8.545330e+05 1.143564e+05 2.050678e+05 1.187692e+05 1.171393e+05 1.538098e+05 1.557178e+05 1.254579e+05 1.139863e+05 4.267909e+05 2.220883e+05 1.532817e+05 1.598562e+05 1.407198e+05 1.117005e+05 1.476353e+05 1.299551e+05 1.925968e+06 1.519584e+05 2.247021e+05 1.464346e+05 1.664573e+05 1.179793e+05 1.613118e+05 2.070927e+05 1.393836e+05 1.599454e+05 1.409003e+05 1.835729e+05 1.580446e+05 2.005611e+05 1.807156e+05 2.277814e+05 1.457718e+05 1.596616e+05 1.673548e+05 1.710229e+05 9.894387e+04 1.245524e+05 2.683543e+07 2.411676e+05 1.620330e+05 2.190116e+05 1.399062e+05 1.602811e+05 1.494827e+05 1.657036e+05 1.563949e+05 1.630926e+05 1.235742e+05 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2.388125e+06 2.392124e+06 4.491393e+04 3.166925e+06 3.114946e+06 2.886005e+06 19921.625 2.202720e+06 2.906364e+06 2.687247e+06 2.729102e+04 2.197254e+06 2.331528e+06 2.814378e+06 25166.97 3.229103e+06 2.531991e+06 2.357725e+06 3.718911e+04 2.748761e+06 2.877654e+06 2.704321e+06 2.667402e+04 2.765131e+06 2.437568e+06 3.135232e+06 1.439894e+04 2.148613e+06 2.788643e+06 2.653236e+06 1.950439e+06 1.246011e+06 8.716354e+05 8.913275e+05 1.252668e+06 1.557085e+06 1.198064e+06 7.374260e+05 7.067030e+05 9.232756e+05 8.261884e+05 1.975154e+06 8.642017e+05 9.896419e+05 1.036114e+06 8.457407e+05 1.190317e+06 1.105800e+06 1.022911e+06 1.058390e+06 7.716765e+05 1.281512e+06 8.793962e+05 8.671210e+05 9.635660e+05 7.889233e+05 9.596018e+05 1.159694e+06 9.217230e+05 1.022159e+06 4.561911e+04 8.983493e+05 9.662668e+05 1.114230e+06 3.626180e+05 9.885110e+05 1.121649e+06 8.775610e+05 1.073560e+06 9.958916e+05 1.024850e+06 5.667944e+05 1.526720e+06 7.341764e+05 1.628266e+06 1.551196e+06 1.009759e+06 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9.248939e+05 1.097389e+06 9.117001e+05 1.269206e+06 1.029281e+06 9.857500e+05 6.878078e+05 1.234230e+06 9.209615e+05 8.251217e+05 8.952503e+05 1.115310e+06 1.100235e+06 C4 H3 N4 O7 P3_2.764 8.648588e+04 3.925066e+06 5.094708e+06 4.322342e+06 4.816143e+04 4.836512e+06 6.833860e+06 7.206696e+06 47875.95 3.729567e+06 4.970641e+06 5.345999e+06 50948.21 4.558344e+06 4.815402e+06 5.267593e+06 3.511933e+04 4.380180e+06 5.152360e+06 4.862339e+06 4.306605e+04 6.238686e+06 5.322945e+06 4.839889e+06 19373.292 4.430828e+06 5.728449e+06 5.365125e+06 2.499176e+04 4.480682e+06 4.763119e+06 4.676392e+06 22910.13 5.995539e+06 5.096249e+06 4.414098e+06 3.335068e+04 5.950441e+06 5.102061e+06 4.837902e+06 2.440310e+04 5.606847e+06 4.339153e+06 5.763069e+06 1.362694e+04 4.987686e+06 4.961243e+06 4.663297e+04 2.571153e+06 2.915966e+06 1.841393e+06 1.641814e+06 1.844463e+06 2.984957e+06 2.398115e+06 1.495977e+06 1.910342e+06 1.618482e+06 1.751411e+06 3.411293e+06 1.705177e+06 1.972604e+06 2.039865e+06 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1.612119e+06 3.278884e+06 2.270618e+06 2.302866e+06 1.864442e+06 2.273089e+06 1.476014e+06 2.073117e+06 1.550697e+06 2.016072e+06 2.488258e+06 2.976773e+06 3.094453e+06 1.936139e+06 1.876562e+06 1.934008e+06 2.085507e+06 2.761072e+06 1.749212e+06 1.942162e+06 1.822669e+06 1.476198e+06 2.988877e+06 3.230789e+06 2.566148e+06 3.561743e+06 2.658150e+06 2.609861e+06 2.823792e+06 2.957051e+06 2.755605e+06 3.301996e+06 3.200486e+06 3.612834e+06 3.103508e+06 2.036755e+06 2.188063e+06 1.845869e+06 2.182484e+06 1.323367e+06 1.223724e+06 7.815095e+05 1.284527e+06 1.579979e+06 9.661841e+05 9.966953e+05 1.669169e+06 1.350453e+06 5.090677e+06 1.113030e+06 5.731108e+06 1.005614e+06 1.330364e+06 1.297068e+06 1.190125e+06 2.947256e+06 5.344067e+06 2.059629e+06 1.960391e+06 4.441584e+06 7.281865e+06 2.203361e+06 1.117680e+06 1.842703e+06 1.617609e+06 1.432570e+06 1.406806e+06 1.932880e+06 2.213069e+06 1.057724e+06 1.379864e+06 1.820366e+06 1.599767e+06 1.721952e+06 1.575915e+06 1.558054e+06 6.730458e+06 1.751980e+06 1.005287e+06 2.032739e+06 2.888920e+06 1.487340e+06 2.006068e+06 1.338061e+06 1.254065e+06 2.137932e+06 1.247064e+06 1.007193e+06 2.044482e+06 2.621374e+06 8.924670e+05 1.467975e+06 1.603313e+06 1.569237e+06 2.121480e+06 1.621560e+06 2.571364e+06 1.617242e+06 3.196882e+06 1.836207e+06 1.305169e+06 1.647786e+06 1.912116e+06 2.967918e+06 2.176169e+06 1.968126e+06 2.449649e+06 1.980614e+06 2.101190e+06 1.812516e+06 1.616930e+06 1.958049e+06 2.848941e+06 1.934458e+06 1.775475e+06 1.296841e+06 2.537625e+06 1.857597e+06 1.986630e+06 1.101767e+06 2.457305e+06 2.103343e+06 C11 H3 N6 O7 P3 S2_2.764 1.369077e+05 2.431062e+07 2.416527e+07 2.326404e+07 6.749256e+04 2.159609e+07 2.767110e+07 3.518101e+07 89209.67 1.791104e+07 2.411428e+07 2.661510e+07 124750.65 1.938079e+07 2.411245e+07 2.671500e+07 7.615543e+04 2.283818e+07 2.448296e+07 2.288946e+07 9.732298e+04 2.537318e+07 2.567799e+07 2.266136e+07 40687.817 2.596896e+07 2.474259e+07 2.326316e+07 5.184258e+04 2.552881e+07 2.384729e+07 2.590758e+07 101320.57 2.584761e+07 2.345811e+07 2.385248e+07 8.384897e+04 2.227414e+07 2.644588e+07 2.454199e+07 5.886241e+04 2.427222e+07 2.472404e+07 2.849893e+07 2.940884e+04 1.906247e+07 2.687309e+07 2.354680e+07 1.819287e+07 1.310299e+07 8.049251e+06 9.512088e+06 1.027107e+07 1.136766e+07 1.099635e+07 8.699021e+06 8.821385e+06 9.837150e+06 6.935071e+06 1.650138e+07 8.353185e+06 9.440652e+06 1.077460e+07 9.008060e+06 1.094386e+07 1.023147e+07 1.007581e+07 9.979040e+06 7.445325e+06 1.026569e+07 1.032130e+07 8.742331e+06 9.102568e+06 8.128510e+06 7.229028e+06 9.294151e+06 8.137969e+06 9.669297e+06 1.598467e+05 7.665059e+06 8.682279e+06 9.455379e+06 5.694831e+06 1.097459e+07 9.749402e+06 7.864656e+06 9.351390e+06 8.027339e+06 7.535184e+06 4.694102e+06 1.237586e+07 7.794529e+06 1.216639e+07 1.359167e+07 9.786198e+06 1.068861e+07 1.114328e+07 9.464548e+06 1.255742e+07 1.329244e+07 9.658279e+06 1.073451e+07 9.897912e+06 1.377397e+07 9.405969e+06 9.523572e+06 8.482488e+06 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5.665096e+06 6.011560e+06 7.349079e+06 5.628786e+06 2.631577e+07 6.762780e+06 2.609657e+07 7.230979e+06 8.174505e+06 7.136247e+06 8.641173e+06 1.486996e+07 2.451675e+07 1.127271e+07 7.017806e+06 2.040616e+07 3.573923e+07 1.297269e+07 3.799680e+06 8.012945e+06 6.833106e+06 8.653164e+06 7.247296e+06 5.916467e+06 6.858095e+06 6.060407e+06 7.152500e+06 5.477105e+06 5.719271e+06 6.570548e+06 7.648864e+06 7.099007e+06 3.625985e+07 5.996694e+06 7.545738e+06 8.276734e+06 1.423544e+07 7.463692e+06 5.702427e+06 5.224289e+06 6.399811e+06 9.600985e+06 7.111667e+06 7.139285e+06 8.501266e+06 1.087883e+07 4.901966e+06 6.388929e+06 7.032001e+06 8.765761e+06 6.476874e+06 7.633735e+06 8.322850e+06 7.228178e+06 1.234204e+07 9.426392e+06 6.018769e+06 8.211638e+06 9.874271e+06 1.175189e+07 1.303847e+07 1.126748e+07 1.045582e+07 7.392207e+06 8.094098e+06 1.228383e+07 1.251394e+07 8.482249e+06 1.471578e+07 8.595741e+06 1.046590e+07 8.068556e+06 8.746526e+06 7.671612e+06 6.652088e+06 8.651967e+06 9.829640e+06 9.519227e+06 C22 H35 N7 O8_2.765 3.026650e+06 5.621276e+05 5.225806e+05 5.143196e+05 4.498226e+04 2.349315e+05 4.034337e+05 5.943210e+05 55194.29 4.015871e+05 5.435267e+05 5.529107e+05 58016.54 3.443015e+05 4.544601e+05 4.723803e+05 4.134539e+04 4.430736e+05 4.845078e+05 3.946158e+05 5.178048e+04 5.164285e+05 5.090870e+05 3.446648e+05 23323.384 5.333554e+05 4.955479e+05 3.569055e+05 2.432981e+04 5.630199e+05 4.271326e+05 5.223026e+05 23392.99 5.288943e+05 3.742189e+05 4.660387e+05 3.739012e+04 4.568220e+05 4.785152e+05 4.352689e+05 2.651713e+04 5.349388e+05 4.245390e+05 5.185580e+05 1.322301e+04 3.491943e+05 6.132992e+05 3.896208e+05 1.748023e+05 2.737498e+06 1.177136e+05 8.509671e+05 7.495622e+04 1.552183e+05 1.554544e+06 7.332834e+04 2.079761e+06 2.938462e+06 7.313454e+05 7.078411e+05 3.595544e+04 1.915814e+06 1.078658e+06 2.349477e+06 3.668351e+04 3.866573e+05 1.027259e+05 1.847794e+05 1.408041e+06 2.876910e+05 1.027907e+05 1.821575e+06 1.037736e+06 4.297354e+04 8.166412e+05 1.825196e+05 5.040888e+05 8.487589e+05 1.933674e+07 4.413145e+05 1.091402e+06 3.238757e+05 9.764082e+05 7.925192e+05 1.039935e+05 6.317136e+04 2.799056e+05 4.561608e+05 6.010587e+05 2.632646e+05 1.240889e+06 1.241977e+05 1.394082e+06 1.123876e+05 7.250024e+04 2.100790e+05 2.982351e+05 3.733383e+05 1.266539e+05 4.886878e+04 1.624492e+05 5.327378e+04 3.693638e+05 1.585225e+05 4.064735e+05 3.472984e+05 2.694264e+05 3.941219e+05 6.438644e+05 4.874829e+05 3.360480e+05 2.840050e+05 2.928071e+05 4.297867e+04 7.383261e+04 1.597554e+06 1.716993e+05 3.273651e+05 5.142492e+04 4.407050e+05 8.654378e+05 3.281727e+06 1.058335e+06 1.075512e+06 1.085833e+06 1.385464e+05 1.381388e+06 9.719274e+04 1.286002e+05 1.870524e+05 4.761096e+05 1.532773e+06 3.739014e+05 6.820556e+05 3.309830e+05 2.115916e+06 9.005966e+05 2.925638e+05 3.098385e+05 1.805408e+05 1.735908e+06 8.516393e+04 1.333506e+06 7.974514e+05 9.779218e+05 4.086616e+05 9.404577e+04 5.997721e+04 1.712350e+05 2.629452e+05 7.638809e+05 1.472621e+05 1.018991e+06 1.885180e+05 5.088596e+05 5.751499e+04 2.608067e+06 2.066609e+05 9.951660e+05 5.913411e+04 2.033893e+05 4.362779e+05 1.263159e+06 2.189786e+05 3.348418e+06 1.740967e+05 1.883710e+06 6.124952e+05 1.468398e+05 3.783396e+04 9.003754e+05 2.015284e+06 5.567016e+04 8.688659e+05 5.517706e+05 6.237445e+04 2.605222e+06 3.274069e+05 1.679455e+06 1.739984e+05 2.969566e+04 2.750124e+06 1.227909e+06 7.805142e+05 5.222371e+05 3.741579e+04 1.954916e+06 7.656466e+04 8.205643e+05 4.683908e+06 1.583831e+06 5.045608e+04 6.780771e+04 9.993331e+04 3.853217e+04 5.108148e+04 2.042281e+06 2.035628e+05 5.261174e+05 1.780139e+06 2.219475e+06 1.833327e+05 8.861355e+04 1.413270e+05 2.675058e+05 4.754658e+04 1.572599e+06 6.762988e+05 1.451974e+05 4.217515e+05 6.875491e+05 2.728867e+05 4.084920e+05 1.108551e+06 6.642133e+04 7.722793e+04 1.303580e+06 1.958063e+06 5.045386e+04 2.210364e+06 4.118383e+06 2.309986e+05 1.251906e+05 2.181243e+05 1.114706e+05 5.836736e+05 4.272956e+04 1.269383e+06 7.702919e+04 1.006011e+06 4.259103e+04 9.750764e+04 1.297640e+05 2.113668e+05 2.862197e+06 4.360367e+04 9.681113e+04 8.909130e+04 1.080644e+05 6.626248e+05 1.582880e+05 9.070448e+05 1.541053e+05 5.176380e+05 5.350075e+04 4.772060e+05 7.005395e+05 1.326602e+06 4.607576e+05 9.339977e+05 4.313745e+04 7.913264e+05 1.316171e+05 9.269394e+04 2.167956e+06 8.455995e+04 9.367150e+05 4.893396e+05 1.250435e+06 3.085421e+04 2.772289e+06 2.218149e+06 C6 H13 N O6_2.766 7.417961e+04 1.764362e+05 1.782207e+05 1.916977e+05 3.636464e+04 1.154254e+05 1.673826e+05 2.471433e+05 44465.63 1.153101e+05 1.819991e+05 1.651695e+05 45830.38 1.474351e+05 1.745433e+05 2.450219e+05 3.057273e+04 1.098183e+05 1.416756e+05 2.094240e+05 3.798063e+04 1.304295e+05 1.820250e+05 1.716403e+05 15748.033 1.503176e+05 2.020838e+05 1.955821e+05 2.250308e+04 1.601555e+05 1.438640e+05 1.791559e+05 27103.60 1.676360e+05 1.206601e+05 1.711521e+05 4.116273e+04 1.871843e+05 1.979654e+05 1.714931e+05 2.693227e+04 1.657028e+05 1.550698e+05 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5.254359e+05 2.881628e+04 3.907579e+06 1.248435e+06 1.790850e+06 1.536918e+06 6.260020e+04 2.511551e+06 1.352928e+05 8.766764e+05 7.535257e+06 1.776130e+06 5.348673e+04 8.287079e+04 2.445408e+05 2.008156e+05 5.989897e+04 2.621132e+06 5.072959e+05 7.878742e+05 1.941654e+06 2.013350e+06 3.672804e+05 1.376945e+05 2.332788e+05 7.599038e+05 4.049226e+04 4.084771e+06 6.159173e+05 2.706415e+05 8.131591e+05 1.096446e+06 3.977840e+05 4.648961e+05 1.879769e+06 1.352654e+05 6.650997e+04 1.636578e+06 2.758043e+06 9.558525e+04 4.111286e+06 4.260147e+06 4.744725e+05 1.686444e+05 3.891187e+05 3.250609e+05 8.740023e+05 4.493283e+04 2.579301e+06 2.094900e+05 1.928159e+06 1.021200e+05 8.274139e+04 3.180813e+05 4.521739e+05 3.206671e+06 6.672753e+04 1.144614e+05 2.560581e+05 5.250255e+04 1.412639e+06 3.481425e+05 2.029927e+06 5.843401e+05 7.365106e+05 4.554492e+04 1.103801e+06 1.492335e+06 1.767770e+06 7.386794e+05 2.274930e+06 5.095069e+04 1.369261e+06 3.336786e+05 1.110478e+05 3.536665e+06 1.701204e+05 1.523575e+06 7.340024e+05 1.667794e+06 4.881840e+04 4.057824e+06 3.475793e+06 C11 H11 N O3_2.768 5.616457e+06 5.833624e+05 5.886190e+05 5.293918e+05 4.272480e+04 5.021153e+05 5.797435e+05 7.387086e+05 47122.43 4.659040e+05 5.946772e+05 6.535514e+05 51256.24 5.157771e+05 5.250709e+05 6.192342e+05 3.990452e+04 4.882597e+05 6.027041e+05 5.896048e+05 5.863655e+04 5.386885e+05 5.580831e+05 5.951360e+05 39361.049 6.208528e+05 5.469707e+05 5.408485e+05 3.851586e+04 5.521498e+05 4.873477e+05 6.316988e+05 38143.55 7.169693e+05 5.224490e+05 5.276659e+05 6.051323e+04 4.703605e+05 6.832836e+05 5.541017e+05 4.094473e+04 5.722754e+05 5.437823e+05 6.885173e+05 1.939885e+04 4.388803e+05 6.382944e+05 5.414744e+05 4.430308e+05 1.448446e+06 6.776625e+05 7.739560e+05 4.054882e+05 1.138310e+06 1.997449e+06 6.512830e+05 7.483330e+05 1.183229e+06 1.899146e+06 4.908297e+05 1.234557e+06 1.240698e+06 8.173199e+05 7.932603e+05 5.542895e+05 2.696460e+05 7.013882e+05 6.736092e+05 7.384070e+05 1.037184e+06 4.695528e+05 6.910026e+05 8.555094e+05 2.385759e+05 1.264169e+06 4.413927e+05 1.216935e+06 9.248219e+05 3.784844e+06 6.205465e+05 6.994514e+05 5.374615e+05 8.089908e+05 3.796230e+05 6.845338e+05 7.695873e+05 6.152212e+05 9.989729e+05 1.166063e+06 8.255418e+05 5.404689e+05 2.796397e+05 8.233395e+05 5.174796e+05 5.808318e+05 3.257938e+05 3.305607e+05 7.152961e+05 1.509513e+05 9.589603e+05 5.974918e+05 6.766128e+05 7.773816e+05 3.906617e+05 8.809292e+05 6.009381e+05 5.843776e+05 8.441647e+05 1.380293e+06 9.616255e+05 3.065840e+05 1.084061e+06 1.350287e+06 3.558548e+05 1.569261e+05 6.293020e+05 8.936942e+05 2.879706e+05 1.016366e+06 9.544206e+05 3.687866e+05 2.480783e+05 3.522766e+05 7.424331e+05 5.267381e+05 4.292782e+05 5.780560e+05 8.211188e+05 7.739544e+05 9.788920e+05 1.507337e+06 2.205237e+06 5.366603e+05 9.005863e+05 1.070718e+06 4.258208e+05 6.475362e+05 8.714411e+05 8.127705e+05 8.027634e+05 8.188963e+05 2.990034e+05 2.818037e+05 4.799963e+05 2.641207e+05 5.686797e+05 2.206265e+05 4.249470e+05 2.759267e+05 2.735675e+05 4.844992e+05 6.294787e+05 6.916054e+05 9.675724e+05 5.600367e+05 3.777016e+05 7.427496e+05 3.745930e+05 5.997109e+05 9.482905e+05 5.072713e+05 6.314025e+05 9.020896e+05 8.181241e+05 1.000784e+06 7.672042e+05 9.176499e+05 7.233652e+05 5.520164e+05 9.486690e+05 1.756509e+06 1.085521e+06 1.231318e+06 1.268290e+06 1.252729e+06 2.836534e+05 1.497179e+06 6.222541e+05 7.064415e+05 2.650836e+05 8.068741e+04 9.437256e+05 1.518755e+06 3.035838e+05 4.157658e+05 3.187616e+05 1.882415e+06 5.064388e+05 8.353567e+05 8.155425e+05 1.289402e+06 2.039981e+05 3.551176e+05 6.757141e+05 6.038082e+04 5.394437e+05 1.886032e+06 4.869308e+05 6.108017e+05 1.136154e+06 1.373329e+06 3.211893e+05 1.426552e+06 3.992195e+05 4.715579e+05 3.222124e+05 2.518522e+05 7.788990e+05 1.105179e+06 2.924774e+05 4.056228e+05 1.093171e+06 1.586472e+06 4.446578e+05 6.403647e+05 1.329623e+06 5.912887e+05 1.817895e+06 1.001008e+05 1.040877e+06 8.271229e+05 5.156091e+05 6.215453e+05 1.247438e+06 6.132279e+05 7.745572e+05 4.988671e+05 3.067727e+05 1.240897e+06 4.947484e+05 5.721151e+05 6.906099e+05 5.512671e+05 3.899584e+05 4.815496e+05 3.207052e+05 6.399111e+05 8.348706e+05 5.871516e+05 8.121643e+05 1.961534e+06 5.595934e+05 1.937929e+05 1.970144e+06 2.888469e+05 8.077498e+04 1.488106e+06 1.162241e+06 1.669433e+06 5.026433e+05 2.474193e+05 6.263807e+05 4.603406e+05 1.264380e+06 6.571690e+05 5.592405e+05 7.837481e+05 8.109006e+05 1.380148e+06 9.053589e+04 1.394619e+06 3.079163e+06 C14 H6 N O14 P3_2.772 8.608193e+04 1.358638e+07 1.316191e+07 1.295403e+07 4.886335e+04 1.165226e+07 1.458539e+07 1.968082e+07 54473.37 9.577741e+06 1.277452e+07 1.451338e+07 63184.91 1.086096e+07 1.353918e+07 1.464218e+07 4.540175e+04 1.213820e+07 1.319516e+07 1.213463e+07 5.911436e+04 1.471488e+07 1.384319e+07 1.130826e+07 34237.289 1.500792e+07 1.356397e+07 1.264681e+07 2.988392e+04 1.456306e+07 1.208519e+07 1.388398e+07 87488.58 1.503069e+07 1.267860e+07 1.255719e+07 4.798546e+04 1.250071e+07 1.435562e+07 1.327784e+07 3.372002e+04 1.391627e+07 1.281572e+07 1.559585e+07 1.706195e+04 1.060471e+07 1.485755e+07 1.270092e+07 9.921490e+06 8.205667e+06 4.804516e+06 4.786248e+06 5.377544e+06 6.396972e+06 6.298460e+06 4.286779e+06 4.717692e+06 5.506963e+06 3.605839e+06 8.634413e+06 4.505631e+06 5.452741e+06 5.953789e+06 5.540680e+06 5.064109e+06 5.473304e+06 5.001655e+06 6.252327e+06 4.344932e+06 5.985718e+06 4.669637e+06 4.783611e+06 4.892117e+06 4.020758e+06 4.432140e+06 4.555908e+06 4.818774e+06 5.753814e+06 1.084165e+05 3.954595e+06 4.658548e+06 5.477861e+06 3.835633e+06 6.206728e+06 5.868401e+06 4.551096e+06 5.573963e+06 5.302732e+06 4.697557e+06 2.947587e+06 6.809353e+06 3.888937e+06 6.880681e+06 8.205803e+06 5.617683e+06 5.348945e+06 5.768690e+06 4.776683e+06 6.041715e+06 7.646925e+06 5.871338e+06 4.736262e+06 5.259787e+06 6.656952e+06 5.506975e+06 6.104939e+06 5.694225e+06 5.687217e+06 5.870188e+06 3.550126e+06 4.627499e+06 4.526787e+06 6.759446e+06 3.974974e+06 3.926554e+06 4.762911e+06 2.215452e+06 4.005056e+06 5.418486e+06 6.411919e+06 4.978459e+06 4.596774e+06 4.099782e+06 3.959577e+06 5.114155e+06 4.208056e+06 5.226699e+06 4.080835e+06 5.472727e+06 5.091066e+06 6.303024e+06 6.895173e+04 5.613748e+06 6.729895e+06 5.983074e+06 5.565064e+06 5.491020e+06 6.999416e+06 6.307045e+06 5.192116e+06 5.182739e+06 7.322425e+06 6.775291e+06 5.368395e+06 5.461924e+06 5.911055e+06 6.001324e+06 6.087637e+06 4.748630e+06 5.844176e+06 6.768339e+06 6.832237e+06 6.168469e+06 4.683914e+06 4.304505e+06 4.979759e+06 5.699362e+06 8.055828e+06 3.776311e+06 6.013359e+06 4.943938e+06 4.183698e+06 6.325040e+06 7.968465e+06 6.568447e+06 9.714734e+06 7.531655e+06 6.407134e+06 6.943275e+06 7.284154e+06 6.809623e+06 8.620581e+06 8.555419e+06 7.407628e+06 7.352336e+06 7.129103e+06 4.783937e+06 5.218533e+06 4.983008e+06 4.433278e+06 4.585585e+06 2.755844e+06 2.939843e+06 5.808546e+06 2.580598e+06 2.711941e+06 4.858109e+06 3.284772e+06 1.865505e+07 4.228257e+06 1.855549e+07 3.476734e+06 4.854290e+06 3.983003e+06 3.787668e+06 8.031461e+06 1.646549e+07 5.313909e+06 4.445205e+06 1.397022e+07 2.634391e+07 6.720581e+06 2.603774e+06 4.619743e+06 3.722297e+06 4.056874e+06 3.825135e+06 3.863200e+06 4.430678e+06 3.156243e+06 4.182600e+06 3.255956e+06 3.781714e+06 3.766571e+06 3.846236e+06 4.097224e+06 2.440346e+07 3.891114e+06 3.345053e+06 4.564431e+06 9.673668e+06 3.872370e+06 3.283708e+06 3.227397e+06 2.914114e+06 5.470589e+06 4.139076e+06 3.984164e+06 4.560798e+06 5.983986e+06 2.381078e+06 3.538648e+06 3.959811e+06 4.656697e+06 4.375067e+06 4.348475e+06 4.901724e+06 4.029022e+06 7.792893e+06 5.505471e+06 3.054446e+06 4.076066e+06 4.642773e+06 7.293924e+06 6.830662e+06 5.651156e+06 6.437384e+06 4.884454e+06 4.900440e+06 6.446929e+06 6.139630e+06 5.025059e+06 7.906617e+06 5.031279e+06 5.926325e+06 4.233152e+06 5.097509e+06 4.342721e+06 4.077544e+06 4.043946e+06 5.950235e+06 5.505797e+06 C11 H16 O6 S_2.773 2.764461e+06 3.745634e+05 4.103854e+05 5.349945e+05 7.014500e+04 4.365125e+05 4.977524e+05 5.968127e+05 51072.27 3.882782e+05 5.174216e+05 5.094986e+05 50346.96 4.166449e+05 5.088352e+05 4.804310e+05 3.674125e+04 3.191215e+05 5.184098e+05 4.428238e+05 5.076316e+04 5.140095e+05 5.500044e+05 6.010643e+05 35736.554 2.830095e+05 4.422373e+05 5.351800e+05 3.358521e+04 3.625372e+05 3.007177e+05 4.326315e+05 27485.96 8.989332e+05 3.718872e+05 3.047318e+05 3.730530e+04 5.118633e+05 4.542174e+05 5.449191e+04 3.506976e+04 5.343704e+05 4.664676e+05 4.472683e+04 1.769617e+04 4.424077e+05 4.804665e+05 5.384381e+04 4.448832e+05 3.954267e+05 7.759966e+04 1.294280e+05 3.877360e+05 9.095436e+05 7.586901e+04 6.468859e+05 1.868163e+06 2.919430e+05 1.596362e+06 3.370794e+05 2.222646e+05 9.170646e+05 9.297818e+05 6.270604e+05 4.494202e+04 1.600802e+05 1.285555e+06 3.633968e+05 1.314870e+06 9.841436e+05 5.765769e+05 1.167328e+05 4.733767e+04 2.475996e+05 1.729803e+06 4.704176e+05 5.145245e+04 1.180730e+05 5.401701e+04 9.067076e+05 4.429807e+05 9.292107e+04 4.578526e+05 6.206177e+05 5.345703e+04 3.870536e+04 8.656994e+04 4.893948e+05 9.389163e+05 1.249405e+06 9.436103e+04 3.384337e+05 2.913455e+05 1.074942e+06 4.186528e+05 4.171166e+05 1.173331e+06 8.047486e+04 3.631708e+05 1.040435e+05 6.332808e+05 7.403649e+05 1.000996e+05 1.599604e+05 1.951609e+05 1.378687e+05 1.887575e+05 1.245078e+06 1.207504e+06 1.722167e+06 6.566047e+04 1.655958e+06 8.489402e+05 3.371672e+05 1.554051e+05 6.367316e+05 6.928542e+05 4.748905e+04 3.274285e+05 1.566579e+06 2.302387e+05 4.909798e+04 4.932014e+05 4.828955e+05 8.446047e+04 4.490502e+05 4.606120e+05 1.025794e+05 1.147469e+05 7.036530e+04 6.268815e+05 1.854409e+06 5.752727e+05 1.311122e+06 3.080575e+05 3.098044e+05 1.048701e+06 9.327630e+04 1.085362e+06 2.337539e+06 3.084445e+05 5.195344e+04 4.324348e+04 2.716454e+05 2.661436e+05 4.524041e+04 4.515265e+04 2.439810e+05 2.321256e+05 9.712934e+05 5.832885e+05 3.217595e+05 1.205758e+05 1.261663e+05 4.208216e+04 1.051631e+05 2.381389e+05 1.392337e+05 3.741714e+05 4.656060e+05 5.048762e+04 9.118112e+04 6.861162e+05 6.034906e+05 5.498653e+05 4.438523e+04 3.215048e+05 7.116202e+05 5.565117e+04 1.485143e+05 7.667730e+05 4.363219e+04 6.919674e+04 8.811672e+05 5.129934e+04 4.052623e+05 4.625423e+04 2.710500e+05 2.137782e+06 3.732128e+04 3.358606e+04 5.971751e+04 1.888948e+06 1.719929e+05 6.831600e+05 4.056487e+04 2.755823e+05 8.121173e+04 6.278374e+05 6.638990e+05 2.229222e+05 4.491599e+04 4.388214e+05 3.262073e+05 4.228741e+04 4.747674e+04 2.713255e+05 2.043187e+05 1.729516e+05 2.262275e+06 1.148600e+06 2.942694e+05 2.386263e+05 7.688710e+05 9.528489e+05 7.074093e+04 1.591903e+05 6.507798e+04 1.226986e+06 7.817477e+05 7.578454e+04 4.896832e+04 1.034806e+06 2.778046e+05 1.002380e+05 1.370706e+06 4.977473e+04 7.026284e+05 2.915170e+05 6.665623e+05 2.269694e+06 1.976924e+05 9.632418e+05 8.027642e+04 5.579611e+05 2.307024e+05 6.682644e+05 5.143200e+04 4.143252e+05 1.201916e+06 2.536705e+05 4.078115e+05 1.438672e+05 6.229996e+04 4.165113e+05 3.669365e+05 1.654965e+06 3.113105e+05 6.596187e+04 1.267359e+05 2.095193e+05 1.437686e+06 5.901400e+04 6.245721e+04 4.638664e+04 8.201521e+04 3.893000e+05 4.376750e+05 1.923320e+05 2.721806e+05 3.543493e+04 1.671861e+05 5.857866e+05 8.179340e+05 7.661647e+05 4.348661e+04 7.855707e+05 1.273958e+05 1.104072e+06 5.883598e+04 1.210487e+05 1.473430e+05 C5 H11 N O2_2.774 6.230662e+08 2.672543e+08 2.581238e+08 2.360029e+08 7.250267e+04 2.466290e+08 2.695937e+08 2.924177e+08 113059.60 2.329510e+08 2.720688e+08 2.637517e+08 159076.21 2.283017e+08 2.337537e+08 3.106108e+08 3.265934e+05 2.207300e+08 2.955611e+08 2.562614e+08 2.293837e+05 2.319349e+08 2.406302e+08 3.200574e+08 111614.519 2.047348e+08 2.534880e+08 2.734829e+08 1.481631e+05 2.285765e+08 2.592240e+08 3.313666e+08 91643.39 2.346100e+08 2.044865e+08 3.005346e+08 1.330442e+05 2.444292e+08 2.032473e+08 3.525436e+08 8.937782e+04 1.745566e+08 2.393262e+08 3.384730e+08 1.825639e+05 2.684918e+08 1.882179e+08 2.758381e+08 3.867659e+08 1.588424e+08 2.990835e+07 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3.161471e+07 7.283127e+07 1.115258e+07 5.458242e+08 6.400609e+08 6.342327e+07 1.254081e+07 3.163401e+08 1.863582e+08 1.425708e+08 6.652003e+08 4.585578e+07 3.246316e+08 1.741731e+08 2.969114e+08 1.042170e+09 1.514645e+08 3.557007e+08 4.315301e+07 3.600823e+08 1.275770e+08 2.775664e+08 1.411872e+07 1.579308e+08 6.190167e+08 1.923218e+08 1.725657e+08 1.021011e+08 6.668673e+07 1.107479e+08 1.933838e+08 7.099246e+08 2.241254e+08 1.246313e+07 8.873924e+07 1.489096e+08 1.119257e+09 2.895869e+07 5.028320e+07 2.464397e+07 2.937363e+07 1.834925e+08 2.990807e+08 8.068944e+07 2.357144e+08 6.926437e+06 1.277184e+08 2.949291e+08 5.052595e+08 5.550325e+08 1.072692e+07 3.443920e+08 1.018841e+08 5.782280e+08 2.830429e+07 1.078787e+08 7.800271e+07 C16 H34 O9_2.775 1.222548e+06 2.641624e+06 2.716574e+06 2.361416e+06 1.658262e+05 1.926727e+06 2.412257e+06 2.987764e+06 321459.46 2.196167e+06 2.783754e+06 2.838236e+06 1687534.34 2.193954e+06 2.447303e+06 2.591475e+06 2.460071e+06 2.042873e+06 2.224301e+06 2.481170e+06 1.962898e+05 2.430648e+06 2.812069e+06 3.149783e+06 99943.618 2.058715e+06 2.349339e+06 2.193403e+06 3.303988e+05 2.269017e+06 2.583206e+06 2.838755e+06 291895.33 2.793521e+06 2.267923e+06 2.445391e+06 1.160186e+05 2.040228e+06 2.703335e+06 2.781677e+06 1.501734e+05 2.271679e+06 2.506021e+06 2.859842e+06 2.696724e+05 1.723222e+06 2.957614e+06 2.326556e+06 4.870407e+05 5.428686e+05 5.799244e+05 4.077807e+05 3.172381e+05 2.682091e+05 2.992782e+06 3.478278e+05 5.327859e+06 4.398398e+05 8.482970e+05 4.504216e+05 3.912749e+05 5.590823e+05 4.193525e+05 4.837316e+05 3.296478e+05 4.190506e+05 4.193663e+05 3.571032e+05 4.922063e+05 6.518200e+05 3.502116e+05 3.946851e+05 1.089715e+07 2.777728e+05 1.116259e+06 4.209037e+05 4.502439e+05 1.072636e+07 1.403597e+06 7.792969e+05 4.115868e+05 8.089277e+05 4.477922e+05 4.534703e+05 3.964156e+05 4.202795e+05 4.937566e+06 6.828996e+05 7.594896e+05 2.955966e+06 7.543218e+05 2.483979e+05 1.184001e+06 5.846459e+05 1.551000e+07 4.450954e+05 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7.689143e+05 4.836495e+05 2.907235e+05 4.476713e+05 3.257408e+05 5.092046e+05 3.786453e+05 3.106083e+05 4.393793e+05 8.722871e+05 6.154445e+05 4.408536e+05 2.828383e+05 5.607147e+05 7.841777e+05 1.719676e+06 5.615647e+05 1.073941e+06 4.142781e+05 6.674491e+05 6.523063e+05 5.078757e+05 5.056592e+05 2.980148e+06 4.537847e+05 8.670013e+05 9.734618e+05 1.089233e+07 1.606996e+06 6.283165e+05 5.149197e+05 3.617122e+05 2.520451e+05 3.991698e+05 1.506946e+06 9.094323e+05 5.274134e+05 7.104355e+05 6.398051e+05 3.938937e+05 9.283357e+05 2.805430e+05 4.650259e+05 2.445337e+06 6.534871e+05 2.450462e+05 6.149348e+05 1.361697e+06 2.591049e+05 7.881924e+05 8.207992e+05 5.045410e+05 7.304406e+05 1.628835e+06 9.959643e+05 1.042926e+06 4.901149e+05 5.705549e+05 4.308250e+05 4.053963e+05 2.596161e+05 8.859346e+05 5.949442e+05 9.340681e+05 6.479839e+05 1.236100e+06 4.352697e+05 3.253700e+05 4.287712e+05 2.389297e+05 5.073811e+05 2.489102e+05 3.730310e+05 6.115094e+05 9.939996e+05 7.777983e+06 1.370837e+06 3.076111e+05 3.276047e+05 2.951867e+05 4.946699e+05 8.292406e+05 2.579837e+05 1.205042e+06 3.093700e+05 4.791043e+05 1.888407e+05 3.492781e+05 2.768125e+06 C17 H33 N5 O5_2.776 1.087196e+06 2.408042e+06 2.376894e+06 2.119993e+06 4.873781e+04 1.622265e+06 2.130900e+06 2.628950e+06 215592.89 1.948980e+06 2.503796e+06 2.456831e+06 1555373.00 1.936924e+06 2.140551e+06 2.335887e+06 2.314623e+06 1.818358e+06 1.999373e+06 2.205169e+06 8.137947e+04 2.139657e+06 2.445612e+06 2.805135e+06 30033.961 1.818811e+06 2.051053e+06 1.940204e+06 2.648935e+05 1.998925e+06 2.297456e+06 2.518394e+06 230024.18 2.482223e+06 1.995154e+06 2.153417e+06 4.248032e+04 1.812103e+06 2.394286e+06 2.429457e+06 8.344315e+04 2.027414e+06 2.246154e+06 2.534295e+06 2.341747e+05 1.464071e+06 2.661221e+06 2.040350e+06 3.696880e+05 4.628441e+05 4.627723e+05 3.104059e+05 2.180969e+05 1.465537e+05 2.669981e+06 2.376074e+05 4.722131e+06 3.235257e+05 6.638132e+05 3.286655e+05 2.750200e+05 4.210410e+05 2.140935e+05 3.634656e+05 2.371285e+05 3.284307e+05 2.427446e+05 2.246652e+05 3.397738e+05 4.751416e+05 1.744440e+05 3.061885e+05 9.488364e+06 1.573551e+05 9.206103e+05 3.145545e+05 3.506004e+05 9.694496e+06 1.296453e+06 5.930602e+05 2.904287e+05 6.180801e+05 3.508112e+05 3.133464e+05 2.730525e+05 3.430491e+05 4.475921e+06 5.643790e+05 6.294207e+05 2.752002e+06 6.554677e+05 1.481251e+05 1.068463e+06 4.611460e+05 1.374650e+07 2.891445e+05 2.619583e+05 3.633173e+05 6.579398e+04 3.798121e+05 6.656497e+05 2.526156e+05 3.232600e+05 3.358660e+05 6.369568e+05 8.913252e+05 4.886056e+05 1.705794e+06 3.803151e+05 4.524888e+05 2.070966e+05 5.795549e+05 3.658322e+05 3.873388e+05 1.376295e+05 2.467265e+05 3.081564e+08 3.100285e+05 6.413940e+05 6.978525e+05 2.757361e+05 1.360213e+06 2.017506e+05 3.600705e+05 3.700038e+05 8.047199e+05 7.143134e+05 3.138231e+05 2.415997e+05 3.684394e+05 3.715492e+05 1.708621e+05 3.045274e+05 3.383324e+05 3.959465e+05 4.315686e+05 7.148248e+05 2.821680e+06 4.735849e+05 4.849330e+05 5.619311e+05 9.464050e+05 1.134087e+06 7.299347e+05 1.375676e+05 1.539144e+05 2.226975e+05 1.564386e+05 2.962765e+05 2.529512e+05 9.515542e+05 2.959947e+06 1.974558e+06 3.502205e+05 3.132681e+06 1.076393e+06 6.673773e+05 1.101653e+06 1.062815e+06 3.784333e+05 3.961945e+05 6.260601e+05 2.626692e+05 6.117700e+05 1.479485e+07 2.829946e+05 3.718405e+05 7.019493e+05 4.369241e+05 5.439734e+05 2.444363e+06 3.804805e+06 4.998417e+05 6.084506e+05 3.939468e+05 1.745984e+05 3.466654e+05 2.235009e+05 3.121294e+05 2.886944e+05 2.216664e+05 3.484204e+05 6.957609e+05 4.902766e+05 3.516162e+05 1.950059e+05 4.616249e+05 6.261611e+05 1.625047e+06 4.421245e+05 8.730785e+05 3.132137e+05 5.040832e+05 5.053006e+05 3.905833e+05 4.170011e+05 2.717631e+06 3.233108e+05 6.831559e+05 7.829660e+05 1.027931e+07 1.366100e+06 5.069292e+05 3.616406e+05 2.201118e+05 1.228442e+05 2.949106e+05 1.427439e+06 7.601224e+05 3.548020e+05 5.490229e+05 5.322695e+05 2.852353e+05 7.623343e+05 2.063612e+05 2.965168e+05 2.247104e+06 5.287468e+05 1.393495e+05 4.778441e+05 1.206160e+06 1.405820e+05 6.556515e+05 6.833016e+05 3.396116e+05 5.892603e+05 1.390440e+06 8.675106e+05 9.055462e+05 3.411134e+05 4.574407e+05 3.266127e+05 3.183780e+05 1.608544e+05 7.316034e+05 3.916243e+05 7.172273e+05 5.061747e+05 1.158912e+06 3.174571e+05 2.328615e+05 2.218951e+05 1.309342e+05 3.780093e+05 1.423208e+05 2.779539e+05 5.200851e+05 8.454020e+05 6.957877e+06 1.121049e+06 2.265363e+05 2.188175e+05 1.781951e+05 3.585807e+05 7.094275e+05 1.533170e+05 1.079414e+06 2.170157e+05 3.383879e+05 1.056648e+05 2.431173e+05 2.531941e+06 C14 H3 Cl N O16 P S_2.778 1.034097e+05 1.109177e+06 1.322720e+06 1.012897e+06 7.091303e+04 9.330082e+05 1.236116e+06 1.305496e+06 73926.74 9.153481e+05 1.134251e+06 1.225680e+06 70213.89 1.006080e+06 1.198085e+06 1.257111e+06 4.652498e+04 9.910442e+05 8.627203e+05 1.056320e+06 6.256672e+04 1.189603e+06 1.419743e+06 1.017515e+06 35093.902 1.110317e+06 1.152283e+06 1.147580e+06 3.186107e+04 1.053144e+06 1.155124e+06 1.111015e+06 32075.81 1.061032e+06 1.118231e+06 1.104065e+06 3.535793e+04 1.069217e+06 1.076820e+06 1.271826e+06 2.724873e+04 1.060157e+06 1.199432e+06 1.297120e+06 1.204043e+04 9.588450e+05 9.414909e+05 1.229125e+06 8.473612e+05 1.451214e+06 1.176945e+06 8.099989e+05 1.424286e+06 1.381185e+06 1.348811e+06 6.153728e+05 8.065251e+05 1.127102e+06 1.432126e+06 1.025491e+06 1.025982e+06 6.398062e+05 1.041331e+06 1.376483e+06 7.594944e+05 1.029946e+06 8.268288e+05 1.454976e+06 1.188872e+06 1.203918e+06 7.361833e+05 8.924588e+05 7.693070e+05 7.294032e+05 1.660218e+06 8.328546e+05 1.312039e+06 1.166583e+06 5.825154e+04 8.428595e+05 8.462067e+05 9.721011e+05 1.630018e+06 1.192470e+06 1.437565e+06 8.897221e+05 1.239076e+06 1.243718e+06 1.153804e+06 1.305247e+06 1.882466e+06 7.108301e+05 1.663225e+06 1.005205e+06 1.162958e+06 9.671351e+05 9.567237e+05 9.221391e+05 8.482494e+05 1.499478e+06 1.087261e+06 7.514674e+05 1.322389e+06 9.188565e+05 1.689629e+06 1.883433e+06 1.986034e+06 1.377816e+06 1.152528e+06 1.030558e+06 1.323737e+06 1.348053e+06 1.821379e+06 7.579986e+05 6.382055e+05 1.557216e+06 7.679263e+05 6.658653e+05 1.901301e+06 1.208985e+06 1.141123e+06 1.557793e+06 1.195116e+06 1.517911e+06 1.201573e+06 1.286424e+06 1.342755e+06 1.246145e+06 1.173767e+06 9.807736e+05 1.170940e+06 6.763940e+04 1.033652e+06 1.172588e+06 9.998774e+05 1.103641e+06 1.332105e+06 1.129021e+06 1.145682e+06 7.502958e+05 1.070873e+06 1.101515e+06 9.253959e+05 1.377960e+06 1.090841e+06 1.333258e+06 6.965762e+05 1.335566e+06 1.196799e+06 1.138946e+06 1.081077e+06 1.488898e+06 1.170120e+06 1.300129e+06 1.382198e+06 1.278336e+06 1.782527e+06 1.632827e+06 1.232748e+06 1.323236e+06 1.780446e+06 1.663500e+06 1.065701e+06 1.638407e+06 1.786615e+06 1.575365e+06 1.266880e+06 8.836640e+05 1.183715e+06 1.824078e+06 1.287462e+06 1.949615e+06 1.638454e+06 1.455012e+06 1.437994e+06 6.329745e+05 1.987762e+06 9.534788e+05 9.558236e+05 8.292507e+05 4.949714e+04 1.645272e+06 1.983534e+06 1.037065e+06 5.484430e+05 8.475384e+05 1.791332e+06 1.329423e+06 2.885118e+06 1.216135e+06 2.442663e+06 8.745584e+05 1.738783e+06 1.168334e+06 6.061161e+05 1.169747e+06 3.111953e+06 1.469786e+06 1.602823e+06 1.576095e+06 2.897070e+06 1.324442e+06 1.521470e+06 1.428876e+06 1.325472e+06 7.997345e+05 1.139282e+06 1.861400e+06 1.832082e+06 9.255672e+05 1.408100e+06 1.694516e+06 1.371944e+06 1.785826e+06 8.838043e+05 1.247364e+06 2.371015e+06 1.296218e+06 9.671944e+05 1.556809e+06 2.851243e+06 1.084104e+06 1.419611e+06 1.169032e+06 1.109321e+06 1.739327e+06 1.599755e+06 1.010397e+06 1.339606e+06 1.382214e+06 9.703485e+05 1.207624e+06 1.416597e+06 9.946192e+05 1.903147e+06 1.185742e+06 1.445070e+06 1.211026e+06 1.185136e+06 1.274691e+06 1.192241e+06 8.353918e+05 7.024819e+05 1.535932e+06 9.257875e+05 7.090147e+05 1.815365e+06 1.503639e+06 1.379599e+06 8.021797e+05 9.975645e+05 1.607855e+06 9.688905e+05 1.243767e+06 1.031017e+06 1.270242e+06 1.338111e+06 1.078632e+06 1.659844e+06 5.393714e+05 1.829218e+06 1.417003e+06 GLYCOCHOLATE (Peak 2) 3.834429e+06 6.645607e+05 4.884059e+05 4.727758e+05 9.493629e+04 3.866880e+05 5.056288e+05 6.037397e+05 94516.03 4.335398e+05 6.053439e+05 5.032780e+05 91484.89 4.359918e+05 6.448746e+05 4.510815e+05 6.610252e+04 4.487509e+05 5.215145e+05 4.757776e+05 8.820659e+04 5.409925e+05 5.385668e+05 5.633305e+05 53134.757 5.179399e+05 4.065896e+05 5.342201e+05 4.436154e+04 5.519524e+05 4.353698e+05 6.007670e+05 43553.12 5.869768e+05 4.719251e+05 4.962779e+05 5.695456e+04 3.968954e+05 5.516262e+05 5.755750e+05 5.032734e+04 5.218282e+05 4.941995e+05 4.844588e+05 2.404022e+04 5.256807e+05 5.653342e+05 4.703320e+05 7.788881e+04 9.234091e+05 2.547648e+05 2.234933e+05 3.046964e+05 5.341122e+05 5.167368e+05 1.266948e+06 4.907872e+06 7.615101e+06 6.247202e+05 1.066728e+06 7.459272e+04 6.771062e+05 1.507259e+05 9.716686e+05 1.088673e+06 7.039552e+04 5.721505e+05 1.149187e+05 1.818372e+06 1.426125e+06 1.227508e+05 1.270560e+06 2.417483e+05 9.737383e+04 1.307546e+06 1.369656e+06 4.341824e+05 2.386628e+05 2.362129e+06 3.295698e+05 7.235356e+05 1.440507e+05 4.623673e+06 1.302151e+05 7.938160e+04 4.018828e+05 5.467757e+05 2.072795e+06 5.865471e+05 4.905384e+05 2.357651e+05 1.101567e+05 2.628799e+06 2.507406e+05 7.021337e+05 1.959761e+05 9.242364e+04 5.778111e+05 1.098036e+05 2.107136e+05 2.372576e+05 1.868578e+05 1.306063e+06 2.339462e+05 9.601398e+04 5.877656e+05 1.643468e+06 7.481656e+05 2.895485e+05 1.907266e+05 6.677844e+05 9.745673e+06 5.766485e+05 1.271586e+05 7.252822e+04 3.738227e+05 3.922938e+05 1.651455e+05 6.898888e+05 5.440233e+05 2.411557e+05 1.289043e+05 2.662639e+05 2.547723e+06 1.514107e+06 1.069554e+06 4.167063e+06 1.043887e+05 5.972170e+05 3.321817e+05 1.230277e+05 1.605891e+06 1.240369e+06 8.618551e+05 2.646937e+05 1.131193e+06 5.283991e+05 2.180394e+05 4.010567e+05 1.695229e+05 2.826857e+05 2.963048e+05 2.480224e+05 8.094849e+05 2.991649e+06 3.904083e+05 1.211280e+06 6.531797e+05 1.208849e+06 1.827910e+05 1.026653e+06 1.647124e+06 1.533584e+06 1.352036e+05 3.767376e+05 1.395393e+05 5.066249e+06 2.295663e+06 2.237812e+05 6.041600e+06 1.215628e+05 4.486736e+05 1.240960e+06 1.045521e+06 4.099418e+05 9.977540e+04 1.406114e+05 8.818275e+04 1.898730e+05 3.644859e+05 3.553897e+05 1.240958e+06 6.684895e+05 2.718958e+05 9.227560e+05 9.629650e+04 1.294422e+06 1.446475e+06 2.365461e+05 6.953401e+04 3.362944e+04 1.067141e+06 6.850660e+06 9.062944e+04 1.081197e+05 6.346493e+04 1.387428e+06 9.224601e+05 1.567835e+05 3.195099e+05 9.060719e+05 1.348307e+05 1.286367e+05 5.051933e+05 4.339104e+04 3.308227e+05 6.332154e+05 8.573924e+04 8.474531e+05 5.317329e+05 1.628122e+06 1.467071e+05 6.067588e+05 4.631417e+05 1.459259e+05 9.702105e+04 7.823785e+04 1.257108e+05 1.600410e+05 5.671317e+05 1.087132e+05 2.487361e+05 3.726988e+05 8.079873e+05 7.491776e+04 7.273578e+05 3.137099e+05 1.515571e+05 8.007759e+04 9.943520e+04 1.843518e+06 1.167888e+05 4.903732e+05 2.572276e+05 2.645513e+05 2.157576e+05 4.697130e+05 9.287679e+05 8.500681e+04 2.207137e+06 5.310495e+05 7.203930e+05 6.532610e+05 7.469103e+04 3.135765e+05 1.336539e+05 5.982151e+05 8.734456e+05 6.315306e+05 1.090797e+06 1.389102e+05 2.939525e+05 1.332848e+05 3.588179e+05 9.029357e+04 4.724525e+05 6.628005e+05 1.546991e+05 5.323851e+05 1.571313e+05 5.988754e+04 8.045790e+04 1.446997e+05 7.979362e+05 3.828974e+05 4.147522e+05 1.124480e+05 5.452298e+06 4.092211e+05 8.814235e+04 1.057021e+05 4.798965e+06 712.83774_2.779 3.947491e+04 3.957266e+06 4.152316e+06 3.136084e+06 2.722640e+04 3.651561e+06 3.267414e+06 4.269466e+06 29579.04 4.312419e+06 4.176306e+06 3.499981e+06 33527.55 3.729614e+06 3.380037e+06 4.086442e+06 2.837806e+04 3.619364e+06 3.351661e+06 3.918006e+06 4.884188e+04 3.812360e+06 4.133542e+06 4.533526e+06 33153.386 2.962807e+06 3.568507e+06 3.883409e+06 3.272100e+04 3.668004e+06 4.128125e+06 3.873792e+06 36769.22 3.924666e+06 3.687570e+06 3.485751e+06 5.006583e+04 3.311889e+06 3.893046e+06 4.462197e+06 4.360494e+04 3.572239e+06 3.928917e+06 4.318545e+06 2.053487e+04 2.925248e+06 3.922412e+06 3.814068e+06 6.932596e+06 1.687958e+06 7.810118e+04 1.655230e+06 3.836910e+06 7.405234e+06 2.204059e+05 9.496365e+06 1.016707e+07 2.945643e+06 7.061630e+06 4.019709e+06 3.441151e+06 8.959419e+06 9.886553e+06 2.758927e+06 2.215486e+06 2.846463e+06 1.480295e+07 1.871046e+06 6.107926e+06 3.010342e+06 1.025089e+07 3.812255e+05 6.870971e+05 4.908465e+06 5.632453e+06 8.392528e+06 2.630979e+05 6.284066e+05 3.696851e+04 8.460613e+06 6.467165e+06 6.599252e+05 9.792097e+05 5.776691e+06 5.489205e+04 8.852034e+04 4.960000e+05 1.162732e+06 3.467391e+06 2.007017e+06 9.207128e+05 7.322453e+06 2.125318e+06 4.456018e+06 1.413046e+06 8.499950e+06 1.601748e+07 1.210753e+06 1.308053e+07 1.047301e+06 3.303980e+06 1.791349e+07 7.815949e+05 4.903740e+06 7.071828e+05 3.933698e+05 4.043421e+05 2.680376e+06 4.769781e+06 9.657876e+06 1.075158e+06 3.430341e+06 3.957804e+06 9.496643e+06 3.931915e+06 3.455531e+06 4.275646e+06 1.961694e+06 1.666239e+06 8.651562e+06 1.487139e+06 1.106982e+06 2.754166e+06 3.523575e+06 1.734782e+05 1.849061e+06 2.466483e+06 1.502399e+06 7.075501e+05 1.533927e+06 5.648035e+06 9.243617e+04 4.586072e+06 9.996878e+06 2.738218e+06 3.173211e+06 9.221238e+06 1.209937e+06 6.980563e+06 1.463869e+07 2.679563e+06 8.962305e+05 2.892752e+05 1.726030e+06 4.458925e+06 9.181255e+04 2.384100e+06 4.386827e+06 3.193083e+06 9.644861e+06 4.555924e+06 1.288928e+06 4.276675e+05 1.003457e+06 3.879223e+05 1.199086e+06 1.028025e+06 7.889354e+05 2.066529e+06 3.553648e+06 6.921806e+04 2.806247e+05 2.744728e+06 2.567993e+06 2.188124e+06 6.073550e+04 1.986015e+06 7.449849e+06 6.874720e+04 7.601468e+05 6.067216e+06 9.219159e+04 4.958770e+05 2.898048e+06 2.845499e+05 8.940532e+06 5.953006e+04 2.392363e+06 1.041165e+07 1.103276e+06 8.003920e+05 6.084151e+04 3.173097e+06 3.023101e+06 1.419918e+07 1.706386e+05 1.063859e+06 1.882371e+06 1.342287e+06 3.313984e+06 6.744479e+04 1.221320e+06 3.054212e+06 2.427767e+06 1.704319e+07 4.104859e+05 5.759067e+05 3.027797e+06 7.488094e+05 6.390585e+06 1.122522e+06 3.945237e+06 4.057419e+05 5.786400e+06 7.836780e+06 8.444520e+05 1.931826e+06 5.178863e+04 3.222996e+06 1.053801e+07 8.572944e+05 5.671021e+04 1.906727e+06 1.255667e+06 1.885058e+06 8.828035e+06 6.687821e+04 1.860430e+06 4.636834e+06 3.687104e+06 6.733020e+06 2.496544e+06 3.952438e+06 5.112053e+05 7.281973e+06 1.483336e+06 2.830237e+06 2.737016e+05 2.218140e+06 8.401753e+06 4.150435e+06 3.253704e+06 1.268930e+06 1.219642e+06 9.782586e+05 3.064481e+06 8.078828e+06 2.542491e+06 6.487544e+04 1.467605e+06 2.960556e+06 1.610833e+07 5.565959e+05 3.609106e+05 6.089433e+05 5.169804e+05 2.468815e+06 1.275904e+06 6.359165e+05 4.594645e+06 7.980039e+04 1.061633e+06 5.018298e+06 5.495617e+06 7.508564e+06 1.472327e+05 3.177426e+06 1.486353e+06 4.176616e+06 7.878681e+05 8.313775e+05 8.390017e+05 alpha-N-Phenylacetyl-L-glutamine_2.78 1.681846e+08 6.595534e+06 7.368966e+06 6.081095e+06 1.383595e+05 6.016124e+06 6.773454e+06 7.379688e+06 136179.42 6.026118e+06 7.535583e+06 6.636142e+06 131013.91 6.691595e+06 5.924408e+06 7.319851e+06 9.169575e+04 5.894085e+06 6.413173e+06 6.678458e+06 1.240263e+05 6.220404e+06 7.466774e+06 8.094471e+06 71539.276 5.642127e+06 6.468365e+06 6.769463e+06 6.708377e+04 5.394354e+06 7.028762e+06 7.349613e+06 67442.26 6.999518e+06 6.538514e+06 6.622953e+06 8.089552e+04 5.456511e+06 7.274691e+06 6.885495e+06 6.876477e+04 5.987042e+06 7.300118e+06 8.056129e+06 3.142931e+04 5.395562e+06 5.669675e+06 7.330807e+06 1.130331e+07 2.717746e+07 2.209845e+07 2.093730e+07 8.433425e+06 1.137728e+07 1.253324e+07 1.341053e+07 1.854969e+07 1.490385e+07 2.360228e+07 1.786056e+07 1.293300e+07 1.037075e+07 4.704322e+06 1.510545e+07 1.727198e+06 1.075622e+07 6.337634e+06 1.230468e+07 6.704768e+06 9.110227e+06 1.464543e+06 3.842289e+06 3.756368e+06 5.132728e+05 1.955032e+07 1.985845e+06 4.681446e+06 1.486958e+06 7.010110e+07 5.201348e+06 8.051461e+06 8.077249e+05 2.110610e+07 3.517609e+06 4.816889e+06 1.096509e+06 3.387358e+06 1.812403e+07 7.254647e+06 9.247884e+06 1.167094e+07 4.267736e+06 1.673758e+07 5.238105e+06 1.507379e+07 4.922952e+06 3.749083e+06 2.085609e+06 1.719466e+06 3.149062e+06 1.164389e+07 5.740460e+06 2.346827e+06 3.895985e+06 8.456899e+06 2.067073e+07 9.312739e+06 1.682342e+07 1.508778e+06 5.723678e+06 5.829717e+06 1.997541e+07 9.926899e+06 7.377973e+06 2.163385e+06 1.035920e+07 6.269484e+06 4.584090e+06 1.511107e+07 7.262301e+06 9.770507e+06 1.547019e+07 9.488092e+06 3.346562e+06 8.382561e+06 6.940009e+06 4.599941e+06 9.211619e+06 3.115193e+06 5.006899e+06 4.365907e+06 3.410602e+07 5.434876e+06 1.270914e+07 7.106538e+06 3.918228e+06 2.220430e+06 1.387652e+07 7.015428e+06 3.213575e+06 5.897302e+06 6.916243e+06 5.148685e+06 8.561623e+06 1.699795e+06 7.693841e+06 3.830124e+06 2.021354e+06 3.362715e+06 2.699201e+06 3.671840e+06 2.967286e+06 4.797707e+06 1.375742e+07 6.251978e+06 8.235554e+06 1.084045e+07 6.582198e+06 5.544550e+06 3.720118e+06 2.104808e+07 1.517411e+07 2.468131e+07 1.186981e+07 1.668454e+07 5.202723e+06 1.765149e+07 2.304975e+06 5.694268e+06 3.591433e+06 6.273139e+06 2.576661e+06 1.170099e+07 1.642451e+07 2.170276e+06 3.539935e+06 7.464166e+06 6.502967e+06 1.277177e+07 1.243973e+06 1.257496e+06 5.067694e+06 1.457701e+07 1.049779e+06 9.647248e+06 1.401632e+06 6.400499e+06 1.529010e+07 5.917837e+07 7.332511e+06 3.912253e+07 1.853098e+06 2.642939e+06 6.186267e+06 8.117328e+05 7.914233e+06 3.846261e+07 4.806536e+06 1.150646e+07 1.799246e+07 1.526262e+07 1.676852e+06 1.263775e+07 8.134452e+06 4.051485e+06 1.136406e+06 4.430870e+06 6.400447e+06 7.059368e+06 4.699036e+06 1.109544e+07 5.769763e+06 1.068151e+07 6.274215e+06 1.204397e+06 2.437244e+06 1.646093e+07 3.089679e+06 6.119825e+06 8.936405e+06 1.308506e+07 3.977090e+06 2.297581e+07 1.591813e+07 5.608017e+06 1.036734e+07 6.476676e+06 2.433482e+06 4.992849e+06 1.075577e+07 1.830526e+06 1.155738e+07 8.881277e+06 6.058305e+06 3.885193e+06 3.093940e+06 6.833172e+06 7.454509e+06 1.948883e+07 1.957997e+07 6.504495e+06 3.466688e+06 5.766700e+06 1.953230e+07 2.471667e+06 5.858460e+06 7.486488e+06 3.164529e+07 9.465112e+06 7.049231e+06 7.648954e+06 5.964286e+06 3.239677e+05 5.598451e+06 1.505111e+07 4.320840e+06 1.687781e+06 1.294761e+06 1.398309e+07 3.495455e+06 9.318702e+06 2.774383e+06 N-ACETYLALANINE (Peak 2) 1.033358e+07 2.352498e+06 2.406192e+06 1.906087e+06 8.930322e+04 2.258721e+06 2.217910e+06 2.783691e+06 88466.14 2.061327e+06 2.411691e+06 2.199401e+06 85729.85 2.199699e+06 2.115542e+06 2.510094e+06 5.727183e+04 2.237022e+06 2.035310e+06 2.423397e+06 7.938233e+04 1.816093e+06 2.564691e+06 2.931324e+06 54796.450 1.899557e+06 2.261329e+06 2.325945e+06 4.560120e+04 2.035212e+06 2.266039e+06 2.473185e+06 70889.97 2.161645e+06 2.058335e+06 2.559423e+06 6.617912e+04 2.101245e+06 2.500316e+06 1.658811e+06 7.374905e+04 2.364088e+06 2.865042e+06 1.320364e+05 2.742657e+04 2.000908e+06 2.296229e+06 7.365211e+04 2.882501e+06 3.178482e+06 5.985617e+06 4.100260e+06 2.578925e+06 3.116519e+06 3.602827e+06 1.481334e+06 3.863583e+06 4.838554e+06 5.891811e+06 2.586052e+06 4.179079e+06 3.411697e+06 3.452017e+06 3.944428e+06 2.134365e+06 2.607876e+06 1.444094e+06 2.801617e+06 2.463918e+06 2.705900e+06 9.014567e+05 3.421374e+06 5.805960e+06 5.771415e+05 2.675838e+06 8.379269e+05 3.909000e+06 2.340988e+06 1.152303e+07 1.639970e+06 1.714327e+06 2.423235e+06 2.487388e+06 2.605181e+06 3.045171e+06 3.413633e+06 2.998794e+06 2.144299e+06 3.831628e+06 3.794008e+06 3.117626e+06 7.300100e+05 4.090989e+06 2.381339e+06 2.986312e+06 1.162801e+06 2.218995e+06 1.871974e+06 7.769048e+05 2.817164e+06 2.246025e+06 7.266205e+05 1.298327e+06 1.063386e+06 4.867354e+06 3.393477e+06 2.994693e+06 2.476414e+06 3.977582e+06 2.245501e+06 2.048509e+06 4.253872e+06 2.737055e+06 1.606655e+06 9.163965e+05 3.444120e+06 2.585584e+06 9.724607e+05 5.264752e+06 3.146351e+06 2.114711e+06 2.556550e+06 1.906263e+06 1.979726e+06 2.288714e+06 2.184125e+06 2.910320e+06 3.996506e+06 1.864046e+06 2.444914e+06 1.998069e+06 9.178170e+06 1.637568e+06 2.805899e+06 1.248236e+06 1.441078e+06 2.464618e+06 1.695345e+06 2.123749e+06 1.590751e+06 2.112058e+06 2.273749e+06 1.262816e+06 1.912595e+06 1.863379e+06 3.282241e+06 1.057933e+06 2.405889e+06 2.237461e+06 1.685608e+06 2.039917e+06 4.011551e+06 3.845387e+06 2.624070e+06 2.308458e+06 2.690479e+06 6.575521e+06 5.512260e+06 1.848671e+06 2.210750e+06 4.691942e+06 4.785853e+06 3.515790e+06 2.585754e+06 4.450381e+06 4.111832e+06 3.457336e+06 3.120771e+06 3.120477e+06 4.029467e+06 2.804035e+06 3.181777e+06 2.708470e+06 4.320779e+06 3.319516e+06 9.747592e+05 4.900195e+06 2.092156e+06 2.598279e+06 8.526776e+05 3.702874e+04 2.336011e+06 2.108550e+06 9.736604e+05 8.060710e+05 1.501316e+06 5.342269e+06 4.060273e+06 6.192161e+06 3.048432e+06 3.162605e+06 9.367331e+05 1.940218e+06 2.064687e+06 5.009349e+04 2.463118e+06 4.982246e+06 1.183562e+06 2.264582e+06 5.438633e+06 4.694338e+06 2.720776e+06 3.444354e+06 3.698572e+06 1.440857e+06 8.910802e+05 1.532556e+06 3.862542e+06 2.400839e+06 1.124408e+06 3.105738e+06 4.428045e+06 2.925568e+06 2.411637e+06 3.056565e+06 2.201875e+06 1.946936e+06 4.704500e+06 7.096471e+05 2.471242e+06 3.733085e+06 1.826949e+06 3.773223e+06 4.371726e+06 1.372751e+06 2.391831e+06 5.875921e+06 1.956443e+06 2.467253e+06 2.270915e+06 1.735301e+06 2.583816e+06 3.182207e+06 2.133456e+06 5.491743e+06 2.727354e+06 2.775781e+06 4.342221e+06 4.175179e+06 3.529410e+06 2.643701e+06 9.204573e+05 1.661187e+06 4.423255e+06 9.817200e+05 2.564728e+06 4.221038e+06 3.999183e+06 2.619331e+06 1.887036e+06 1.918763e+06 2.744547e+06 1.758116e+06 6.991380e+06 2.652896e+06 1.553283e+06 2.287078e+06 4.063317e+06 2.992535e+06 7.568480e+05 3.263114e+06 4.121600e+06 C33 H5 N8 O15 P3 S_2.781 7.037536e+04 1.061596e+06 1.176550e+06 7.884894e+05 4.689417e+04 1.153564e+06 1.182919e+06 1.300489e+06 44589.08 1.055740e+06 1.091789e+06 1.018624e+06 43792.43 1.106606e+06 8.391316e+05 1.356888e+06 2.908534e+04 1.052423e+06 1.035054e+06 1.077984e+06 4.201789e+04 1.025609e+06 1.108793e+06 1.360303e+06 25155.503 9.029523e+05 1.183149e+06 1.130652e+06 2.433172e+04 9.031472e+05 1.062236e+06 1.055720e+06 25551.82 1.235013e+06 1.028387e+06 1.135831e+06 3.050836e+04 9.342271e+05 1.179409e+06 1.237111e+06 2.539140e+04 9.432684e+05 1.066051e+06 1.246178e+06 1.105365e+04 9.818675e+05 1.080154e+06 1.090494e+06 1.934275e+06 4.070111e+06 2.506471e+06 3.265538e+06 1.361826e+06 1.972632e+06 1.906510e+06 2.041751e+06 2.851416e+06 2.106910e+06 3.911915e+06 2.814067e+06 2.355772e+06 1.254633e+06 7.210222e+05 1.936055e+06 2.004811e+05 1.691602e+06 1.101619e+06 1.924347e+06 8.717230e+05 1.244197e+06 5.410314e+04 6.809083e+05 5.170559e+05 1.516804e+05 3.784536e+06 2.942438e+05 5.824136e+05 1.471589e+05 4.100440e+04 7.603010e+05 1.388540e+06 9.286073e+04 2.001564e+06 4.347080e+05 6.375650e+05 1.634311e+05 4.319145e+05 1.848991e+06 1.104812e+06 9.021894e+05 2.027034e+06 5.884552e+05 2.641914e+06 5.787882e+05 2.196161e+06 7.752142e+05 6.032884e+05 3.202163e+05 2.192516e+05 4.138334e+05 1.631214e+06 1.300833e+06 4.019140e+05 6.939188e+05 1.064692e+06 3.176224e+06 1.029881e+06 1.510381e+06 1.387286e+05 7.914458e+05 1.056508e+06 1.830439e+06 1.538335e+06 1.212706e+06 3.036913e+05 1.559329e+06 8.151778e+05 8.829459e+05 2.229867e+06 9.837494e+05 1.786219e+06 2.229433e+06 1.398528e+06 5.570284e+05 1.154834e+06 1.224140e+06 7.679318e+05 1.307470e+06 4.138552e+05 6.922412e+05 8.009254e+05 5.779690e+04 8.909117e+05 2.000048e+06 1.181084e+06 5.073707e+05 2.501211e+05 3.211266e+06 1.149348e+06 4.206628e+05 1.015491e+06 1.173733e+06 8.605071e+05 1.280639e+06 2.078389e+05 1.383717e+06 7.170468e+05 3.660703e+05 5.491543e+05 4.148757e+05 4.816349e+05 4.382067e+05 7.507924e+05 2.256145e+06 1.066111e+06 1.356743e+06 8.796876e+05 1.028299e+06 8.315049e+05 5.945919e+05 2.989216e+06 2.796280e+06 3.478738e+06 1.613283e+06 2.059510e+06 8.535724e+05 2.491237e+06 3.055814e+05 7.389599e+05 4.566063e+05 9.380804e+05 3.321000e+05 1.608501e+06 2.073814e+06 2.667247e+05 5.452917e+05 8.879230e+05 1.008096e+06 1.860340e+06 2.020307e+05 1.941838e+05 5.740125e+05 1.213652e+06 1.091872e+05 1.736112e+06 2.103082e+05 9.629711e+05 2.175353e+06 6.782551e+06 1.048718e+06 2.474826e+06 2.518202e+05 4.041635e+05 1.224522e+06 2.163886e+04 1.313448e+06 2.829584e+06 7.864320e+05 1.604149e+06 1.855471e+06 1.184304e+06 2.109354e+05 1.114146e+06 1.315802e+06 6.647267e+05 1.274154e+05 7.496212e+05 1.010657e+06 7.857470e+05 5.458757e+05 1.873445e+06 6.184161e+05 1.032825e+06 1.013567e+06 1.680989e+05 3.541936e+05 1.462605e+06 3.049221e+05 1.016394e+06 1.465951e+06 1.655737e+06 6.415704e+05 3.268849e+06 2.164291e+06 8.470370e+05 1.515869e+06 9.925641e+05 3.035623e+05 8.055662e+05 1.836432e+06 2.846816e+05 1.726514e+06 1.538788e+06 9.053001e+05 4.815300e+05 5.702421e+05 9.747217e+05 1.152045e+06 2.782667e+06 3.572537e+06 1.130426e+06 5.046468e+05 8.919165e+05 2.776054e+06 3.265600e+05 9.386817e+05 1.058808e+06 3.477244e+06 1.263766e+06 9.369138e+05 1.294053e+06 9.820766e+05 1.027691e+05 8.672294e+05 2.324571e+06 5.716556e+05 1.939314e+05 1.380225e+05 1.830688e+06 6.371067e+05 1.389066e+06 3.275279e+05 328.90283_2.783 1.755071e+05 3.631444e+05 1.529957e+05 4.260860e+05 1.017032e+05 3.619566e+05 4.720622e+05 4.866438e+05 64482.13 2.153004e+05 5.353439e+05 3.335430e+05 56383.23 2.923874e+05 3.547117e+05 4.431668e+05 3.534718e+04 2.509503e+05 3.998378e+05 3.284897e+05 4.722422e+04 4.956257e+05 2.639025e+05 5.017686e+05 27823.169 2.733756e+05 4.766603e+05 4.180166e+05 2.528389e+04 1.524263e+05 4.552125e+05 2.093534e+05 22749.18 5.202053e+05 3.330355e+05 3.438248e+05 2.468483e+04 4.587051e+05 3.481685e+05 3.898846e+05 2.240825e+04 3.898578e+05 2.877216e+05 4.487935e+05 1.139065e+04 3.500413e+05 3.152378e+05 4.074246e+05 2.947481e+05 4.556742e+05 3.859881e+05 1.845107e+05 3.639313e+05 5.344356e+05 6.451649e+05 1.268133e+05 2.681430e+05 3.905027e+05 5.206344e+05 3.830621e+05 2.917419e+05 2.765166e+05 3.126594e+05 4.603265e+05 1.112777e+05 3.576506e+05 3.085653e+05 5.043736e+05 4.225459e+05 5.300385e+05 1.374636e+05 3.230803e+05 2.805929e+05 7.242073e+04 7.565682e+05 2.298439e+05 4.853487e+05 3.448897e+05 5.085263e+04 3.371717e+05 6.813851e+04 3.080767e+05 4.328201e+05 2.106639e+05 5.261451e+05 3.774198e+05 4.702277e+05 4.983977e+05 6.355956e+05 5.417555e+05 4.922745e+05 6.088824e+04 5.641479e+05 2.794174e+05 3.806311e+05 1.610043e+05 3.873638e+05 3.813984e+05 2.220856e+05 4.356047e+05 4.952471e+05 8.979122e+04 3.595208e+05 2.680179e+05 5.751659e+05 7.932325e+05 6.131898e+05 5.990099e+05 3.579727e+05 5.810639e+05 3.556897e+05 5.335675e+05 6.591936e+05 2.077036e+05 2.094395e+05 6.488691e+05 6.020756e+05 1.890860e+05 7.923854e+05 3.702365e+05 3.320126e+05 4.885536e+05 5.561678e+05 4.612428e+05 5.003999e+05 5.365587e+05 5.038616e+05 4.930753e+05 4.128119e+05 2.997883e+05 3.544372e+05 4.693816e+04 3.690175e+05 5.035668e+05 3.338730e+05 3.353204e+05 4.509527e+05 2.841831e+05 3.767834e+05 4.495069e+05 3.455320e+05 3.957605e+05 3.099556e+05 4.299309e+05 2.967350e+05 3.661702e+05 1.849992e+05 3.457928e+05 3.349840e+05 2.449383e+05 2.693399e+05 5.790622e+05 5.099535e+05 4.272354e+05 5.449682e+05 5.194109e+05 5.438141e+05 6.485741e+05 4.657829e+05 3.342692e+05 6.003318e+05 5.001083e+05 4.746319e+05 5.338475e+05 7.115721e+05 4.837534e+05 3.721533e+05 4.537866e+05 4.935985e+05 6.769440e+05 2.893290e+05 5.411171e+05 5.763977e+05 7.959976e+05 3.985318e+05 2.802639e+05 7.562870e+05 3.795592e+05 2.557599e+05 5.461910e+04 1.211810e+04 7.980569e+05 9.619831e+05 2.995423e+05 2.224561e+05 2.166931e+05 4.741081e+05 5.536468e+05 9.625938e+05 3.524360e+05 1.111080e+06 2.661112e+05 5.152649e+05 4.391422e+05 4.612723e+04 3.113753e+05 1.266108e+06 4.007367e+05 5.234113e+05 6.315458e+05 1.091827e+06 5.383017e+05 6.171740e+05 5.266636e+05 1.981385e+05 1.574689e+05 3.243416e+05 2.312655e+05 7.538255e+05 2.506330e+05 4.207780e+05 8.858272e+05 6.522995e+05 6.215726e+05 2.584956e+05 4.762568e+05 8.605776e+05 6.250826e+05 1.954353e+05 6.900493e+05 8.259412e+05 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2.817384e+06 9.919810e+05 7.067061e+05 2.683631e+05 2.319144e+05 7.738092e+05 6.907389e+05 2.337693e+05 7.179241e+05 2.202482e+05 6.835788e+05 6.588953e+05 3.706902e+06 5.056611e+06 4.642940e+05 6.459722e+05 8.480527e+04 7.428924e+05 5.150986e+06 6.298411e+04 4.614192e+05 5.340324e+06 3.605854e+05 5.603875e+05 1.095011e+05 6.090736e+05 6.626559e+05 6.361485e+05 7.525553e+05 7.059376e+05 9.552854e+05 3.178447e+06 6.787851e+05 2.813797e+05 1.031817e+06 8.945880e+05 6.574091e+05 2.420911e+06 4.077609e+06 1.129780e+06 7.344803e+05 4.924705e+05 8.239303e+05 8.302194e+05 4.624245e+06 2.074877e+06 8.584865e+05 9.792481e+05 2.962891e+05 5.195269e+05 1.361429e+06 1.145735e+06 6.411005e+05 5.528632e+05 1.183888e+06 7.334839e+05 1.231112e+06 5.830348e+05 9.410769e+05 8.637194e+05 9.662948e+05 9.344961e+05 8.865825e+05 2.605263e+06 8.561067e+05 5.220451e+05 6.731265e+05 3.395246e+05 4.323485e+05 3.579384e+05 5.188145e+05 6.372629e+05 7.568674e+05 4.919913e+05 4.007478e+06 1.141955e+06 5.826689e+05 9.028206e+05 8.277520e+05 8.720441e+05 1.340339e+06 6.962974e+05 8.189226e+05 6.493653e+05 1.148961e+06 2.391003e+05 1.177908e+06 2.892642e+05 6.241973e+05 5.575605e+05 4.407448e+04 9.357573e+05 9.072376e+04 C19 H37 N5 O6_2.79 1.114305e+06 4.176788e+05 5.634455e+05 4.264733e+05 9.580826e+04 4.087016e+05 5.539846e+05 5.005438e+05 194925.57 4.124097e+05 5.135439e+05 5.607288e+05 1193864.05 4.199558e+05 4.615835e+05 5.063452e+05 2.160652e+06 3.912866e+05 3.782898e+05 6.224562e+05 5.650412e+04 3.832377e+05 4.446599e+05 5.975815e+05 29595.900 4.468542e+05 4.976670e+05 3.850979e+05 7.414810e+04 4.392619e+05 5.570390e+05 4.542380e+05 62950.02 4.665687e+05 4.472164e+05 5.372332e+05 3.061816e+04 3.729905e+05 5.984764e+05 3.988163e+05 6.480426e+04 3.924221e+05 5.704040e+05 5.158591e+05 1.100092e+04 4.719295e+05 3.684135e+05 5.202872e+05 7.421773e+04 1.200489e+05 1.962287e+05 5.418988e+04 8.343750e+04 1.119105e+05 1.362945e+06 2.319606e+04 1.036322e+06 9.873257e+04 1.848861e+05 6.487904e+04 4.235865e+04 6.640746e+04 1.627405e+05 1.140460e+05 2.424535e+04 2.653420e+04 1.572658e+05 4.826138e+04 1.388722e+05 1.302411e+05 6.669372e+04 6.553974e+04 2.609891e+06 6.158544e+04 2.640294e+05 4.433601e+04 8.095481e+04 2.488101e+06 1.278268e+06 1.709112e+05 1.011775e+05 1.139700e+05 8.865189e+04 1.023555e+05 4.832449e+04 8.255894e+04 1.201995e+06 2.528409e+05 1.289466e+05 8.354004e+05 1.442507e+05 6.097310e+04 2.851760e+05 1.468507e+05 3.753661e+06 9.941610e+04 6.026527e+04 3.824571e+04 4.674055e+04 6.101340e+04 3.279278e+05 5.972401e+04 7.760103e+04 7.062669e+04 2.044587e+05 2.597328e+05 2.922067e+05 8.426746e+05 7.257809e+04 1.545391e+05 3.557739e+04 2.742345e+05 8.185549e+04 4.633979e+04 3.766734e+04 1.369085e+05 9.838394e+07 4.206109e+04 1.916001e+05 2.093685e+05 5.586935e+04 3.898505e+05 4.247739e+04 1.192988e+05 7.770817e+04 2.302220e+05 1.201016e+05 7.587557e+04 6.742649e+04 7.911915e+04 5.110830e+04 4.942428e+04 1.297684e+05 7.092423e+04 5.535382e+04 6.000670e+04 1.839957e+05 6.128754e+05 8.025887e+04 1.068672e+05 1.004658e+05 1.653775e+05 2.537436e+05 1.939202e+05 6.828794e+04 3.238982e+04 1.559063e+04 2.718962e+04 6.132990e+04 4.895399e+04 1.208985e+05 1.281001e+06 8.608428e+05 5.794729e+04 7.474322e+05 3.186198e+05 2.558459e+05 3.829125e+05 2.136023e+05 1.299694e+05 1.561241e+05 2.125639e+05 1.249024e+05 1.758109e+05 5.419845e+06 1.413347e+05 1.630662e+05 1.488141e+05 1.160998e+05 1.687030e+05 7.184000e+05 1.374037e+06 1.561026e+05 1.927935e+05 9.933432e+04 7.116951e+04 1.365363e+05 5.171956e+04 1.650400e+05 3.043040e+04 1.120733e+04 1.158613e+05 3.314889e+05 4.526370e+04 1.399513e+05 4.043352e+04 1.353043e+05 2.528346e+05 7.649232e+05 1.093297e+05 5.824193e+05 4.567850e+04 1.541452e+05 1.164632e+05 1.149170e+04 7.796014e+04 1.430950e+06 5.627480e+04 2.514816e+05 3.793777e+05 4.122038e+06 2.386143e+05 2.094113e+05 1.285204e+05 9.796971e+04 4.826971e+04 4.874036e+04 5.058787e+05 3.697833e+05 9.815716e+04 9.127507e+04 1.976580e+05 1.252960e+05 1.905548e+05 5.353283e+04 1.314889e+05 9.035073e+05 2.243072e+05 5.020627e+04 6.767025e+04 4.558605e+05 5.718298e+04 2.354346e+05 2.453094e+05 7.199505e+04 8.064495e+04 3.291617e+05 1.336961e+05 1.471333e+05 1.614034e+05 7.676871e+04 1.039597e+05 7.012729e+04 4.585389e+04 3.623822e+05 7.768849e+04 9.433495e+04 1.260567e+05 4.596307e+05 1.032894e+05 4.098698e+04 1.130747e+05 3.261174e+04 9.012562e+04 6.757931e+04 3.231391e+04 6.239712e+04 4.280819e+05 2.687569e+06 1.477676e+05 4.213218e+04 8.147185e+04 8.277988e+04 1.112431e+05 1.498371e+05 4.002189e+04 4.085968e+05 6.510514e+04 1.059290e+05 2.245436e+04 8.154291e+04 4.452906e+05 C18 H38 O10_2.794 1.202692e+05 1.031008e+05 1.435880e+05 1.339004e+05 9.281590e+04 1.301131e+05 1.175328e+05 1.356574e+05 89913.37 1.249238e+05 1.475391e+05 1.144529e+05 107217.58 1.280254e+05 1.121289e+05 1.013314e+05 6.846515e+04 1.279150e+05 1.465791e+05 1.342302e+05 8.933362e+04 1.961203e+05 1.396082e+05 1.526389e+05 53595.719 9.182715e+04 1.185036e+05 1.208394e+05 3.700534e+04 7.617648e+04 1.201424e+05 1.404422e+05 68049.82 1.169521e+05 1.341407e+05 1.346769e+05 7.973219e+04 1.048211e+05 1.443412e+05 9.986594e+04 6.455659e+04 1.337380e+05 1.008666e+05 1.576923e+05 2.750194e+04 1.220689e+05 1.545437e+05 1.218074e+05 5.571656e+04 1.008278e+05 6.127145e+04 5.385160e+04 8.308138e+04 9.732163e+04 2.164723e+05 4.932262e+04 2.861819e+05 8.329170e+04 9.606332e+04 8.552967e+04 8.997676e+04 8.324065e+04 1.333197e+05 1.221170e+05 6.121235e+04 6.366359e+04 1.115661e+05 8.117855e+04 1.143840e+05 9.579772e+04 7.556232e+04 6.397542e+04 8.175541e+05 6.509906e+04 9.203082e+04 5.152888e+04 6.919296e+04 4.193797e+05 9.108168e+04 1.037551e+05 9.256509e+04 6.362215e+04 9.702709e+04 1.034539e+05 6.852966e+04 6.281798e+04 2.301925e+05 1.004811e+05 8.690968e+04 1.279305e+05 7.809991e+04 8.542876e+04 1.122382e+05 1.033134e+05 8.412255e+05 1.101824e+05 7.440185e+04 5.718035e+04 6.345836e+04 7.837582e+04 9.192614e+04 8.136290e+04 6.725027e+04 9.534345e+04 1.147983e+05 8.070830e+04 9.802278e+04 1.326007e+05 8.107840e+04 1.207518e+05 7.177496e+04 9.034647e+04 9.056607e+04 8.267372e+04 5.337162e+04 1.010217e+05 2.581715e+07 6.079282e+04 8.953698e+04 1.283796e+05 8.317286e+04 8.430569e+04 7.273197e+04 8.201914e+04 7.284509e+04 9.013190e+04 9.575375e+04 5.275111e+04 7.223269e+04 6.409351e+04 9.060010e+04 1.248396e+05 7.634729e+04 1.159858e+05 8.152269e+04 6.727960e+04 6.218306e+04 1.615678e+05 9.684638e+04 1.018007e+05 6.483916e+04 9.006553e+04 1.015009e+05 1.201577e+05 9.386939e+04 7.041475e+04 4.325439e+04 5.515425e+04 6.847277e+04 8.831884e+04 1.085194e+05 1.357305e+05 1.393708e+05 8.962832e+04 1.405489e+05 7.853880e+04 1.393269e+05 9.341401e+04 1.082499e+05 9.182522e+04 8.082635e+04 9.271238e+04 7.629260e+04 8.795578e+04 9.401321e+05 8.350940e+04 7.414674e+04 1.217337e+05 7.330556e+04 8.895584e+04 1.614316e+05 1.676744e+05 9.086337e+04 1.370505e+05 4.318601e+04 9.301311e+04 9.078119e+04 7.322692e+04 1.362754e+05 3.468602e+04 2.343205e+04 6.171604e+04 1.177865e+05 7.357207e+04 8.656641e+04 6.324943e+04 8.276359e+04 5.733499e+04 1.092123e+05 8.466438e+04 9.698836e+04 5.735137e+04 9.988368e+04 1.264897e+05 3.049527e+04 6.955131e+04 1.332117e+05 5.700309e+04 9.251883e+04 1.310231e+05 3.218743e+05 8.592477e+04 9.265155e+04 1.126245e+05 1.169963e+05 7.154474e+04 5.842847e+04 9.513339e+04 9.172681e+04 1.317719e+05 7.599388e+04 7.537169e+04 7.754911e+04 8.793462e+04 4.040017e+04 9.335681e+04 7.122519e+04 8.441003e+04 6.275327e+04 6.907815e+04 1.446293e+05 7.273264e+04 1.107171e+05 6.101968e+04 4.655653e+04 1.016532e+05 1.049533e+05 7.769238e+04 8.021738e+04 1.247739e+05 5.484361e+04 8.364697e+04 6.758804e+04 5.911991e+04 1.128563e+05 7.984889e+04 1.280868e+05 1.018595e+05 1.053280e+05 9.255163e+04 7.106143e+04 1.568392e+05 5.620246e+04 8.219034e+04 6.512801e+04 5.904461e+04 1.009661e+05 9.838294e+04 4.122109e+05 8.118610e+04 6.136575e+04 1.058550e+05 9.084761e+04 1.097767e+05 1.180865e+05 5.841312e+04 1.130293e+05 9.367750e+04 9.733085e+04 5.361899e+04 9.936574e+04 9.209501e+04 PANTOTHENATE (Peak 2) 6.981310e+06 2.314445e+05 3.463750e+05 2.747172e+05 6.875419e+04 2.042346e+05 2.483122e+05 2.708317e+05 83118.51 2.402563e+05 3.033104e+05 2.701693e+05 89623.68 2.706757e+05 2.480852e+05 2.811714e+05 7.052796e+04 2.504078e+05 1.901556e+05 3.419356e+05 1.180428e+05 2.073023e+05 2.866187e+05 3.641863e+05 50793.430 2.186369e+05 2.449555e+05 2.566877e+05 5.091395e+04 1.609862e+05 2.987157e+05 3.015717e+05 48284.55 3.221481e+05 2.179019e+05 2.469472e+05 9.920491e+04 2.153534e+05 2.673970e+05 3.966400e+05 4.375996e+04 2.219596e+05 2.087715e+05 3.005824e+05 2.036155e+04 2.454209e+05 2.128280e+05 3.014033e+05 1.588086e+05 4.069607e+05 8.374990e+05 1.856500e+05 3.087767e+05 4.601767e+05 1.126102e+06 2.137315e+05 5.573505e+05 8.595521e+05 7.746065e+05 3.407582e+05 3.454782e+05 3.540119e+05 3.538874e+05 9.982916e+05 2.601093e+05 2.222268e+05 1.617551e+05 2.061798e+05 6.316769e+05 3.806050e+05 6.962080e+04 6.130011e+05 2.619597e+05 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8.518747e+06 1.073724e+07 1.084717e+07 8.457333e+06 9.720146e+06 1.007183e+07 9.585990e+06 8.909912e+06 8.534788e+06 C10 H3 N O16 P2 S_2.841 1.384462e+05 3.042921e+06 3.063203e+06 3.169359e+06 1.370116e+05 3.283880e+06 2.544394e+06 3.110321e+06 149017.77 4.487969e+06 3.020847e+06 3.142800e+06 165312.39 2.706851e+06 2.948113e+06 3.052776e+06 1.348346e+05 3.813632e+06 2.819618e+06 3.065339e+06 2.578091e+05 3.126157e+06 3.393693e+06 3.380950e+06 99946.819 2.768397e+06 2.720940e+06 4.030017e+06 1.064989e+05 3.212011e+06 2.763820e+06 3.216942e+06 151523.43 3.146548e+06 3.165036e+06 2.874143e+06 1.502228e+05 3.636771e+06 3.252979e+06 3.025497e+06 1.444745e+05 3.183206e+06 3.036923e+06 3.750904e+06 5.952778e+04 2.371985e+06 2.736275e+06 3.726503e+06 3.265550e+06 2.451631e+06 2.906981e+06 3.436826e+06 2.941398e+06 3.163591e+06 3.047031e+06 2.578163e+06 2.853352e+06 2.983177e+06 3.384349e+06 3.389564e+06 3.382168e+06 2.365248e+06 3.265055e+06 3.166625e+06 3.337124e+06 2.598925e+06 3.731410e+06 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2.891742e+06 2.539078e+06 3.507195e+06 2.854434e+06 2.857614e+06 3.302074e+06 2.267017e+06 3.469546e+06 3.519727e+06 2.628782e+06 2.566307e+06 3.165402e+06 3.019791e+06 2.425310e+06 3.576751e+06 2.805078e+06 3.069700e+06 2.909856e+06 3.395242e+06 2.913571e+06 3.310131e+06 2.612349e+06 3.291417e+06 3.837706e+06 3.553466e+06 3.263053e+06 3.816486e+06 3.192055e+06 3.309357e+06 3.072737e+06 3.878341e+06 2.578929e+06 2.584707e+06 3.764860e+06 2.526479e+06 2.915450e+06 3.828779e+06 3.091488e+06 1.800587e+06 2.877014e+06 2.216952e+06 3.303463e+06 2.892986e+06 2.914003e+06 2.316503e+06 3.223914e+06 1.658722e+06 3.265319e+06 4.097708e+06 2.954549e+06 2.615636e+06 3.291325e+06 2.517137e+06 3.413064e+06 2.865601e+06 2.148474e+06 1.568655e+06 3.738102e+06 2.132601e+06 3.001560e+06 3.546746e+06 2.768567e+06 2.914865e+06 2.566390e+06 2.944171e+06 3.066968e+06 3.419334e+06 2.757103e+06 2.411638e+06 3.575966e+06 2.663701e+06 3.070489e+06 2.078722e+06 2.643173e+06 2.914660e+06 3.082180e+06 2.464635e+06 2.786960e+06 3.097300e+06 2.403178e+06 3.701327e+06 3.324879e+06 3.798596e+06 2.999420e+06 2.964800e+06 3.196915e+06 3.281210e+06 3.447372e+06 2.891998e+06 3.338589e+06 2.495610e+06 3.050711e+06 3.757777e+06 3.608256e+06 2.812688e+06 2.871477e+06 3.052945e+06 3.515255e+06 3.921567e+06 2.855482e+06 2.870628e+06 2.584226e+06 2.518302e+06 2.454851e+06 2.736267e+06 3.124989e+06 3.358955e+06 3.164022e+06 2.562668e+06 2.985660e+06 3.349114e+06 3.312101e+06 2.817815e+06 3.777253e+06 3.050115e+06 2.982589e+06 3.594173e+06 3.455098e+06 C8 H6 N6 O5 P2 S_2.841 1.376220e+05 7.182115e+06 7.534581e+06 7.228008e+06 1.402365e+05 5.639784e+06 6.427824e+06 8.131121e+06 174061.22 7.421402e+06 6.671262e+06 6.180207e+06 193197.98 7.692707e+06 5.457908e+06 7.538429e+06 1.457506e+05 7.390983e+06 6.851432e+06 6.844472e+06 2.562306e+05 6.680528e+06 7.975602e+06 7.057963e+06 101576.218 6.574822e+06 6.477024e+06 6.649125e+06 1.163617e+05 7.482821e+06 7.919530e+06 8.359722e+06 167711.63 5.135727e+06 5.748985e+06 6.171004e+06 1.453579e+05 7.323632e+06 6.650375e+06 8.451193e+06 1.178299e+05 7.587837e+06 6.602581e+06 7.123734e+06 5.877734e+04 6.151792e+06 7.853450e+06 6.142506e+06 7.520838e+06 6.660862e+06 6.685808e+06 7.866185e+06 4.931135e+06 6.785651e+06 6.811363e+06 6.902523e+06 6.977313e+06 6.992601e+06 6.744712e+06 6.518889e+06 7.882950e+06 5.985634e+06 5.505138e+06 6.062772e+06 4.289504e+06 6.102896e+06 6.349299e+06 6.655675e+06 6.649486e+06 6.820710e+06 5.594467e+06 6.804239e+06 8.727145e+06 7.327370e+06 5.757790e+06 7.629214e+06 6.035848e+06 6.626274e+06 1.784923e+05 6.175430e+06 7.059505e+06 5.513919e+06 6.074975e+06 7.545237e+06 6.052659e+06 6.737620e+06 1.787734e+06 5.193778e+06 5.930047e+06 5.449786e+06 7.070178e+06 6.748802e+06 6.884524e+06 6.596037e+06 5.860281e+06 6.643634e+06 4.316062e+06 6.905129e+06 5.803809e+06 7.407806e+06 5.894497e+06 5.757194e+06 7.197529e+06 7.088729e+06 7.065849e+06 6.407349e+06 6.626316e+06 6.208853e+06 6.238076e+06 4.713565e+06 6.398758e+06 5.629267e+06 7.453472e+06 6.042199e+06 5.049031e+06 4.993223e+06 6.698765e+06 4.538586e+06 6.995387e+06 7.017549e+06 6.232664e+06 6.489714e+06 5.658154e+06 7.986571e+06 4.247351e+06 5.648631e+06 7.392190e+06 7.856538e+06 7.899558e+06 7.963122e+06 5.868169e+06 1.741207e+05 7.070601e+06 6.852637e+06 6.527258e+06 7.557153e+06 1.030589e+07 9.394959e+06 7.305286e+06 6.414707e+06 6.321243e+06 8.250225e+06 7.928145e+06 7.463123e+06 7.541856e+06 7.349707e+06 7.337342e+06 1.223857e+07 6.570026e+06 6.018621e+06 6.453909e+06 6.064815e+06 7.214464e+06 6.330841e+06 7.804680e+06 7.304436e+06 7.561089e+06 7.951758e+06 6.668771e+06 6.626470e+06 5.109157e+06 5.031618e+06 7.235434e+06 5.776986e+06 7.015985e+06 7.190357e+06 6.122896e+06 5.206555e+06 7.713770e+06 6.580690e+06 5.561878e+06 6.707040e+06 6.174538e+06 6.791411e+06 9.131423e+06 6.432675e+06 6.857018e+06 4.796932e+06 6.541902e+06 5.238155e+06 6.536591e+06 7.095405e+06 4.886825e+06 6.566894e+06 6.885699e+06 6.539221e+06 7.086455e+06 6.008753e+06 5.215576e+06 5.830642e+06 4.609689e+06 5.515206e+06 8.068986e+06 5.210888e+06 8.787278e+06 6.136026e+06 5.345665e+06 7.419942e+06 6.112324e+06 5.292721e+06 4.518759e+06 7.552480e+06 6.560256e+06 7.895057e+06 7.370978e+06 7.222571e+06 6.196061e+06 5.947195e+06 6.175051e+06 8.890351e+06 7.362328e+06 5.787342e+06 4.574272e+06 6.643879e+06 7.965365e+06 6.541425e+06 5.494775e+06 5.584502e+06 7.293274e+06 6.353028e+06 6.049527e+06 5.110888e+06 5.554895e+06 5.603958e+06 6.710583e+06 5.668448e+06 5.140032e+06 6.382273e+06 6.767841e+06 6.929641e+06 5.868465e+06 6.688707e+06 6.358863e+06 6.443552e+06 1.939658e+06 6.784328e+06 5.906605e+06 6.532069e+06 6.005859e+06 7.729072e+06 5.184968e+06 5.998799e+06 5.347605e+06 6.535049e+06 6.612689e+06 6.213996e+06 7.284560e+06 7.033299e+06 4.811789e+06 7.755423e+06 6.530534e+06 6.964073e+06 7.534031e+06 7.062975e+06 7.275439e+06 5.584184e+06 7.033989e+06 6.868358e+06 6.341301e+06 6.163113e+06 8.762548e+06 6.169231e+06 Diatrizoic acid_2.843 3.177186e+05 1.065566e+09 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2.072482e+06 1.538503e+06 2.873563e+06 1.156413e+06 1.426499e+06 9.545101e+05 2.513597e+06 5.840330e+06 4.563397e+06 1.767860e+06 3.151093e+06 1.475263e+06 2.598594e+06 2.575910e+06 6.594383e+05 2.190690e+06 4.236939e+06 2.866548e+06 1.245294e+06 1.793371e+05 3.771628e+06 4.586515e+06 2.468631e+06 2.496549e+06 2.142380e+06 3.331044e+06 2.977524e+06 4.570175e+06 1.580630e+06 2.753085e+06 3.624136e+06 3.233660e+06 4.487606e+06 3.133423e+06 3.300053e+06 4.270367e+06 C10 H N6 O5 P3 S2_2.867 1.223857e+05 3.697549e+06 2.853065e+06 3.319069e+06 1.299346e+05 2.755653e+06 4.751925e+06 3.230049e+06 98928.44 3.803443e+06 3.095766e+06 3.483932e+06 93720.26 2.532857e+06 4.219141e+06 4.319857e+06 8.063673e+04 2.575174e+06 3.743737e+06 2.872088e+06 1.477900e+05 3.734114e+06 3.236218e+06 4.353141e+06 79963.527 3.228481e+06 2.367465e+06 3.873479e+06 9.539372e+04 2.919497e+06 2.792805e+06 5.268750e+06 108413.61 4.027035e+06 1.652452e+06 2.617590e+06 1.072827e+05 3.972746e+06 4.362437e+06 4.404061e+06 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1.575096e+05 2.164591e+05 6.049755e+04 1.739319e+05 1.018978e+05 1.254830e+05 9.625665e+04 1.856826e+05 1.325151e+05 1.893870e+05 5.792122e+04 1.662643e+05 5.220965e+04 1.734411e+05 8.582188e+04 2.074693e+05 1.074290e+05 2.897569e+05 2.103308e+05 4.133733e+05 6.159846e+04 7.510090e+04 5.418713e+04 6.543565e+04 1.147562e+05 5.700120e+04 6.282130e+04 1.228453e+05 1.728123e+05 2.117307e+06 2.232104e+05 5.697509e+04 1.426600e+05 1.261636e+05 8.848411e+04 3.847029e+05 7.836914e+04 5.057560e+05 5.967046e+04 8.491143e+04 8.297831e+04 1.228339e+05 3.517660e+05 C10 H14 N2 O3_2.879 3.073259e+05 1.750820e+05 1.361275e+05 1.409578e+05 1.048677e+05 1.438841e+05 1.936008e+05 2.594132e+05 62964.41 1.177225e+05 1.927540e+05 2.357326e+05 69058.13 7.900508e+04 1.814333e+05 1.468821e+05 7.052045e+04 1.377211e+05 2.018285e+05 2.226702e+05 1.111179e+05 9.409894e+04 1.900355e+05 1.954212e+05 55639.212 1.182284e+05 2.155687e+05 2.540604e+05 6.403739e+04 7.311112e+04 1.018967e+05 2.299515e+05 90059.28 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2.812109e+05 6.826081e+05 4.064583e+05 5.978432e+05 6.312972e+04 1.109416e+05 1.729604e+05 8.142323e+04 2.975688e+05 6.861660e+05 9.439230e+04 9.659872e+04 5.605133e+05 5.510983e+05 1.039278e+05 1.590463e+05 4.254992e+05 9.750033e+04 1.087835e+05 1.180027e+05 3.928469e+05 2.160084e+05 2.304811e+05 3.937982e+05 3.774527e+05 8.085691e+04 4.949632e+05 1.464554e+05 2.510618e+05 3.265140e+05 4.427406e+05 9.759845e+04 1.212540e+05 2.466494e+05 1.681588e+05 4.590396e+05 8.120055e+05 6.772719e+04 3.076778e+05 2.129885e+05 7.327986e+04 3.793046e+05 1.684254e+05 9.273412e+04 1.074788e+05 8.791863e+04 9.291628e+04 3.139486e+05 2.235105e+05 1.951680e+05 1.326646e+05 5.065916e+05 2.272874e+05 2.178234e+05 8.205454e+04 1.013352e+05 5.039707e+05 1.052047e+05 1.939418e+05 4.873879e+05 9.989336e+05 1.257189e+05 6.602339e+04 2.585849e+05 3.174621e+05 8.754260e+04 3.501027e+05 1.942034e+05 1.348819e+05 7.648820e+04 2.439469e+05 7.605924e+04 1.002339e+05 3.320688e+05 4.006694e+05 C5 H14 Br O4 P3 S2_2.879 7.942329e+04 4.223453e+07 3.326495e+07 9.293109e+07 1.519794e+05 1.419114e+08 4.348908e+07 3.659146e+07 172831.45 4.721511e+07 4.613285e+07 6.266721e+07 237628.27 7.651253e+07 2.449154e+07 7.245259e+07 1.585595e+05 6.111006e+07 2.773763e+07 4.732107e+07 2.814187e+05 7.034253e+07 3.183818e+07 4.080304e+07 113077.981 6.941760e+07 5.908044e+07 5.975959e+07 1.372926e+05 4.876570e+07 3.608011e+07 5.661664e+07 138558.17 5.921928e+07 3.411086e+07 5.715656e+07 1.360057e+05 6.923100e+07 3.830312e+07 2.492656e+07 1.177858e+05 9.756079e+07 4.478019e+07 5.624000e+07 1.147775e+05 3.114915e+07 5.963636e+07 5.181148e+08 3.399555e+08 1.242415e+08 1.167198e+08 1.979423e+08 8.461609e+07 1.769018e+08 7.157946e+07 4.954072e+08 1.194424e+08 8.678413e+07 8.560521e+07 3.846853e+07 3.209848e+07 6.827441e+07 5.755857e+07 8.377847e+07 1.706469e+08 3.165744e+08 2.441602e+08 7.115088e+07 1.523447e+08 1.572802e+08 1.387351e+08 1.086166e+08 5.639038e+07 2.460842e+08 1.041029e+08 2.277906e+08 1.433651e+08 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1.634825e+07 1.074600e+07 8.533936e+06 1.395802e+07 1.269085e+07 3.982207e+07 1.321922e+07 2.640100e+07 1.654897e+07 2.146174e+07 1.350727e+07 1.965139e+07 1.078050e+07 2.769858e+07 1.399115e+07 4.087869e+07 6.621322e+05 3.144344e+06 2.565142e+07 6.073842e+06 5.540618e+07 1.303715e+07 2.657377e+07 3.604853e+07 7.025439e+06 2.623203e+07 1.279293e+07 1.364245e+07 2.073265e+07 1.724776e+07 4.669614e+06 2.485851e+07 1.219569e+07 2.574337e+07 2.452046e+07 1.889811e+07 1.556647e+07 1281.45761_2.888 7.493222e+04 3.000047e+07 1.370646e+07 2.324013e+07 9.088701e+04 4.317644e+07 1.807058e+07 2.789559e+07 130122.89 2.333188e+07 2.002150e+07 3.075395e+07 149799.19 2.414354e+07 2.488877e+07 2.913310e+07 1.339198e+05 2.793340e+07 3.029839e+07 1.842174e+07 2.278094e+05 2.441454e+07 3.063360e+07 1.533227e+07 108436.894 2.855309e+07 2.928089e+07 2.237641e+07 1.288256e+05 2.952902e+07 2.925994e+07 1.899544e+07 135175.27 2.990739e+07 2.415190e+07 1.906141e+07 1.472558e+05 3.294374e+07 2.858729e+07 2.148607e+07 1.226120e+05 3.027294e+07 2.099075e+07 3.077424e+07 1.046180e+05 2.061494e+07 3.342811e+07 1.920502e+07 1.207558e+07 2.645067e+07 6.795875e+07 1.747555e+07 2.564761e+07 1.629173e+07 2.548120e+07 3.710206e+07 8.257426e+07 5.338262e+07 4.658536e+07 1.752768e+07 1.865460e+07 7.747470e+07 3.332824e+07 2.944195e+07 4.369382e+07 2.543764e+07 1.745386e+07 2.489024e+07 8.469782e+07 4.609240e+07 3.304093e+07 2.969579e+07 3.959319e+07 8.728000e+06 2.993428e+07 8.741949e+06 3.181612e+07 3.074386e+07 1.554170e+05 1.471690e+07 1.032333e+07 5.303885e+07 3.454264e+07 2.729949e+07 2.172190e+07 3.549588e+07 4.487081e+07 4.246471e+07 3.058387e+07 4.618829e+07 2.112907e+07 3.637539e+06 3.011278e+07 3.530336e+07 2.805559e+07 1.843252e+07 1.779626e+07 1.363247e+07 4.122119e+07 2.393448e+07 4.154957e+07 1.155936e+07 1.606623e+07 5.643471e+06 2.979254e+07 6.393531e+07 3.398332e+07 4.618410e+07 2.578357e+07 2.337725e+07 1.839659e+07 5.148380e+07 2.826893e+07 1.531473e+07 3.057877e+06 2.928969e+07 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2.176224e+07 6.556913e+06 2.457013e+07 6.288233e+07 1.696022e+07 2.883199e+07 4.133993e+07 4.361779e+07 1.141914e+07 4.109652e+07 2.487831e+07 2.702979e+07 4.684202e+07 1.509700e+07 4.853689e+07 5.985209e+07 2.356508e+07 2.244398e+07 3.450429e+07 6.474385e+07 2.671270e+07 3.094109e+07 1.807653e+07 6.063302e+07 2.448054e+07 4.029737e+07 2.878606e+07 6.140463e+07 2.305982e+07 3.190327e+07 4.802679e+07 1.971126e+07 3.223305e+07 2.868892e+07 1.541874e+07 2.376328e+07 2.545478e+07 1.699049e+07 3.251812e+07 1.983429e+07 2.270324e+07 3.663602e+07 2.682165e+07 1.886350e+07 4.112506e+07 4.434100e+07 4.929338e+07 2.290482e+07 1.098441e+07 1.400109e+07 5.175396e+07 6.720731e+06 7.739318e+07 2.666325e+07 3.425268e+07 3.868416e+07 1.801093e+07 3.939073e+07 1.707459e+07 1.246880e+07 6.358859e+07 1.877069e+07 1.648526e+07 4.960519e+07 2.705775e+07 2.536305e+07 4.206975e+07 3.967580e+07 2.264499e+07 730.8119_2.888 4.653081e+04 5.781953e+05 6.145783e+05 6.410256e+05 5.266466e+04 6.996603e+05 6.011901e+05 7.273633e+05 48005.07 5.691176e+05 7.127234e+05 7.639124e+05 51563.36 5.676293e+05 5.221690e+05 6.884440e+05 5.062397e+04 5.788775e+05 6.968742e+05 6.447002e+05 7.347707e+04 4.647239e+05 7.318608e+05 7.510310e+05 30305.949 5.718081e+05 6.933155e+05 6.459403e+05 4.322581e+04 5.628274e+05 6.235427e+05 6.629697e+05 50937.29 5.621004e+05 8.081054e+05 6.025303e+05 6.399785e+04 5.191355e+05 6.684235e+05 7.303117e+05 3.899377e+04 4.768470e+05 7.009316e+05 8.333377e+05 2.739488e+04 4.626996e+05 6.739199e+05 6.076752e+05 3.586431e+05 6.953339e+05 4.116260e+05 7.933025e+05 2.611387e+05 1.070139e+06 9.654794e+05 5.825631e+05 6.814844e+05 1.004795e+06 8.778744e+05 6.570024e+05 1.266854e+06 6.856302e+05 1.105417e+06 1.766302e+06 7.520792e+05 6.376173e+05 5.143823e+05 1.140762e+06 4.020767e+05 7.658139e+05 3.802775e+05 7.627103e+05 7.127327e+05 7.598532e+05 1.152281e+06 2.681059e+05 1.000250e+06 1.522797e+06 5.539424e+04 6.556987e+05 5.287979e+05 3.576059e+05 1.133171e+06 9.156179e+05 7.730411e+05 3.879476e+05 7.161575e+05 3.992567e+05 5.542617e+05 2.972942e+05 7.449547e+05 4.612287e+05 5.705580e+05 1.082402e+06 8.094813e+05 6.211212e+05 2.579826e+05 5.563010e+05 2.823284e+05 9.435046e+05 6.021805e+05 3.949017e+05 4.684669e+05 3.404576e+05 9.298206e+05 2.170620e+06 6.479093e+05 3.563178e+05 5.230009e+05 2.198358e+06 4.377764e+05 4.863032e+05 7.890514e+05 4.091024e+05 2.920123e+05 8.056398e+05 1.643496e+06 8.408102e+05 3.786688e+05 1.230462e+06 2.646479e+05 9.180466e+05 3.516002e+05 3.687407e+05 4.602411e+05 3.396784e+05 5.561289e+05 9.435386e+05 6.344898e+05 6.670494e+05 1.271982e+06 7.835072e+04 2.584963e+05 6.409967e+05 5.570771e+05 4.109875e+05 4.102377e+05 3.799146e+05 3.952129e+05 7.942587e+05 1.132323e+06 5.081321e+05 3.376692e+05 4.155047e+05 6.990511e+05 7.654623e+05 2.470221e+05 4.806850e+05 3.087582e+05 2.581132e+05 2.475378e+05 4.769283e+05 2.669276e+05 6.420871e+05 4.194134e+05 1.271147e+06 1.009062e+06 9.872513e+05 4.848872e+05 5.690554e+05 2.509164e+05 9.241560e+05 5.725025e+05 5.665549e+05 7.576134e+05 6.271073e+05 1.258498e+06 3.875538e+05 2.915125e+05 4.465327e+05 1.125341e+06 1.105138e+06 5.295705e+05 4.043950e+05 6.973289e+05 5.419296e+05 6.694458e+05 1.005546e+06 5.153610e+05 3.866431e+05 4.487611e+05 8.361874e+05 4.580460e+05 3.873713e+05 2.659739e+05 3.924474e+05 1.799346e+06 4.029578e+05 4.742931e+05 4.053190e+05 3.995786e+05 3.679698e+05 3.295069e+05 1.058711e+06 1.708214e+05 3.740148e+05 5.297477e+05 7.429625e+05 9.389868e+05 7.720623e+05 2.236744e+05 4.917344e+05 4.453052e+05 3.266542e+05 5.108783e+05 3.132281e+05 6.301239e+05 5.568783e+05 2.269167e+06 6.011922e+05 1.067856e+06 5.057505e+05 3.859061e+05 3.085196e+05 3.084503e+05 4.441638e+05 6.701212e+05 4.915103e+05 2.137304e+05 7.585399e+05 8.608810e+05 5.748736e+05 9.104155e+05 8.033529e+05 5.448321e+05 1.164250e+06 7.403669e+05 5.830348e+05 3.847915e+05 6.406865e+05 4.585334e+05 5.062249e+05 3.856623e+05 3.790290e+05 1.560125e+06 3.074765e+06 3.391944e+05 4.273772e+05 7.804875e+05 6.572850e+05 6.415816e+05 5.808477e+05 7.114970e+05 5.757220e+05 2.811630e+05 3.120135e+05 9.657436e+05 7.149666e+05 6.260327e+05 6.436191e+05 6.575757e+05 3.248010e+05 5.188799e+05 5.061970e+05 1.521276e+06 3.311356e+05 6.267901e+05 5.307925e+05 6.474436e+05 3.503143e+05 6.753188e+05 5.102366e+05 N-ACETYLGLYCINE 1.326822e+07 1.941913e+06 1.825234e+06 2.074915e+06 5.500889e+04 1.908137e+06 2.316675e+06 2.335975e+06 49750.15 1.770955e+06 1.882570e+06 2.233335e+06 52811.00 1.929853e+06 1.998816e+06 2.167516e+06 5.033109e+04 1.667152e+06 2.130455e+06 2.109578e+06 7.445297e+04 1.652214e+06 2.237540e+06 2.355680e+06 42854.962 1.623802e+06 2.259677e+06 2.067802e+06 4.551792e+04 1.738815e+06 1.827076e+06 2.262710e+06 50999.26 1.864097e+06 2.338399e+06 2.149308e+06 6.387670e+04 1.570504e+06 2.038726e+06 2.387453e+06 4.093043e+04 1.685289e+06 1.937853e+06 2.551401e+06 2.922187e+04 1.468147e+06 2.051111e+06 2.073858e+06 1.024987e+06 2.472524e+06 1.373933e+06 2.328349e+06 9.729470e+05 3.465610e+06 3.487136e+06 1.635278e+06 2.628512e+06 3.288215e+06 4.061989e+06 1.868672e+06 4.004533e+06 2.311807e+06 4.243209e+06 6.312315e+06 2.072549e+06 1.760495e+06 1.402178e+06 3.534323e+06 1.620890e+06 2.729107e+06 9.788230e+05 2.272215e+06 2.316618e+06 2.098446e+06 4.151371e+06 9.373467e+05 3.363845e+06 4.616101e+06 6.136997e+06 1.726331e+06 1.663134e+06 1.205122e+06 5.537283e+06 2.574746e+06 2.503705e+06 1.338946e+06 2.814685e+06 1.870493e+06 1.998953e+06 1.896681e+06 2.085138e+06 1.418417e+06 2.225345e+06 4.178877e+06 2.416472e+06 2.042898e+06 8.176569e+05 1.563896e+06 7.022157e+05 2.853833e+06 2.625568e+06 1.320087e+06 1.522909e+06 1.024350e+06 2.956900e+06 8.483762e+06 2.875091e+06 1.501576e+06 1.805985e+06 7.263951e+06 1.307759e+06 2.326405e+06 2.778749e+06 1.223269e+06 8.594403e+05 2.317531e+06 7.446479e+06 2.339417e+06 1.430637e+06 3.291581e+06 1.033432e+06 3.331833e+06 1.104782e+06 1.271756e+06 1.393663e+06 1.375070e+06 1.976255e+06 3.052991e+06 1.951739e+06 1.961951e+06 3.588338e+06 3.488945e+06 8.025074e+05 1.808125e+06 1.799159e+06 1.401270e+06 1.239907e+06 1.099374e+06 1.156936e+06 2.650670e+06 3.432000e+06 1.633452e+06 1.025819e+06 1.609601e+06 2.207426e+06 2.290881e+06 7.136927e+05 1.326544e+06 1.079354e+06 7.820516e+05 9.154661e+05 1.981820e+06 1.040838e+06 1.790468e+06 1.367014e+06 4.232535e+06 2.863019e+06 4.154399e+06 2.009353e+06 1.524473e+06 1.277384e+06 2.984432e+06 2.067149e+06 1.973042e+06 2.673602e+06 2.453413e+06 4.827871e+06 1.511744e+06 1.078804e+06 1.568033e+06 3.689358e+06 2.987637e+06 2.059161e+06 1.638652e+06 1.741216e+06 1.683070e+06 2.591397e+06 2.510115e+06 1.910597e+06 1.103551e+06 1.025790e+06 2.664233e+06 2.393482e+06 1.334197e+06 7.524545e+05 9.658851e+05 7.741461e+06 1.555208e+06 2.520984e+06 1.911336e+06 2.237929e+06 1.022276e+06 9.419704e+05 3.222906e+06 5.515284e+05 1.333069e+06 2.811575e+06 2.204088e+06 3.960957e+06 4.135619e+06 1.753141e+06 1.337853e+06 2.258336e+06 1.139891e+06 1.417227e+06 6.630233e+05 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1.815005e+05 9.121553e+06 8.054518e+06 3.090256e+06 102664.164 6.804057e+06 9.844366e+06 6.138869e+06 1.477850e+05 5.755756e+06 6.353563e+06 4.344175e+06 134498.92 7.228031e+06 7.016641e+06 5.009635e+06 1.353965e+05 6.859009e+06 9.130991e+06 6.060350e+06 9.843645e+04 7.184947e+06 5.195939e+06 7.440403e+06 8.732699e+04 5.157101e+06 8.331527e+06 4.860295e+06 6.706636e+06 9.221155e+06 1.165209e+07 4.635421e+06 7.955959e+06 7.674845e+06 8.083299e+06 1.191078e+07 1.059050e+07 5.806803e+06 6.726015e+06 5.060316e+06 4.686764e+06 9.392267e+06 7.667200e+06 8.903541e+06 1.132186e+07 5.768832e+06 4.636304e+06 9.265493e+06 9.083157e+06 1.001770e+07 2.859601e+06 7.534923e+06 1.277952e+07 4.240766e+06 1.092830e+07 4.820131e+06 9.222172e+06 7.315151e+06 1.617023e+05 4.146621e+06 5.470916e+06 5.948389e+06 9.117992e+06 7.969818e+06 7.139895e+06 7.712432e+06 1.109757e+07 1.090591e+07 7.781824e+06 1.344185e+07 9.421273e+06 4.858393e+06 8.604056e+06 9.700643e+06 9.547938e+06 5.522263e+06 4.674645e+06 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7.568361e+06 5.991261e+06 9.621271e+06 8.419388e+06 4.054039e+06 1.068977e+07 8.238643e+06 9.626267e+06 1.053575e+07 1.368301e+07 7.659386e+06 C17 H2 N9 O16 P3 S2_2.902 4.872407e+04 4.368998e+05 4.538664e+05 4.891478e+05 5.460488e+04 4.131439e+05 5.229885e+05 4.904729e+05 52395.85 4.592479e+05 3.989299e+05 5.901868e+05 57443.52 4.457103e+05 3.899705e+05 4.949371e+05 5.565548e+04 3.779742e+05 5.296384e+05 4.588361e+05 8.093131e+04 3.576032e+05 5.406653e+05 5.208006e+05 30136.817 4.455367e+05 4.585465e+05 4.799604e+05 6.447230e+04 4.309291e+05 3.738082e+05 5.073029e+05 60956.67 5.024616e+05 5.128598e+05 4.148853e+05 6.540699e+04 4.041950e+05 4.767519e+05 5.345553e+05 4.428119e+04 3.488823e+05 5.155345e+05 5.687914e+05 2.845878e+04 4.160724e+05 4.219360e+05 4.557679e+05 9.010957e+05 5.335757e+05 2.411968e+05 1.134560e+05 3.000937e+05 9.174675e+05 6.017535e+04 9.829500e+05 2.467458e+06 3.926134e+05 1.174097e+06 1.064554e+06 5.649467e+05 1.021926e+06 1.546476e+06 4.576861e+05 1.157962e+05 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6.558545e+05 2.360742e+06 3.601666e+05 5.972703e+05 9.290841e+04 5.548099e+05 1.151365e+05 2.777445e+05 2.010952e+05 2.627563e+05 1.266899e+06 5.970989e+05 4.075819e+05 7.708178e+04 1.300440e+05 1.596866e+05 3.497500e+05 1.522263e+06 2.760078e+05 7.117671e+04 2.729526e+05 7.995244e+05 1.282385e+06 8.237966e+04 5.897139e+04 1.152530e+05 1.688353e+05 4.924801e+05 2.406193e+05 1.520951e+05 7.513413e+05 8.025272e+04 1.525989e+05 9.143296e+05 1.136398e+06 7.056964e+05 5.823441e+04 6.523437e+05 1.999433e+05 8.987068e+05 1.909875e+05 2.518437e+05 1.507967e+05 C5 H9 N O3_2.903 3.019540e+06 1.111337e+06 9.271479e+05 1.048775e+06 1.146111e+05 9.878679e+05 1.166412e+06 1.226824e+06 119902.02 1.000465e+06 1.053918e+06 1.114735e+06 110047.94 9.650654e+05 1.016538e+06 1.105429e+06 1.038500e+05 1.042652e+06 1.046942e+06 1.097941e+06 1.575481e+05 9.235275e+05 1.087975e+06 1.247242e+06 60747.939 9.737619e+05 1.021471e+06 1.084293e+06 1.588319e+05 1.045433e+06 1.064619e+06 1.083975e+06 127340.70 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1.400534e+06 1.525551e+06 3.402549e+06 1.101507e+06 2.309100e+05 5.949793e+05 9.457027e+05 1.352552e+06 1.215596e+05 1.552513e+06 6.473309e+05 1.977411e+05 1.256255e+07 3.430941e+06 1.136645e+06 5.365009e+05 2.172678e+06 3.279096e+06 2.449373e+05 3.377592e+05 1.233746e+05 3.768624e+06 2.920515e+06 4.256223e+05 1.311010e+05 1.856552e+06 8.248422e+05 4.200330e+05 3.725924e+06 4.251894e+05 3.187061e+06 5.608247e+05 1.401058e+06 8.212090e+06 7.651995e+05 1.192449e+06 5.103458e+05 1.153030e+06 3.382137e+05 8.764991e+05 2.424214e+05 6.197550e+05 2.968265e+06 1.244628e+06 9.527077e+05 2.659557e+05 2.744641e+05 7.329742e+05 9.030516e+05 5.085045e+06 7.268206e+05 1.609766e+05 6.889267e+05 1.543189e+06 2.493707e+06 2.862129e+05 4.170247e+05 2.341379e+05 1.960324e+05 1.292761e+06 1.104682e+06 6.262865e+05 1.443927e+06 1.999427e+05 4.440052e+05 1.682956e+06 2.626250e+06 1.538068e+06 1.791653e+05 1.844953e+06 7.250498e+05 2.210906e+06 2.437981e+05 6.782328e+05 3.696969e+05 C51 H68 N6 O9 S_2.932 2.385306e+07 2.018984e+06 3.526025e+06 3.827797e+06 1.752346e+05 3.513423e+06 3.614500e+06 4.217853e+06 150706.13 3.610355e+06 2.868814e+06 3.077887e+06 173784.82 3.424556e+06 3.728410e+06 3.107850e+06 1.468964e+05 2.720458e+06 3.259757e+06 3.530880e+06 1.917385e+05 4.361674e+06 3.691925e+06 2.344143e+06 102884.935 2.916167e+06 4.038235e+06 3.963946e+06 1.369129e+05 2.923700e+06 3.114272e+06 3.806482e+06 119514.49 3.396775e+06 2.823249e+06 3.776192e+06 2.981125e+05 2.881833e+06 2.909459e+06 4.093374e+06 8.284379e+04 3.558742e+06 4.105390e+06 3.041885e+06 5.500344e+04 3.069705e+06 2.587367e+06 3.905220e+06 1.309684e+06 4.804243e+06 3.775262e+06 1.490793e+06 3.162580e+06 4.276132e+06 3.294690e+06 3.249286e+06 4.257741e+06 4.749302e+06 1.197522e+07 4.030115e+06 3.490814e+06 5.015612e+06 5.690006e+06 7.213565e+06 1.647040e+06 3.986289e+06 3.072925e+06 2.915107e+06 3.049473e+06 4.204702e+06 2.538218e+06 5.669466e+06 5.390185e+06 1.195288e+06 3.763121e+06 1.402183e+06 3.564600e+06 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2.161636e+06 2.889514e+06 2.000189e+06 6.955211e+06 2.528018e+06 5.555215e+06 2.553964e+06 7.462644e+06 4.809243e+06 2.420764e+06 2.875549e+06 1.227835e+06 6.496679e+06 1.389790e+06 1.231880e+06 2.459199e+06 1.053201e+07 7.174137e+06 2.920764e+06 6.330518e+05 3.003190e+06 2.739185e+06 8.995884e+06 3.992970e+06 2.322203e+06 5.265799e+06 2.731254e+06 6.352820e+06 8.264679e+05 3.515986e+06 8.210233e+06 C9 H9 N O4_2.932 8.454373e+05 1.919649e+05 2.413032e+05 2.466390e+05 6.018089e+04 1.323360e+05 2.329542e+05 2.562288e+05 56065.22 2.276108e+05 2.148855e+05 2.026756e+05 65333.10 1.960218e+05 1.802125e+05 2.690712e+05 5.966560e+04 2.056225e+05 1.764217e+05 2.399600e+05 8.055228e+04 1.580689e+05 2.490782e+05 2.536526e+05 32347.444 2.036506e+05 1.934608e+05 2.626502e+05 6.695237e+04 1.517751e+05 2.456644e+05 2.183889e+05 61333.07 1.891155e+05 2.430499e+05 2.103431e+05 6.375601e+04 1.377297e+05 2.533170e+05 2.124634e+05 5.913672e+04 1.824400e+05 2.453632e+05 2.684910e+05 3.409027e+04 2.113017e+05 1.982974e+05 1.782671e+05 8.902225e+04 2.716392e+05 1.501762e+05 8.643576e+04 2.967247e+05 2.618337e+05 1.182488e+05 1.032724e+06 4.220103e+05 2.144249e+05 9.846091e+05 5.529523e+05 2.123864e+05 1.221955e+05 2.942582e+05 1.630473e+05 1.675466e+05 1.660968e+05 2.165729e+05 2.531851e+05 4.805200e+05 2.037942e+05 3.529818e+05 8.941381e+04 2.419106e+05 1.368539e+05 2.454324e+05 1.211905e+05 1.178585e+05 4.146784e+05 2.417582e+06 2.896883e+05 2.991395e+05 7.221760e+04 4.777081e+05 6.732955e+04 3.653452e+05 5.146921e+05 5.450057e+05 3.213838e+06 3.880914e+05 2.355333e+05 7.625249e+04 1.497725e+05 2.495249e+05 2.971884e+05 2.400007e+05 7.601585e+04 1.969721e+05 8.170172e+04 8.828398e+04 1.793530e+05 9.950589e+04 3.054869e+05 2.087874e+05 1.823860e+05 1.811643e+05 1.531476e+05 1.686460e+05 3.286505e+05 1.610095e+05 3.255800e+05 2.655193e+05 2.803971e+05 2.164015e+05 7.959478e+04 9.747615e+04 1.374596e+05 6.262298e+05 7.686027e+04 6.634469e+05 1.828339e+05 1.439286e+05 8.458013e+04 3.211085e+05 1.381553e+05 1.400461e+05 9.506330e+04 9.523895e+04 1.345203e+05 2.923543e+05 6.374661e+04 6.797127e+04 1.481689e+06 4.244728e+05 7.866397e+04 1.870008e+05 1.360430e+05 7.347276e+05 4.081452e+05 2.133334e+06 4.537977e+05 2.511405e+05 5.741423e+05 7.007733e+04 3.593535e+05 1.969782e+05 1.884747e+05 7.579458e+04 9.109641e+04 2.141349e+05 1.234333e+05 7.341163e+04 1.401057e+05 2.244230e+05 1.084561e+05 2.991422e+05 1.183688e+05 1.571135e+05 1.560929e+05 9.852910e+04 3.831663e+05 2.689025e+05 7.189595e+05 1.421007e+05 9.315169e+05 4.074250e+05 7.896807e+04 1.043505e+05 2.282828e+05 1.795963e+05 2.473068e+05 6.121404e+05 4.922333e+05 2.037207e+05 2.942855e+05 2.619851e+05 5.686401e+05 6.073850e+05 1.499020e+05 4.301683e+05 1.182965e+05 8.688161e+04 1.487127e+05 6.708049e+05 1.118272e+05 1.160813e+05 2.634219e+05 5.741164e+05 2.020325e+05 4.851916e+05 2.632764e+05 2.207043e+05 2.512811e+05 8.961576e+04 1.265000e+05 1.604223e+05 6.822034e+04 1.357114e+05 1.906946e+05 3.002997e+05 4.427673e+05 2.447032e+05 1.079034e+05 1.374866e+05 8.986127e+05 1.654162e+05 7.975956e+04 1.313972e+05 6.745604e+05 2.685707e+05 1.781393e+05 9.786482e+04 9.031493e+04 2.550903e+05 1.405820e+05 1.051389e+05 5.092151e+05 9.074996e+04 3.082531e+05 8.039415e+04 1.694227e+05 5.311304e+05 2.524140e+05 4.834954e+05 1.252310e+05 1.567660e+05 1.749611e+05 1.654388e+05 7.900249e+04 4.954547e+05 1.160459e+05 1.369976e+05 8.888282e+05 3.873846e+05 6.698486e+04 8.216920e+04 1.002334e+05 1.384577e+05 2.046272e+05 2.040558e+05 4.985107e+05 6.417506e+04 5.901846e+04 7.183105e+04 5.065060e+05 1.005039e+05 9.253174e+04 2.380796e+05 9.102396e+04 7.222620e+04 6.180840e+05 1.995942e+05 1.169232e+05 2.054359e+05 9.040611e+05 1.237854e+05 1.101013e+05 8.987716e+04 4.265866e+05 5.567922e+05 9.358410e+04 1.751000e+05 6.206922e+05 C7 H4 O2_2.933 8.273157e+05 1.516485e+05 1.065481e+05 2.124760e+05 5.521588e+04 6.838734e+04 1.844122e+05 1.492901e+05 51615.82 1.413772e+05 1.543242e+05 1.802137e+05 52002.66 1.643036e+05 1.529036e+05 1.707643e+05 4.693490e+04 1.534304e+05 1.746218e+05 1.942336e+05 7.131205e+04 7.097834e+04 1.706203e+05 1.873212e+05 30721.792 1.603716e+05 1.831390e+05 1.135722e+05 5.112138e+04 1.493551e+05 1.670604e+05 1.602332e+05 48949.14 1.900541e+05 1.413240e+05 1.918141e+05 4.958618e+04 1.496195e+05 1.273167e+05 1.831846e+05 5.829370e+04 1.030723e+05 1.554118e+05 2.951419e+05 2.731776e+04 1.016059e+05 1.405512e+05 1.426855e+05 6.945678e+04 1.526043e+05 2.188251e+05 1.141537e+05 1.226064e+05 8.974529e+04 5.166864e+04 7.452559e+05 3.185271e+05 2.534756e+05 7.404916e+05 2.882004e+05 1.657837e+05 1.136495e+05 2.621255e+05 1.310544e+05 1.011703e+05 6.770366e+04 1.194428e+05 2.378116e+05 4.083896e+05 2.484169e+05 3.395660e+05 7.191283e+04 1.733574e+05 1.109726e+05 2.129446e+05 9.992515e+04 9.794302e+04 3.175214e+05 1.921179e+06 2.046511e+05 2.492791e+05 1.447209e+05 3.524337e+05 7.350464e+04 2.500620e+05 4.302315e+05 3.225414e+05 2.604520e+06 3.535015e+05 1.295408e+05 1.239630e+05 9.441557e+04 2.214408e+05 1.545656e+05 1.583216e+05 5.360183e+04 1.819542e+05 1.007877e+05 8.254253e+04 5.501473e+04 1.004221e+05 2.219826e+05 1.706565e+05 6.668607e+04 1.060428e+05 7.577448e+04 7.902625e+04 2.802726e+05 1.497935e+05 3.079790e+05 7.293104e+04 3.803536e+05 6.770846e+04 8.853264e+04 5.065083e+04 6.753816e+04 5.639633e+05 6.499710e+04 5.162350e+05 8.851829e+04 1.563035e+05 1.075184e+05 2.257347e+05 9.614070e+04 1.177066e+05 1.237797e+05 5.346382e+04 9.669323e+04 1.955302e+05 5.192683e+04 8.694731e+04 1.118336e+06 3.154471e+05 6.958858e+04 8.073675e+04 8.011682e+04 4.892315e+05 3.562220e+05 1.918693e+06 3.894196e+05 1.190210e+05 5.228962e+05 5.400780e+04 2.882405e+05 1.473243e+05 1.297265e+05 6.412895e+04 1.189127e+05 1.669254e+05 7.243329e+04 9.451129e+04 6.503106e+04 2.597944e+05 1.131153e+05 3.166632e+05 1.230850e+05 1.777921e+05 7.320885e+04 6.621008e+04 2.664253e+05 2.263125e+05 4.353024e+05 1.591522e+05 6.254356e+05 2.821354e+05 1.037852e+05 7.106738e+04 1.039948e+05 1.199320e+05 2.490852e+05 4.753807e+05 3.719763e+05 8.027984e+04 2.495721e+05 1.049314e+05 3.845342e+05 4.217610e+05 1.288934e+05 3.139426e+05 7.919447e+04 8.235112e+04 7.268677e+04 5.226150e+05 1.203308e+05 5.915173e+04 1.330958e+05 4.918004e+05 8.238396e+04 3.767103e+05 2.270734e+05 2.218558e+05 1.159543e+05 6.800741e+04 1.336909e+05 9.241550e+04 5.593449e+04 7.991102e+04 1.738460e+05 2.137046e+05 3.307732e+05 3.008637e+05 6.463551e+04 1.556725e+05 5.855375e+05 1.306428e+05 6.106507e+04 6.941954e+04 4.552506e+05 2.696210e+05 1.700482e+05 1.058928e+05 6.082931e+04 2.040167e+05 1.117327e+05 1.045626e+05 3.670028e+05 7.205253e+04 2.859530e+05 5.623670e+04 1.593079e+05 4.179411e+05 2.006266e+05 3.558697e+05 1.435587e+05 1.018506e+05 6.953878e+04 1.519034e+05 6.560051e+04 3.712027e+05 6.410013e+04 6.908563e+04 6.848049e+05 2.460694e+05 1.207745e+05 7.868131e+04 9.585724e+04 1.095744e+05 8.257241e+04 1.706948e+05 4.273032e+05 1.155099e+05 5.495278e+04 8.116393e+04 3.363809e+05 1.366450e+05 7.093314e+04 2.002080e+05 6.576758e+04 5.640930e+04 4.644684e+05 9.246642e+04 1.275029e+05 5.623645e+04 6.896715e+05 5.383069e+04 7.890395e+04 5.619664e+04 3.623518e+05 4.721112e+05 7.706153e+04 1.842008e+05 3.313292e+05 C8 H14 N9 P3_2.934 4.618859e+06 3.729812e+05 3.665335e+05 4.103266e+05 8.561276e+04 2.466708e+05 4.607292e+05 4.839440e+05 64570.96 3.428438e+05 3.325071e+05 4.159501e+05 65862.85 3.898049e+05 3.324023e+05 3.794988e+05 5.698042e+04 3.424745e+05 3.600949e+05 4.401841e+05 7.648185e+04 3.826673e+05 3.983475e+05 4.011604e+05 34100.698 3.126983e+05 4.166958e+05 4.200532e+05 5.416115e+04 2.584262e+05 3.431740e+05 4.158652e+05 50461.73 4.890070e+05 3.817936e+05 2.262936e+05 5.249365e+04 4.608451e+05 3.595525e+05 3.299233e+05 5.562468e+04 4.478728e+05 3.483140e+05 3.549777e+05 3.433186e+04 5.195539e+05 3.162898e+05 3.508855e+05 2.532096e+05 3.421549e+05 6.068129e+05 2.881237e+05 5.663222e+05 3.986318e+05 8.367047e+05 3.950404e+05 4.486005e+05 3.185418e+05 1.414564e+06 3.404674e+05 3.414846e+05 3.613670e+05 5.176748e+05 6.154250e+05 1.906668e+05 2.101049e+05 1.420323e+05 1.262216e+06 1.615091e+06 4.876918e+05 4.318481e+05 6.393781e+05 3.842678e+05 9.523857e+04 1.014657e+06 1.354463e+05 5.904163e+05 3.297778e+05 4.598830e+06 5.587206e+05 9.361667e+05 7.619525e+05 9.835505e+05 5.756357e+05 3.273108e+05 4.165796e+05 9.643797e+05 1.653404e+06 2.582334e+05 2.293196e+06 3.925163e+05 1.128778e+05 5.993760e+05 1.129978e+06 1.898036e+05 1.050401e+05 1.708930e+05 2.444088e+05 6.367666e+04 4.533680e+05 5.169382e+05 1.395537e+05 1.093693e+05 6.930008e+04 1.796410e+05 3.702303e+05 1.419370e+06 6.211739e+05 5.887202e+05 9.424162e+05 1.623020e+05 3.479742e+06 1.205907e+06 7.196498e+04 9.745439e+04 7.123336e+05 1.036357e+06 7.067477e+04 5.485029e+05 1.943023e+05 3.152034e+05 1.255522e+05 2.744339e+05 6.844197e+05 2.782628e+05 2.099585e+05 2.700674e+05 4.064835e+05 3.986065e+05 4.680030e+05 6.420177e+05 1.488051e+06 1.037047e+05 6.536405e+05 2.326110e+05 4.940137e+05 2.688071e+05 1.619993e+05 2.040509e+05 3.962059e+05 8.486486e+05 1.276697e+06 1.155034e+05 4.921506e+05 5.915545e+05 8.459556e+05 7.569472e+04 4.225139e+05 8.895452e+05 8.715128e+04 2.302779e+05 9.367692e+05 1.207481e+06 2.576141e+05 2.602709e+05 5.881719e+05 6.570486e+05 3.352938e+05 4.625662e+05 7.433954e+05 2.579545e+05 4.229490e+05 9.557057e+04 7.954470e+05 1.069361e+06 4.177030e+05 2.782280e+05 8.502801e+05 4.854968e+05 5.329207e+05 9.163538e+04 3.370389e+05 4.750398e+05 7.672805e+05 6.845322e+05 2.577314e+05 7.137660e+05 9.477943e+04 1.308117e+06 1.150127e+05 1.492738e+05 9.816891e+05 9.852685e+05 1.030333e+05 9.175188e+04 6.889852e+04 7.126147e+05 3.453138e+05 1.568385e+06 7.843697e+05 2.322364e+06 1.438698e+05 9.877244e+04 8.153649e+05 1.384747e+05 5.975190e+05 2.348963e+06 1.504445e+05 1.452106e+06 2.798487e+06 2.234774e+06 2.986767e+05 1.600683e+06 5.786788e+05 2.237285e+05 6.533804e+04 1.655093e+05 4.528124e+05 9.321370e+05 1.068839e+06 2.929274e+05 4.708647e+05 1.858219e+06 3.678555e+05 6.634870e+05 1.895957e+06 3.716491e+05 9.389478e+05 1.193372e+05 3.780328e+05 1.139525e+06 1.829287e+05 9.985627e+05 1.237074e+06 8.366647e+04 4.446375e+05 1.561952e+05 7.902058e+04 4.777434e+05 1.249566e+05 6.168994e+05 1.644314e+05 6.870268e+04 2.361712e+05 9.709514e+05 2.441214e+05 7.390723e+05 2.055904e+05 1.763443e+06 5.342223e+05 4.190869e+05 7.004393e+04 7.548383e+04 8.822850e+05 2.594877e+05 2.070540e+05 3.673996e+05 9.163879e+05 7.162217e+05 2.784588e+05 1.336903e+05 6.154650e+05 3.620370e+05 5.234949e+05 2.545499e+05 7.201335e+04 8.010013e+05 5.846759e+05 6.649368e+05 2.133206e+05 4.065369e+05 1.663928e+06 C35 H77 N9 O14 P2 S_2.934 5.382982e+06 7.798413e+05 7.742684e+05 6.094659e+05 8.577133e+04 1.083981e+06 7.799259e+05 8.406868e+05 88287.58 8.828278e+05 7.393798e+05 8.625485e+05 108349.28 8.610769e+05 8.162537e+05 5.539690e+05 9.202053e+04 7.556942e+05 8.525157e+05 7.379980e+05 1.212282e+05 1.085766e+06 1.212666e+06 4.120803e+05 63651.882 5.758640e+05 9.215315e+05 9.006900e+05 9.034312e+04 6.438207e+05 8.168570e+05 7.876490e+05 68578.16 9.438616e+05 1.032512e+06 5.118288e+05 5.772617e+04 7.721568e+05 7.209541e+05 9.619009e+05 5.415974e+04 8.810097e+05 9.216284e+05 8.376024e+05 3.674696e+04 7.274327e+05 5.495087e+05 9.652380e+05 5.407981e+05 1.229829e+06 1.230045e+06 7.456163e+05 7.030114e+05 1.118559e+06 8.269018e+05 1.725557e+06 1.249133e+06 4.634967e+05 2.460060e+06 7.421677e+05 4.371955e+05 1.805178e+06 3.201391e+05 2.099363e+06 2.226148e+05 3.800326e+05 6.514781e+05 8.040123e+05 1.086859e+06 1.655784e+06 4.558596e+05 1.270058e+06 1.865743e+06 2.638768e+05 1.429182e+06 5.483929e+05 9.880381e+05 9.731443e+05 8.017868e+06 6.774938e+05 7.625725e+05 1.130888e+06 1.467778e+06 8.496516e+05 9.191113e+05 9.788516e+05 1.838002e+06 2.374503e+06 1.330004e+06 1.178596e+06 5.748204e+05 3.289466e+05 1.286907e+06 1.863180e+06 7.811010e+05 7.029430e+05 5.727740e+05 3.805119e+05 1.243458e+05 1.022906e+06 1.889635e+06 2.602002e+05 4.625283e+05 2.960506e+05 1.290768e+06 1.363248e+06 9.263280e+05 2.590210e+06 8.384315e+05 1.296386e+06 5.440433e+05 1.846483e+06 1.573853e+06 2.542830e+05 2.666792e+05 1.260404e+06 1.223338e+06 9.282625e+04 1.173198e+06 9.185665e+05 5.297263e+05 7.257500e+05 3.841847e+05 8.913769e+05 5.006705e+05 8.071865e+05 1.196061e+06 1.050733e+06 8.390409e+05 3.914567e+05 6.605887e+05 5.565930e+06 1.311682e+06 1.368355e+06 8.006598e+05 1.141165e+06 1.388192e+06 6.578653e+05 6.826587e+05 5.899569e+05 6.922777e+05 1.256369e+06 6.893769e+05 6.280627e+05 1.614835e+06 7.805009e+05 2.011375e+05 4.320607e+05 4.418929e+05 4.940310e+05 7.736349e+05 6.327350e+05 2.008189e+06 6.179185e+05 4.475179e+05 8.895802e+05 1.240708e+06 1.461911e+06 7.726667e+05 1.321076e+06 5.312330e+05 1.192001e+06 8.320324e+05 1.828207e+06 1.547461e+06 8.641528e+05 1.525066e+06 1.518718e+06 5.133953e+05 1.286725e+06 1.217424e+06 1.304682e+06 1.277479e+06 1.013280e+06 5.367005e+05 8.064711e+05 1.429388e+06 6.383822e+05 1.229833e+06 4.815123e+05 1.377702e+05 5.296147e+06 1.815368e+06 3.649080e+05 3.339760e+05 1.723017e+05 2.204908e+06 8.718876e+05 2.477476e+06 1.154947e+06 3.110227e+06 3.449749e+05 5.832502e+05 8.703010e+05 7.173771e+04 9.470950e+05 2.526997e+06 4.571086e+05 7.616301e+05 2.753169e+06 1.942477e+06 4.158784e+05 1.226841e+06 6.885621e+05 1.578297e+06 2.539245e+05 4.880161e+05 1.202422e+06 7.160944e+05 1.207813e+06 7.580168e+05 1.830780e+06 2.286109e+06 9.551290e+05 1.054464e+06 8.454030e+05 1.085743e+06 1.649042e+06 2.556895e+05 3.455266e+05 1.534000e+06 9.152090e+05 1.488100e+06 9.915929e+05 6.504739e+05 1.043180e+06 6.868944e+05 1.510475e+05 1.455177e+06 8.947469e+05 8.657541e+05 5.215989e+05 6.968063e+05 5.359221e+05 1.832068e+06 7.575669e+05 1.349603e+06 1.517652e+06 2.629114e+06 1.257831e+06 5.962515e+05 8.456792e+05 2.661885e+05 1.458697e+06 5.899157e+05 4.284809e+05 6.015245e+05 2.035670e+06 1.731953e+06 5.242337e+05 9.895183e+04 7.045206e+05 7.645354e+05 2.432083e+06 1.209743e+06 9.425152e+05 1.162279e+06 9.930700e+05 1.563930e+06 3.297905e+05 1.550406e+06 2.721597e+06 765.82787_2.935 5.956557e+04 5.183086e+06 4.956371e+06 4.906733e+06 6.481960e+04 4.576842e+06 5.479435e+06 5.455420e+06 61776.94 4.775250e+06 4.917816e+06 6.026752e+06 66381.89 4.203944e+06 4.545773e+06 5.500042e+06 6.265589e+04 5.191582e+06 4.881364e+06 5.104845e+06 9.171832e+04 4.131514e+06 5.451317e+06 6.217825e+06 41289.245 4.310368e+06 5.069178e+06 5.138157e+06 7.949968e+04 4.323811e+06 5.148472e+06 5.939244e+06 66588.88 4.407311e+06 5.068027e+06 5.387312e+06 6.803311e+04 4.596251e+06 4.430837e+06 5.435075e+06 6.225931e+04 4.510841e+06 5.224372e+06 6.692117e+06 3.389188e+04 4.017784e+06 5.861742e+06 3.928302e+06 5.246293e+06 2.130030e+06 2.964566e+06 8.062385e+06 6.361251e+06 3.905897e+06 6.500071e+06 5.673418e+06 4.416501e+06 5.042146e+06 9.988606e+06 4.525021e+06 5.534042e+06 4.177199e+06 5.636361e+06 3.000933e+06 8.350495e+06 4.649428e+06 2.523888e+06 8.742488e+06 9.554921e+06 4.202094e+06 1.436905e+07 8.371251e+06 6.507000e+06 1.318094e+06 4.446582e+06 3.476264e+06 3.842012e+06 3.602070e+06 6.712198e+04 5.920344e+06 1.228660e+07 9.305602e+06 2.447511e+06 6.513091e+06 3.563812e+06 2.567814e+06 6.586508e+06 4.061738e+06 1.706426e+06 4.334250e+06 6.095341e+06 3.195932e+06 5.869165e+06 6.772804e+06 2.547093e+06 1.785596e+06 1.914337e+06 4.725018e+06 4.586094e+06 4.831885e+06 3.377154e+06 3.786823e+06 1.027276e+06 3.527416e+06 1.869668e+06 2.981458e+06 5.425617e+06 2.472364e+06 5.007069e+06 6.635561e+06 1.733238e+06 9.329139e+06 1.002662e+07 3.107324e+06 2.347528e+06 4.473421e+06 7.912640e+06 4.503718e+06 4.348795e+06 2.081574e+06 4.414469e+06 2.938173e+06 3.718343e+06 7.906737e+06 3.382944e+06 1.510396e+06 3.200853e+06 4.631725e+06 4.971197e+06 8.748966e+06 8.916303e+06 8.785869e+04 1.636873e+06 6.986292e+06 2.855719e+06 6.421945e+06 3.440684e+06 3.220187e+06 3.275081e+06 5.023652e+06 9.603183e+06 1.736862e+07 3.010794e+06 4.595762e+06 8.129442e+06 1.450216e+07 2.035450e+06 1.266988e+07 1.312745e+07 2.731670e+06 3.098967e+06 5.981893e+06 8.514201e+06 3.313587e+06 2.849485e+06 4.575449e+06 5.569584e+06 2.915866e+06 4.710850e+06 7.985572e+06 1.870738e+06 5.243118e+06 1.158659e+06 4.961841e+06 6.774384e+06 3.647044e+06 2.795186e+06 7.607560e+06 4.047629e+06 4.087402e+06 1.670865e+06 3.235020e+06 3.937670e+06 4.453488e+06 6.713497e+06 4.873030e+06 5.148587e+06 1.967343e+06 8.276913e+06 4.536824e+06 4.290719e+06 4.072979e+06 1.952659e+06 4.282138e+06 2.871128e+06 2.580633e+06 3.009572e+06 3.129623e+06 3.891938e+06 4.666108e+06 2.625420e+06 6.449962e+06 2.751895e+06 9.332728e+06 1.878663e+06 6.099794e+06 7.398348e+06 4.024452e+06 6.151839e+06 7.688170e+06 2.476332e+06 6.294340e+06 4.397903e+06 5.586953e+06 3.360408e+06 2.936239e+06 4.009475e+06 2.461432e+06 4.742530e+06 1.201334e+07 5.455597e+06 2.701367e+06 6.194777e+06 3.576986e+06 1.047478e+07 1.904597e+07 1.162554e+06 4.217227e+06 2.424758e+06 4.543085e+06 5.108246e+06 2.907803e+06 6.166726e+06 7.240055e+06 2.811288e+06 4.139868e+06 7.264494e+05 2.347160e+06 4.856799e+06 2.702069e+06 1.253940e+07 3.143154e+06 1.620566e+06 4.482935e+06 4.528228e+06 3.684922e+06 4.444735e+06 2.846031e+06 8.208399e+06 4.615427e+06 6.927170e+06 3.313964e+06 3.558241e+06 4.758772e+06 4.501024e+06 6.255952e+06 3.423891e+06 4.050207e+06 4.100091e+06 4.583961e+06 6.351159e+06 7.922897e+06 6.242340e+06 4.571606e+06 3.731380e+06 2.335989e+06 4.053413e+06 6.120022e+06 3.991847e+06 8.774532e+06 2.982741e+06 1.165429e+07 164.52865_2.938 4.489885e+06 3.729812e+05 3.665335e+05 4.103266e+05 8.570850e+04 2.466708e+05 4.607292e+05 4.839440e+05 62705.93 3.428438e+05 3.325071e+05 4.159501e+05 65936.51 3.898049e+05 3.324023e+05 3.794988e+05 5.986940e+04 3.424745e+05 3.600949e+05 4.401841e+05 7.972356e+04 3.826673e+05 3.983475e+05 4.011604e+05 36384.934 3.126983e+05 4.166958e+05 4.200532e+05 6.144224e+04 2.584262e+05 3.431740e+05 4.158652e+05 48128.17 4.890070e+05 3.817936e+05 2.262936e+05 5.447512e+04 4.608451e+05 3.595525e+05 3.299233e+05 5.568689e+04 4.478728e+05 3.483140e+05 3.549777e+05 3.437026e+04 5.195539e+05 3.162898e+05 3.508855e+05 2.532096e+05 3.421549e+05 6.068129e+05 2.881237e+05 5.663222e+05 3.986318e+05 8.367047e+05 3.950404e+05 4.486005e+05 3.185418e+05 1.414564e+06 3.404674e+05 3.414846e+05 3.613670e+05 5.176748e+05 6.154250e+05 1.906668e+05 2.101049e+05 1.420323e+05 1.262216e+06 1.644183e+06 4.876918e+05 4.318481e+05 6.393781e+05 3.842678e+05 9.534507e+04 1.014657e+06 1.354463e+05 5.904163e+05 3.297778e+05 4.903159e+06 5.587206e+05 9.361667e+05 7.619525e+05 9.835505e+05 5.756357e+05 3.273108e+05 4.165796e+05 9.643797e+05 1.466254e+06 2.582334e+05 2.293196e+06 3.925163e+05 1.128778e+05 5.993760e+05 1.129978e+06 1.898036e+05 1.051576e+05 1.710841e+05 2.444088e+05 6.374787e+04 4.533680e+05 5.169382e+05 1.395537e+05 1.094916e+05 6.937758e+04 1.796410e+05 3.702303e+05 1.419370e+06 6.211739e+05 6.250374e+05 9.424162e+05 1.624836e+05 3.272242e+06 1.205907e+06 7.204546e+04 9.756337e+04 7.123336e+05 1.036357e+06 7.075381e+04 5.485029e+05 1.943023e+05 3.152034e+05 1.255522e+05 2.744339e+05 6.844197e+05 2.782628e+05 2.099585e+05 2.700674e+05 4.064835e+05 3.986065e+05 4.680030e+05 6.420177e+05 1.488051e+06 1.037047e+05 6.536405e+05 2.326110e+05 4.940137e+05 2.688071e+05 1.619993e+05 2.040509e+05 3.962059e+05 8.486486e+05 1.276697e+06 1.155034e+05 4.921506e+05 5.915545e+05 8.459556e+05 7.577937e+04 4.225139e+05 8.895452e+05 8.715128e+04 2.302779e+05 9.367692e+05 1.207481e+06 2.576141e+05 2.602709e+05 5.881719e+05 6.570486e+05 3.352938e+05 4.625662e+05 7.433954e+05 2.579545e+05 4.229490e+05 9.557057e+04 7.954470e+05 1.069361e+06 4.177030e+05 2.782280e+05 8.502801e+05 4.854968e+05 5.329207e+05 9.163538e+04 3.370389e+05 4.750398e+05 7.672805e+05 6.845322e+05 2.577314e+05 7.137660e+05 9.477943e+04 1.308117e+06 1.150127e+05 1.494408e+05 9.816891e+05 9.852685e+05 1.030333e+05 9.175188e+04 6.897556e+04 7.126147e+05 3.453138e+05 1.568385e+06 7.843697e+05 2.280018e+06 1.438698e+05 9.877244e+04 8.153649e+05 1.386295e+05 5.975190e+05 2.373147e+06 1.504445e+05 1.452106e+06 2.758980e+06 2.044616e+06 3.309277e+05 1.600683e+06 5.786788e+05 2.237285e+05 6.541111e+04 1.655093e+05 4.528124e+05 9.321370e+05 1.068839e+06 2.929274e+05 4.708647e+05 1.816238e+06 3.678555e+05 6.634870e+05 1.753065e+06 3.716491e+05 9.389478e+05 1.194707e+05 3.780328e+05 1.139525e+06 1.829287e+05 9.985627e+05 1.237074e+06 8.366647e+04 4.446375e+05 1.563699e+05 7.902058e+04 4.777434e+05 1.249566e+05 6.168994e+05 1.644314e+05 6.877951e+04 2.361712e+05 9.709514e+05 2.441214e+05 7.390723e+05 2.055904e+05 1.763443e+06 5.342223e+05 4.190869e+05 7.012226e+04 7.556825e+04 8.822850e+05 2.594877e+05 2.070540e+05 3.673996e+05 9.163879e+05 7.162217e+05 2.784588e+05 1.336903e+05 6.154650e+05 3.620370e+05 5.234949e+05 2.545499e+05 7.201335e+04 8.010013e+05 5.846759e+05 6.649368e+05 2.133206e+05 4.065369e+05 1.468669e+06 KYNURENATE 2.007002e+06 6.960313e+05 8.689544e+05 9.506064e+05 1.132931e+05 7.125116e+05 9.588045e+05 9.077685e+05 108512.57 8.341068e+05 8.602572e+05 8.532510e+05 124006.58 7.819152e+05 7.695367e+05 8.002313e+05 1.021447e+05 8.160290e+05 9.167911e+05 8.856858e+05 1.327503e+05 7.553376e+05 7.423369e+05 1.092892e+06 66851.629 7.927111e+05 8.324803e+05 7.365797e+05 1.025776e+05 7.422130e+05 1.147964e+06 9.082988e+05 94667.85 5.648871e+05 8.680377e+05 8.096695e+05 9.978881e+04 8.138631e+05 7.816558e+05 7.851341e+05 8.303261e+04 7.901730e+05 1.012762e+06 1.054897e+06 4.225826e+04 6.759319e+05 8.254004e+05 7.909119e+05 8.259725e+05 1.237758e+06 6.674743e+05 1.495490e+06 1.154287e+06 1.422311e+06 2.526013e+06 1.080431e+06 8.259392e+05 1.099554e+06 2.240540e+06 3.345537e+05 1.907336e+06 1.654939e+06 2.507859e+06 9.444431e+05 4.427568e+05 1.106496e+06 9.348685e+05 5.598327e+05 8.209525e+05 7.627056e+05 4.033993e+05 1.690188e+06 1.260743e+06 1.533886e+05 1.226719e+06 6.096959e+05 1.039733e+06 5.568798e+05 1.981355e+06 6.886769e+05 1.302603e+06 1.190184e+06 1.027069e+06 1.046214e+06 4.850888e+05 1.052060e+06 9.428480e+05 1.445678e+06 1.168349e+06 4.503598e+05 7.007393e+05 7.471253e+05 8.073300e+05 2.799247e+06 6.781733e+05 8.117628e+05 7.605836e+05 6.456560e+05 3.143837e+05 1.246386e+06 9.149218e+05 1.419636e+06 7.602567e+05 9.225106e+05 5.883500e+05 1.551413e+06 7.385658e+05 8.850651e+05 1.223589e+06 1.304330e+06 5.173432e+05 8.156310e+05 1.437715e+06 6.279573e+05 5.182873e+05 7.988823e+05 9.209332e+05 7.602804e+05 1.013017e+06 9.514942e+05 5.651086e+05 6.821087e+05 3.284272e+05 5.723936e+05 9.048627e+05 1.413457e+05 5.000225e+05 8.620134e+05 8.688331e+05 1.509477e+06 1.546537e+06 9.747671e+05 6.013161e+05 1.211784e+06 8.636975e+05 9.222205e+05 6.682978e+05 8.157856e+05 6.458893e+05 7.627683e+05 9.064391e+05 5.789233e+05 1.193367e+06 6.735394e+05 8.576213e+05 1.086318e+06 6.494336e+05 1.262703e+06 8.491723e+05 5.002882e+05 5.559263e+05 9.381266e+05 8.350432e+05 5.471542e+05 7.973397e+05 1.842377e+06 1.083319e+06 6.222125e+05 9.113534e+05 1.069013e+06 7.985158e+05 1.053282e+06 5.107354e+05 7.471491e+05 1.713130e+06 7.883711e+05 1.537527e+06 1.015481e+06 4.311379e+05 1.347637e+06 1.041797e+06 4.122520e+05 1.440440e+06 1.419756e+06 1.576125e+06 1.219765e+06 1.780723e+06 4.691326e+05 8.637629e+05 7.208215e+05 1.259251e+05 9.151000e+05 9.639902e+05 3.959727e+05 3.171148e+05 2.129316e+05 7.744600e+05 7.369267e+05 1.013801e+06 1.533957e+06 1.119563e+06 1.293219e+06 4.542016e+05 7.138190e+05 2.740828e+05 1.233948e+06 3.373484e+06 7.772132e+05 7.286061e+05 1.999306e+06 8.230394e+05 5.194175e+05 1.190177e+06 7.069269e+05 6.872527e+05 5.588961e+05 5.014257e+05 7.023208e+05 6.960777e+05 5.991580e+05 1.016327e+06 6.267625e+05 1.641718e+06 5.194831e+05 8.802737e+05 8.154078e+05 4.511779e+05 7.026729e+05 4.991312e+05 1.030130e+06 1.276162e+06 1.314099e+06 9.795970e+05 1.024346e+06 9.151806e+05 1.232820e+06 9.902218e+05 4.202911e+05 6.707956e+05 1.209214e+06 6.329942e+05 6.102971e+05 7.118730e+05 7.852989e+05 1.015338e+06 1.058328e+06 1.317149e+06 8.966888e+05 7.195170e+05 7.120845e+05 1.915890e+06 6.372094e+05 5.181657e+05 2.241523e+06 8.931354e+05 2.939736e+05 1.372187e+06 1.101911e+06 2.063851e+06 9.117647e+05 1.192995e+06 1.338484e+06 7.340270e+05 2.291607e+06 1.766480e+06 7.680851e+05 1.115318e+06 7.196237e+05 1.357642e+06 4.734391e+05 1.168257e+06 2.077063e+06 C25 H49 N5 O9_2.955 2.868759e+05 3.489599e+05 3.375511e+05 3.582310e+05 1.085246e+05 2.326255e+05 2.974937e+05 3.158895e+05 103871.28 4.214898e+05 3.412559e+05 4.172936e+05 146231.24 2.113374e+05 3.406591e+05 3.304184e+05 4.063709e+05 2.657744e+05 3.164363e+05 3.905165e+05 1.380606e+05 2.092383e+05 4.168383e+05 3.244072e+05 68048.637 3.399737e+05 3.326630e+05 2.896536e+05 9.360535e+04 3.435092e+05 3.489630e+05 3.470475e+05 80438.67 2.724917e+05 2.860892e+05 3.316623e+05 8.478581e+04 3.952980e+05 2.649784e+05 3.846997e+05 6.445442e+04 2.427819e+05 3.811802e+05 3.794135e+05 4.206524e+04 2.975162e+05 3.404781e+05 2.885643e+05 2.818443e+05 1.245916e+05 2.832265e+05 1.285331e+05 1.283758e+05 1.917323e+05 1.186690e+06 2.617217e+05 7.818483e+05 2.104072e+05 1.566402e+05 2.131579e+05 1.411224e+05 1.022634e+05 1.228969e+05 1.602592e+05 1.768119e+05 9.054110e+04 1.576870e+05 1.842487e+05 2.703924e+05 1.739236e+05 1.113025e+05 1.209907e+05 1.954856e+06 1.579217e+05 2.398803e+05 1.090347e+05 1.429420e+05 5.717569e+05 6.659026e+05 1.179935e+05 1.054852e+05 1.307888e+05 2.147619e+05 2.425100e+05 1.987423e+05 1.590019e+05 4.062927e+05 2.571864e+05 1.635983e+05 1.329690e+05 1.841182e+05 1.795384e+05 2.210564e+05 1.169681e+05 1.761866e+06 1.192332e+05 1.035675e+05 1.039566e+05 1.165669e+05 2.184120e+05 2.970886e+05 1.057170e+05 1.108824e+05 1.751750e+05 1.724124e+05 1.275484e+05 2.602322e+05 4.057364e+05 1.203242e+05 1.286511e+05 1.370416e+05 1.064887e+05 2.276373e+05 1.033036e+05 1.342609e+05 1.311132e+05 3.772784e+07 2.063300e+05 1.656274e+05 4.048485e+05 1.056658e+05 4.552829e+05 1.167581e+05 1.312688e+05 1.266142e+05 1.163215e+05 1.105779e+05 1.182203e+05 1.475648e+05 2.337990e+05 1.122253e+05 1.569322e+05 3.560708e+05 1.172454e+05 2.072670e+05 1.625823e+05 9.957072e+04 6.086598e+05 1.025394e+05 3.290762e+05 2.876821e+05 1.199673e+05 2.862339e+05 2.300298e+05 1.449976e+05 1.791529e+05 9.449794e+04 1.231465e+05 1.098594e+05 3.001196e+05 1.528663e+05 4.997145e+05 4.287241e+05 1.616705e+05 6.629617e+05 4.261367e+05 1.333999e+05 1.854372e+05 1.080035e+05 2.108017e+05 1.274599e+05 3.431835e+05 1.720557e+05 1.805112e+05 1.569332e+06 2.274610e+05 1.210637e+05 1.223851e+05 1.008487e+05 2.679951e+05 5.259894e+05 3.294876e+05 1.236032e+05 1.741310e+05 1.114238e+05 2.835450e+05 1.297092e+05 2.998606e+05 1.307213e+05 1.554255e+05 2.396933e+05 2.280726e+05 2.288907e+05 3.034594e+05 2.245267e+05 2.015301e+05 1.200178e+05 3.675612e+05 7.537420e+05 9.318916e+04 5.281611e+05 3.094687e+05 2.524633e+05 1.294631e+05 4.094722e+05 1.078236e+05 8.812856e+05 3.227900e+05 2.137030e+05 2.826928e+05 5.519347e+05 9.965007e+05 1.254716e+05 1.171948e+05 1.331952e+05 2.621920e+05 1.680376e+05 4.717642e+05 2.343397e+05 1.272181e+05 1.793374e+05 9.945810e+04 9.916380e+04 1.296719e+05 1.133077e+05 2.995901e+05 1.263290e+06 1.011856e+05 1.609037e+05 1.151429e+05 1.806712e+05 1.579798e+05 2.916458e+05 1.505795e+05 2.403060e+05 1.174632e+05 3.533416e+05 1.798572e+05 1.574344e+05 1.825177e+05 1.133663e+05 1.010770e+05 3.640560e+05 1.800574e+05 2.932084e+05 4.742761e+05 4.968058e+05 4.592959e+05 4.999351e+05 3.158083e+05 1.626892e+05 2.333755e+05 1.585164e+05 1.738205e+05 1.508922e+05 1.308544e+05 2.550837e+05 1.958391e+05 1.351885e+06 2.605194e+05 1.116538e+05 1.228184e+05 2.040112e+05 2.214678e+05 3.577048e+05 1.695948e+05 2.708743e+05 1.122875e+05 1.179707e+05 1.198803e+05 1.143538e+05 1.661643e+05 N-(3-acetamidopropyl)pyrrolidin-2-one_2.976 7.861434e+07 1.341389e+07 1.394366e+07 1.355546e+07 8.779302e+04 1.059683e+07 1.481817e+07 1.534209e+07 90035.05 1.268169e+07 1.522233e+07 1.281878e+07 107632.68 9.972812e+06 1.438232e+07 1.582277e+07 1.077706e+05 1.196931e+07 1.110723e+07 1.281263e+07 1.221505e+05 1.337669e+07 1.488474e+07 1.500320e+07 66571.460 1.304893e+07 1.343975e+07 1.221445e+07 8.609642e+04 1.269158e+07 1.374324e+07 1.512256e+07 70834.49 1.212729e+07 1.281494e+07 1.428921e+07 8.896825e+04 1.281537e+07 1.413566e+07 1.139006e+07 6.117508e+04 1.254187e+07 1.430560e+07 1.646262e+07 3.880335e+04 1.282923e+07 1.164654e+07 1.353605e+07 9.469125e+06 3.474282e+07 3.025442e+07 2.056761e+07 9.024920e+06 1.340853e+07 2.685212e+07 1.626592e+07 2.369427e+07 2.777309e+07 6.393324e+07 1.473886e+07 3.359002e+07 1.971810e+07 2.787013e+07 3.099155e+07 9.797008e+06 1.419720e+07 1.019209e+07 3.004562e+07 1.181408e+07 1.798501e+07 9.649151e+06 1.433416e+07 3.833920e+07 9.663640e+06 1.552934e+07 5.820380e+06 2.517501e+07 2.376457e+07 7.949190e+07 8.576215e+06 2.005750e+07 1.490841e+07 2.395680e+07 2.174397e+07 1.637493e+07 2.457473e+07 6.156440e+06 7.392020e+06 3.197098e+07 1.720267e+07 3.004445e+07 5.786468e+06 1.540148e+07 1.753534e+07 3.105877e+07 9.804157e+06 1.199160e+07 1.020196e+07 6.878048e+06 1.189461e+07 1.481982e+07 5.699179e+06 7.518068e+06 1.016136e+07 1.212097e+07 2.021568e+07 2.139037e+07 3.186524e+07 2.870847e+07 1.724686e+07 1.100485e+07 3.612010e+07 1.328640e+07 7.276414e+06 8.392289e+06 2.008835e+07 1.507658e+07 9.679878e+06 2.336331e+07 2.035157e+07 1.239832e+07 1.195327e+07 5.837924e+06 8.490968e+06 5.489041e+06 1.906782e+07 2.628673e+07 8.090492e+06 1.242734e+07 1.569510e+07 1.708750e+07 4.008300e+07 1.616859e+07 1.618958e+07 1.118911e+07 8.787650e+06 1.757959e+07 7.228383e+06 7.666518e+06 1.387635e+07 1.604923e+07 1.075410e+07 1.094753e+07 1.039720e+07 8.495301e+06 6.689665e+06 8.162475e+06 1.027338e+07 1.386947e+07 1.053662e+07 8.103306e+06 1.213100e+07 2.406076e+07 2.511530e+07 1.029322e+07 1.052190e+07 2.273809e+07 4.575929e+07 5.620366e+06 1.655061e+07 2.916663e+07 4.896481e+07 1.741454e+07 9.368986e+06 2.535153e+07 1.998380e+07 1.677575e+07 1.693150e+07 2.162037e+07 1.544643e+07 1.055826e+07 1.301192e+07 2.734614e+07 2.633897e+07 2.533537e+07 1.324333e+07 2.505571e+07 9.180090e+06 1.424584e+07 8.217834e+06 5.945736e+06 9.671084e+06 1.008820e+07 8.282674e+06 1.108574e+07 5.522603e+06 2.372318e+07 7.384019e+06 3.327862e+07 2.252684e+07 2.809014e+07 7.222731e+06 1.332761e+07 9.919295e+06 4.152071e+06 2.616321e+07 2.554589e+07 1.247550e+07 2.498784e+07 4.682721e+07 9.118169e+06 1.344401e+07 1.429902e+07 1.599242e+07 4.859988e+06 8.156124e+06 1.156321e+07 2.250734e+07 2.794866e+07 9.041658e+06 1.450904e+07 3.269157e+07 2.478634e+07 8.082820e+06 1.055028e+07 1.356241e+07 1.800168e+07 3.913432e+07 7.957463e+06 1.494748e+07 3.011119e+07 2.147542e+07 1.715259e+07 2.468221e+07 1.489983e+07 1.092590e+07 1.039109e+07 9.398520e+06 1.166590e+07 5.097080e+06 1.893967e+07 1.488211e+07 1.823413e+07 7.331499e+06 3.598012e+07 1.050717e+07 9.382964e+06 1.769081e+07 3.654546e+07 1.911640e+07 1.700653e+07 1.590717e+07 8.597787e+06 2.475276e+07 4.433056e+06 6.465381e+06 1.174725e+07 3.268622e+07 8.504795e+06 5.915437e+06 2.085700e+07 3.262398e+07 6.355531e+06 2.380675e+07 1.600130e+07 1.733718e+07 2.588071e+07 2.032758e+07 2.412466e+07 1.078769e+07 2.497114e+07 2.369466e+07 C6 H11 N O4_2.984 3.655050e+06 1.188011e+06 1.642246e+06 1.245995e+06 7.931731e+04 1.677402e+06 1.418174e+06 1.794461e+06 69700.21 1.479652e+06 1.710678e+06 1.407610e+06 78065.42 1.316924e+06 1.342639e+06 1.880369e+06 8.957111e+04 1.298816e+06 1.246490e+06 1.549706e+06 1.094668e+05 1.288749e+06 1.467643e+06 2.271094e+06 60789.657 1.049859e+06 1.280184e+06 1.428532e+06 7.219888e+04 1.555745e+06 1.731422e+06 1.595552e+06 64596.40 1.242493e+06 1.414339e+06 1.729987e+06 8.656542e+04 1.341362e+06 1.321097e+06 1.427126e+06 5.864036e+04 1.405731e+06 1.444928e+06 2.015381e+06 3.625804e+04 1.511720e+06 1.191129e+06 1.480235e+06 1.608212e+06 1.568665e+06 1.655571e+06 1.811151e+06 1.139668e+06 1.936953e+06 2.586555e+06 2.327960e+06 2.254470e+06 2.732470e+06 2.393975e+06 2.397594e+06 2.873099e+06 2.394308e+06 2.680079e+06 2.049223e+06 1.368528e+06 1.089698e+06 1.282254e+06 1.621101e+06 1.341503e+06 1.333077e+06 1.375955e+06 1.428883e+06 1.921673e+06 1.181259e+06 2.474658e+06 1.033425e+06 2.739822e+06 2.235056e+06 3.550292e+06 1.939698e+06 2.161712e+06 1.610957e+06 1.997646e+06 1.694592e+06 1.943351e+06 1.694785e+06 1.500903e+06 1.672977e+06 1.666954e+06 1.768038e+06 1.568994e+06 1.091965e+06 1.752739e+06 2.503358e+06 1.580485e+06 1.503790e+06 1.295734e+06 1.161254e+06 8.716708e+05 1.896592e+06 1.502872e+06 8.686066e+05 8.929717e+05 1.470299e+06 1.309955e+06 1.549436e+06 2.481606e+06 1.287940e+06 1.937084e+06 1.611640e+06 8.601216e+05 2.005356e+06 1.853309e+06 1.089105e+06 8.140336e+05 1.301349e+06 1.576265e+06 1.623567e+06 1.512254e+06 2.169050e+06 8.762379e+05 1.236466e+06 9.014381e+05 1.237358e+06 9.768884e+05 1.305781e+06 1.681866e+06 1.267471e+06 2.105098e+06 1.382134e+06 2.762808e+06 2.913120e+06 9.377537e+05 1.494349e+06 1.181737e+06 1.438087e+06 1.727981e+06 1.394440e+06 1.398391e+06 1.982869e+06 1.167670e+06 1.505778e+06 9.731368e+05 1.330807e+06 1.687569e+06 1.362763e+06 7.658747e+05 1.286400e+06 9.189151e+05 8.519793e+05 1.013809e+06 1.123967e+06 1.243187e+06 1.458462e+06 1.261216e+06 1.900494e+06 1.510856e+06 1.654739e+06 1.079731e+06 1.725972e+06 1.496944e+06 1.773162e+06 1.503173e+06 1.225737e+06 1.252669e+06 1.676679e+06 1.512642e+06 1.633775e+06 1.810941e+06 1.398080e+06 1.498398e+06 1.411034e+06 2.100051e+06 1.672698e+06 1.661678e+06 9.683950e+05 1.495071e+06 1.699880e+06 3.097364e+06 1.531235e+06 5.860595e+05 2.358869e+06 1.657364e+06 1.244178e+06 1.044932e+06 1.085050e+06 1.924439e+06 1.847849e+06 2.085044e+06 1.755756e+06 1.543112e+06 8.786679e+05 8.825256e+05 1.270402e+06 5.135944e+05 1.160269e+06 1.913610e+06 1.411891e+06 1.392569e+06 2.301672e+06 2.237366e+06 1.856870e+06 1.754574e+06 1.386983e+06 1.089126e+06 1.006794e+06 1.597839e+06 2.210724e+06 2.200994e+06 1.047082e+06 1.848492e+06 1.642028e+06 1.937777e+06 1.179389e+06 1.552215e+06 1.599956e+06 1.319795e+06 1.199242e+06 1.246437e+06 1.500484e+06 1.361349e+06 1.410697e+06 1.334483e+06 1.293497e+06 1.707786e+06 1.583218e+06 1.626308e+06 1.132466e+06 1.654318e+06 1.680809e+06 1.898485e+06 1.569691e+06 1.574371e+06 1.404619e+06 1.758349e+06 1.921722e+06 1.709849e+06 1.340007e+06 1.905090e+06 1.544855e+06 1.997752e+06 1.283117e+06 1.072489e+06 1.800582e+06 1.148075e+06 1.186955e+06 1.767262e+06 1.956276e+06 3.132152e+06 1.980749e+06 1.626729e+06 1.754712e+06 9.363621e+05 1.962191e+06 1.826773e+06 1.746438e+06 1.330223e+06 1.788510e+06 2.120573e+06 9.439615e+05 1.665743e+06 1.991369e+06 C12 H10 N4 O4 S_2.989 6.280035e+07 1.425167e+07 1.621643e+07 1.665438e+07 1.338639e+05 1.599281e+07 1.851583e+07 1.913833e+07 536307.82 1.670761e+07 1.594049e+07 1.708467e+07 1157476.00 1.497613e+07 1.691239e+07 1.835544e+07 2.916039e+06 1.556943e+07 1.503027e+07 1.643733e+07 1.379560e+05 1.689577e+07 1.735706e+07 1.968754e+07 82021.107 1.264342e+07 1.841141e+07 1.797369e+07 9.757752e+04 1.288618e+07 1.707696e+07 1.891924e+07 139888.28 1.550808e+07 1.617462e+07 1.705353e+07 1.437606e+05 1.634532e+07 1.591633e+07 1.772255e+07 8.561604e+04 1.632295e+07 1.595461e+07 1.908284e+07 1.674893e+05 1.597978e+07 1.478199e+07 1.722053e+07 1.111067e+07 2.787428e+07 2.138586e+07 1.198776e+07 1.643479e+07 1.923564e+07 3.754751e+07 1.266163e+07 2.585760e+07 3.214715e+07 3.045750e+07 1.573800e+07 1.878878e+07 2.454192e+07 1.993570e+07 3.191756e+07 8.116215e+06 1.318038e+07 2.003361e+07 2.220935e+07 2.688528e+07 2.714179e+07 9.059871e+06 2.440259e+07 1.650448e+07 1.127054e+07 3.099615e+07 1.068892e+07 2.413706e+07 2.355739e+07 8.528764e+07 1.827058e+07 1.689393e+07 1.758250e+07 3.859709e+07 2.073210e+07 3.608521e+07 3.672660e+07 1.421769e+07 3.741804e+07 3.259536e+07 5.326658e+07 1.808176e+07 8.934481e+06 1.992296e+07 3.398137e+07 2.351992e+07 1.637921e+07 1.322551e+07 1.117570e+07 5.475494e+06 3.266097e+07 2.524717e+07 7.940952e+06 1.269173e+07 7.430827e+06 2.480085e+07 3.097763e+07 3.093481e+07 3.478973e+07 2.346319e+07 2.315707e+07 1.192271e+07 3.689075e+07 1.974982e+07 8.989032e+06 7.976892e+06 2.383050e+07 2.086599e+07 7.196100e+06 3.074286e+07 2.633723e+07 1.139363e+07 1.977138e+07 1.918546e+07 9.601683e+06 1.706684e+07 2.709760e+07 2.803692e+07 1.476791e+07 1.485021e+07 1.702299e+07 2.024287e+07 6.285859e+07 1.745083e+07 1.628085e+07 1.728145e+07 1.182833e+07 1.586658e+07 1.266309e+07 1.865061e+07 2.547761e+07 1.514406e+07 1.419171e+07 9.654843e+06 1.898639e+07 1.537416e+07 6.980467e+06 3.655755e+06 9.887823e+06 7.922355e+06 1.064133e+07 1.490013e+07 2.068035e+07 2.943096e+07 2.922193e+07 2.035036e+07 3.492709e+07 2.693754e+07 3.187442e+07 1.502757e+07 1.495070e+07 2.299091e+07 2.737220e+07 2.638797e+07 2.095171e+07 2.386186e+07 2.617160e+07 2.642122e+07 1.429419e+07 2.511129e+07 3.159609e+07 1.954906e+07 2.183023e+07 2.419626e+07 2.468029e+07 2.365779e+07 7.123059e+06 3.930970e+07 1.935312e+07 2.776823e+07 4.172793e+06 1.662662e+06 1.341097e+07 4.426679e+07 8.025719e+06 3.977977e+06 1.248855e+07 3.637705e+07 2.974730e+07 4.714234e+07 2.444978e+07 3.986371e+07 4.457818e+06 8.699393e+06 1.884361e+07 1.570511e+06 2.031338e+07 2.470110e+07 7.390728e+06 3.594967e+07 3.155803e+07 6.243094e+07 1.131680e+07 4.015316e+07 3.122756e+07 1.764261e+07 8.178052e+06 1.604770e+07 3.254348e+07 2.641104e+07 1.368382e+07 1.846034e+07 2.694115e+07 3.831839e+07 1.799941e+07 1.024632e+07 2.033576e+07 2.493393e+07 2.922049e+07 1.117571e+07 2.768908e+07 2.346043e+07 1.749083e+07 2.815304e+07 3.033249e+07 1.694096e+07 2.052776e+07 2.692855e+07 7.036471e+06 2.379859e+07 2.453300e+07 1.213331e+07 1.062360e+07 1.488543e+07 1.315073e+07 3.709548e+07 1.999379e+07 2.213483e+07 1.388378e+07 3.366530e+07 1.509749e+07 1.877385e+07 1.142744e+07 9.512524e+06 3.977714e+07 1.142364e+07 1.573749e+07 2.869922e+07 3.437641e+07 3.437554e+07 1.041725e+07 1.155565e+07 2.382796e+07 1.187938e+07 2.869707e+07 1.790349e+07 1.382119e+07 3.600242e+07 2.267045e+07 1.779608e+07 3.167635e+06 3.509348e+07 2.466116e+07 742.81196_2.992 7.643790e+04 1.565202e+07 1.428661e+07 1.533206e+07 8.500914e+04 1.357725e+07 1.539811e+07 1.744818e+07 80685.22 1.398636e+07 1.502574e+07 1.705850e+07 84259.11 1.303604e+07 1.414309e+07 1.665934e+07 8.819474e+04 1.478083e+07 1.407289e+07 1.590683e+07 1.067140e+05 1.200757e+07 1.552453e+07 2.125613e+07 64053.672 1.214443e+07 1.466103e+07 1.342822e+07 5.914570e+04 1.412110e+07 1.626291e+07 1.788376e+07 77136.31 1.236019e+07 1.481509e+07 1.627261e+07 9.691490e+04 1.255843e+07 1.519219e+07 1.706712e+07 7.590016e+04 1.238906e+07 1.606807e+07 2.006857e+07 4.202794e+04 1.173665e+07 1.443944e+07 1.450689e+07 1.611953e+07 1.189013e+07 9.242846e+06 1.171266e+07 1.580423e+07 1.039402e+07 1.666179e+07 1.331274e+07 1.274925e+07 2.012546e+07 1.509556e+07 1.483117e+07 1.834525e+07 1.646992e+07 1.557472e+07 9.811185e+06 1.481365e+07 1.584786e+07 2.307158e+07 1.011559e+07 1.183149e+07 1.139487e+07 1.879181e+07 1.642314e+07 1.937625e+07 1.673270e+07 1.230627e+07 1.651302e+07 1.194328e+07 1.483057e+07 9.417884e+04 1.773751e+07 1.679660e+07 1.395558e+07 7.782775e+06 1.733726e+07 1.852421e+07 2.217035e+07 7.963533e+06 7.534902e+06 1.083152e+07 8.050129e+06 1.771740e+07 1.626659e+07 8.748536e+06 1.328762e+07 1.321657e+07 1.865315e+07 1.613974e+07 1.616943e+07 1.458131e+07 1.998676e+07 1.009613e+07 1.579925e+07 1.153555e+07 1.391601e+07 1.055141e+07 1.253313e+07 7.637972e+06 7.711807e+06 1.429502e+07 1.456260e+07 1.229269e+07 6.363817e+06 1.131079e+07 1.439090e+07 2.007269e+07 1.079694e+07 1.110392e+07 1.432025e+07 1.372218e+07 2.059947e+07 8.549002e+06 1.452281e+07 1.529466e+07 9.008118e+06 1.181113e+07 1.233893e+07 1.550315e+07 1.262067e+07 1.386715e+07 2.246015e+07 1.877241e+07 1.202101e+05 1.319999e+07 1.585333e+07 1.390586e+07 1.134580e+07 1.016710e+07 1.507956e+07 1.556983e+07 2.039647e+07 1.262992e+07 1.585293e+07 1.274744e+07 1.452458e+07 1.789970e+07 1.067081e+07 1.034978e+07 1.633856e+07 1.005438e+07 1.241774e+07 1.077811e+07 8.725432e+06 1.137106e+07 1.886467e+07 1.267225e+07 2.076515e+07 1.172342e+07 1.331419e+07 9.565367e+06 1.183544e+07 1.048085e+07 2.086725e+07 1.173666e+07 8.841199e+06 9.883784e+06 1.518991e+07 1.498440e+07 1.071007e+07 1.354868e+07 1.305594e+07 1.310355e+07 9.741180e+06 1.087577e+07 7.216260e+06 1.525921e+07 1.023776e+07 1.399798e+07 1.548215e+07 1.448491e+07 1.079830e+07 8.435323e+06 5.260199e+06 4.625153e+06 1.405702e+07 7.617661e+06 2.071090e+07 9.788556e+06 1.632308e+07 7.157378e+06 1.138806e+07 2.798440e+06 1.105208e+07 6.170380e+06 1.593153e+07 6.121957e+06 1.576056e+07 5.058918e+06 1.079744e+07 8.375995e+06 4.233111e+06 3.946817e+06 1.308805e+07 7.032410e+06 2.243508e+07 1.595802e+07 1.433757e+07 2.196653e+07 9.675698e+06 6.244821e+06 1.359812e+07 1.610112e+07 1.193047e+07 7.492853e+06 1.060523e+07 1.415049e+07 1.130210e+07 5.816866e+06 7.703327e+06 2.507785e+07 1.706533e+07 6.165722e+06 1.459568e+07 1.264930e+07 1.207307e+07 1.988858e+07 1.283701e+07 1.634318e+07 1.053751e+07 1.460284e+07 1.885301e+07 1.449242e+07 7.245126e+06 1.461271e+07 1.544569e+07 1.173666e+07 1.414869e+07 1.183632e+07 1.214498e+07 9.246668e+06 1.239162e+07 1.659179e+07 1.376924e+07 1.639557e+07 1.352848e+07 1.160163e+07 2.701008e+07 1.601903e+07 9.572730e+06 1.346926e+07 1.374860e+07 2.088307e+07 1.934076e+07 1.373201e+07 1.644268e+07 1.352713e+07 1.748455e+07 1.300546e+07 1.570471e+07 6.585836e+06 7.888966e+06 1.625910e+07 1.251279e+07 139.02316_2.994 2.586165e+06 5.356930e+05 6.447340e+05 6.859402e+05 1.123584e+05 4.445190e+05 6.029106e+05 7.097503e+05 101825.56 5.396543e+05 6.175691e+05 7.753211e+05 117928.08 5.611951e+05 5.284299e+05 6.011437e+05 1.067496e+05 5.276121e+05 6.069896e+05 4.692237e+05 1.283648e+05 5.830701e+05 7.209263e+05 7.394959e+05 70685.411 5.469267e+05 5.821846e+05 5.997624e+05 5.817722e+04 4.989568e+05 6.329589e+05 5.992639e+05 65439.28 5.206791e+05 8.179071e+05 5.414088e+05 8.456648e+04 4.835522e+05 6.309163e+05 6.442932e+05 6.963270e+04 5.936483e+05 4.906720e+05 8.324198e+05 4.431521e+04 5.582396e+05 5.935322e+05 4.970790e+05 3.735910e+05 9.368399e+05 9.768654e+05 4.051818e+05 6.200607e+05 5.604659e+05 1.429038e+06 5.026729e+05 1.131189e+06 1.334357e+06 1.128052e+06 6.114172e+05 6.776048e+05 8.850194e+05 7.953483e+05 1.070307e+06 1.572108e+05 5.723355e+05 7.899556e+05 6.153678e+05 1.058916e+06 9.626859e+05 3.376331e+05 1.036386e+06 7.349445e+05 4.351171e+05 1.321896e+06 2.750167e+05 1.084033e+06 9.162488e+05 3.622632e+06 6.082669e+05 5.773473e+05 6.557193e+05 1.351199e+06 7.691259e+05 1.598518e+06 1.505671e+06 5.802942e+05 1.615170e+06 1.434509e+06 1.890602e+06 6.433427e+05 2.273248e+05 7.017399e+05 1.206061e+06 8.788313e+05 6.022704e+05 4.159041e+05 3.580703e+05 2.183449e+05 1.252619e+06 1.080867e+06 1.892863e+05 4.485161e+05 1.889740e+05 7.730220e+05 1.159188e+06 1.082449e+06 1.533745e+06 7.417981e+05 9.332886e+05 2.836162e+05 1.435935e+06 7.316252e+05 3.056941e+05 2.782122e+05 1.012242e+06 6.425999e+05 2.003551e+05 1.137912e+06 7.975297e+05 2.987929e+05 6.066966e+05 7.191713e+05 2.517455e+05 5.374148e+05 9.811869e+05 1.036465e+06 6.446897e+05 4.342239e+05 5.585809e+05 6.518759e+05 2.179143e+06 8.792230e+05 5.966022e+05 5.801055e+05 3.789166e+05 7.599262e+05 4.704476e+05 5.927726e+05 9.768740e+05 5.115402e+05 6.056395e+05 3.427093e+05 8.263197e+05 5.420384e+05 1.558938e+05 8.776077e+04 3.855154e+05 3.127518e+05 3.638216e+05 4.673975e+05 7.728689e+05 1.246787e+06 1.156462e+06 7.567410e+05 1.286956e+06 9.007621e+05 1.116042e+06 5.230781e+05 5.266267e+05 9.107549e+05 7.859153e+05 1.089128e+06 8.921664e+05 7.141786e+05 8.683714e+05 8.748496e+05 3.882801e+05 9.373776e+05 1.149738e+06 6.491018e+05 7.245697e+05 8.101476e+05 9.707964e+05 1.057982e+06 1.767339e+05 1.185602e+06 6.877122e+05 1.149600e+06 1.023047e+05 1.582125e+05 5.928319e+05 2.141446e+06 2.996476e+05 1.028012e+05 4.233515e+05 1.374164e+06 1.121874e+06 1.797272e+06 8.900589e+05 1.620705e+06 9.397721e+04 2.941146e+05 7.173365e+05 1.908322e+05 7.067421e+05 9.419225e+05 1.172444e+05 1.220613e+06 1.417170e+06 2.264850e+06 4.324870e+05 1.605477e+06 1.131863e+06 6.075740e+05 2.973917e+05 6.038906e+05 1.263430e+06 1.177306e+06 5.348349e+05 6.521043e+05 1.062934e+06 1.423367e+06 7.160302e+05 4.222952e+05 7.105911e+05 1.162403e+06 1.508681e+06 4.553575e+05 1.091958e+06 8.845906e+05 5.868217e+05 1.185694e+06 1.031559e+06 6.480875e+05 5.749192e+05 9.564373e+05 1.745290e+05 8.405762e+05 8.694407e+05 4.874174e+05 2.968914e+05 4.138438e+05 5.187772e+05 1.428753e+06 5.074419e+05 8.189076e+05 4.543585e+05 1.176163e+06 4.721020e+05 5.605353e+05 3.210731e+05 3.735202e+05 1.499405e+06 4.178312e+05 6.973891e+05 9.644822e+05 1.351926e+06 1.535571e+06 3.846063e+05 2.991517e+05 8.369010e+05 3.449598e+05 1.145977e+06 7.145001e+05 4.723974e+05 1.354508e+06 7.385396e+05 8.047131e+05 9.466116e+04 1.407234e+06 9.354139e+05 C4 H5 N O_2.994 1.066000e+07 4.712664e+06 4.481902e+06 4.741733e+06 9.046603e+04 4.865999e+06 5.362214e+06 5.504091e+06 86037.15 4.490154e+06 4.529040e+06 5.423454e+06 90461.47 4.571630e+06 4.443581e+06 5.048247e+06 3.652024e+05 4.613233e+06 4.953617e+06 5.370677e+06 1.663812e+05 4.223712e+06 4.899512e+06 5.191476e+06 251411.312 4.275695e+06 5.404349e+06 5.117321e+06 5.485179e+04 4.058033e+06 4.848893e+06 5.913153e+06 68949.84 3.983047e+06 5.042266e+06 5.247171e+06 9.072117e+04 4.291874e+06 4.898901e+06 4.345529e+06 7.517968e+04 4.514699e+06 5.229080e+06 6.018314e+06 3.748271e+04 4.343884e+06 4.292247e+06 5.021827e+06 4.112858e+06 6.189203e+06 3.615534e+06 5.041376e+06 4.937633e+06 5.025868e+06 9.105758e+06 3.714048e+06 6.785891e+06 8.384982e+06 8.662007e+06 4.621343e+06 6.913633e+06 6.493251e+06 5.852326e+06 7.785176e+06 3.958788e+06 4.595384e+06 6.177646e+06 4.387221e+06 6.111692e+06 5.897259e+06 4.486564e+06 5.169481e+06 5.605196e+06 4.632147e+06 7.101480e+06 3.913967e+06 5.665119e+06 6.142270e+06 1.529461e+07 6.475789e+06 5.448645e+06 5.038554e+06 7.299853e+06 6.034591e+06 9.062449e+06 1.058302e+07 3.060499e+06 6.574549e+06 6.483970e+06 8.427046e+06 6.104145e+06 3.766880e+06 4.821544e+06 8.230161e+06 6.456924e+06 5.291973e+06 5.531612e+06 4.657866e+06 3.085718e+06 8.068052e+06 5.986271e+06 3.533136e+06 3.861478e+06 3.133579e+06 6.301435e+06 6.309962e+06 5.568709e+06 6.450889e+06 5.915707e+06 6.116267e+06 3.384706e+06 6.456420e+06 4.524049e+06 3.605136e+06 4.277715e+06 4.681273e+06 5.284263e+06 3.172822e+06 7.795044e+06 8.481152e+06 3.227072e+06 5.251867e+06 5.566871e+06 3.137511e+06 4.539737e+06 7.311665e+06 6.524078e+06 3.810282e+06 4.386889e+06 6.199406e+06 5.583210e+06 1.155689e+07 4.622736e+06 5.221127e+06 4.995218e+06 3.558631e+06 3.941879e+06 4.154370e+06 4.927987e+06 6.379784e+06 4.875004e+06 4.349294e+06 3.486863e+06 4.944960e+06 4.813361e+06 2.683967e+06 2.069595e+06 3.665874e+06 2.950525e+06 3.398854e+06 3.843733e+06 4.295542e+06 6.507137e+06 6.253488e+06 5.336447e+06 7.889038e+06 6.900213e+06 7.312787e+06 3.883334e+06 3.669936e+06 5.563955e+06 8.248655e+06 6.217432e+06 4.858263e+06 5.485478e+06 6.355034e+06 7.241657e+06 3.818079e+06 6.802615e+06 8.540927e+06 5.135590e+06 4.485567e+06 5.937453e+06 4.757068e+06 5.734146e+06 2.767786e+06 9.181411e+06 5.605537e+06 7.028469e+06 2.203222e+06 1.501737e+06 2.314889e+06 7.650178e+06 3.011570e+06 1.751668e+06 4.894086e+06 7.021178e+06 6.954692e+06 1.407894e+06 6.416615e+06 1.907076e+06 2.007949e+06 2.563844e+06 5.784326e+06 1.088150e+06 5.088004e+06 5.093332e+06 2.577322e+06 7.885192e+06 5.047354e+06 1.057840e+07 3.587685e+06 7.655390e+06 8.901323e+06 5.232770e+06 3.455511e+06 5.392812e+06 5.797571e+06 4.142645e+06 3.874254e+06 5.603416e+06 6.516319e+06 6.939827e+06 4.155889e+06 2.816206e+06 5.810149e+06 4.428145e+06 7.031849e+06 5.532156e+06 7.237174e+06 5.219009e+06 5.611076e+06 5.871139e+06 6.437172e+06 5.464351e+06 4.625595e+06 6.930551e+06 2.791991e+06 6.399719e+06 6.909975e+06 3.807542e+06 2.622894e+06 5.057088e+06 4.474095e+06 6.995686e+06 4.766036e+06 4.976987e+06 4.191940e+06 7.050862e+06 4.081957e+06 6.060847e+06 3.972075e+06 4.092835e+06 8.066418e+06 3.850944e+06 6.540934e+06 6.777581e+06 7.561748e+06 7.786182e+06 3.550567e+06 5.438193e+06 6.621307e+06 3.846409e+06 7.346815e+06 4.854039e+06 4.787326e+06 7.979258e+06 6.722023e+06 3.767360e+06 1.899392e+06 7.872198e+06 6.121337e+06 D-PYROGLUTAMATE 1.636712e+08 8.776302e+07 8.859364e+07 9.184753e+07 3.554795e+05 9.055345e+07 9.771583e+07 1.000175e+08 575155.61 8.681484e+07 9.255098e+07 1.012999e+08 1178381.98 8.367173e+07 8.817017e+07 9.764381e+07 4.014214e+06 8.555384e+07 8.962994e+07 9.336249e+07 4.053311e+05 7.915375e+07 9.987837e+07 1.169522e+08 196535.937 7.527472e+07 9.048878e+07 9.333080e+07 1.707310e+05 7.910422e+07 9.573944e+07 1.075096e+08 374491.15 8.006833e+07 9.159061e+07 9.735931e+07 4.462257e+05 8.049421e+07 9.304715e+07 1.028953e+08 4.212887e+05 7.825242e+07 9.522995e+07 1.106029e+08 8.017175e+05 7.645510e+07 8.529386e+07 9.604457e+07 7.958542e+07 1.119196e+08 8.702467e+07 9.224029e+07 9.599269e+07 9.678530e+07 1.692886e+08 8.580581e+07 1.209699e+08 1.639115e+08 1.422033e+08 9.110461e+07 1.265846e+08 1.251489e+08 1.066440e+08 1.366822e+08 7.631328e+07 8.526178e+07 1.189436e+08 8.976262e+07 1.117539e+08 1.059352e+08 7.875209e+07 1.310193e+08 1.048430e+08 8.791101e+07 1.181032e+08 7.925643e+07 1.036697e+08 1.107682e+08 2.670277e+08 1.097366e+08 1.000554e+08 9.735298e+07 1.262493e+08 1.138441e+08 1.609860e+08 1.824215e+08 6.170435e+07 1.136198e+08 1.128044e+08 1.421786e+07 1.154067e+08 7.102754e+07 9.472746e+07 1.338377e+08 1.239853e+08 1.044453e+08 8.995682e+07 8.926111e+07 6.022842e+07 1.517450e+08 1.089566e+08 6.858359e+07 7.220833e+07 6.460707e+07 1.060899e+08 1.258750e+08 9.787292e+07 1.142676e+08 1.126115e+08 1.133389e+08 6.781743e+07 1.165365e+08 8.804380e+07 7.491731e+07 7.818521e+07 8.412381e+07 9.258758e+07 6.502386e+07 1.399304e+08 1.458533e+08 5.954104e+07 9.899348e+07 9.744715e+07 5.300818e+07 8.288987e+07 1.234436e+08 1.265012e+08 7.143293e+07 8.701907e+07 1.178201e+08 1.100213e+08 1.871676e+08 9.030463e+07 9.730688e+07 9.194001e+07 6.478957e+07 7.627958e+07 8.047864e+07 9.775712e+07 1.313378e+08 8.576277e+07 8.640684e+07 6.743715e+07 9.190523e+07 9.259458e+07 5.497269e+07 4.368870e+07 7.551338e+07 5.516277e+07 6.540670e+07 7.366651e+07 7.328605e+07 1.169264e+08 1.388805e+08 9.448917e+07 1.452623e+08 1.147553e+08 1.236189e+08 7.436292e+07 7.479953e+07 1.028418e+08 1.585679e+08 1.039350e+08 8.986137e+07 9.918250e+07 1.202819e+08 1.330210e+08 7.448427e+07 1.206675e+08 1.427602e+08 9.422181e+07 8.711012e+07 1.040747e+08 8.359680e+07 1.098524e+08 5.206907e+07 1.599767e+08 1.057616e+08 1.311416e+08 4.242036e+07 2.626516e+07 4.688838e+07 1.266010e+08 6.293097e+07 3.211098e+07 9.559767e+07 1.316057e+08 1.198757e+08 1.530299e+08 1.124934e+08 1.073915e+08 4.426421e+07 5.069760e+07 1.024095e+08 2.126389e+07 1.017325e+08 8.657792e+07 5.058131e+07 1.385207e+08 9.515128e+07 1.857889e+08 6.636609e+07 1.267325e+08 1.596848e+08 9.275849e+07 7.083067e+07 1.030533e+08 1.019398e+08 7.302282e+07 7.269894e+07 1.005837e+08 1.066573e+08 1.267257e+08 8.088865e+07 6.301066e+07 1.091222e+08 8.433370e+07 1.146470e+08 1.152525e+08 1.256358e+08 9.063811e+07 1.041602e+08 1.142676e+08 1.114482e+08 1.024272e+08 8.936424e+07 1.295378e+08 5.434864e+07 1.121128e+08 1.231390e+08 8.181358e+07 5.253609e+07 9.474061e+07 8.742352e+07 1.271451e+08 9.058109e+07 9.122974e+07 7.696083e+07 1.251956e+08 7.606431e+07 1.087553e+08 7.442943e+07 7.613312e+07 1.437757e+08 7.258376e+07 1.209236e+08 1.318274e+08 1.317366e+08 1.384879e+08 7.710726e+07 1.009027e+08 1.209091e+08 7.445082e+07 1.380886e+08 8.935742e+07 9.599040e+07 1.351571e+08 1.158888e+08 7.377181e+07 3.669666e+07 1.528251e+08 1.124446e+08 C4 H9 N O2_2.995 7.155750e+06 1.944607e+06 1.727920e+06 2.085551e+06 7.897570e+04 1.757517e+06 2.044992e+06 2.092766e+06 80657.04 1.860387e+06 1.813813e+06 2.015774e+06 79972.70 1.955014e+06 1.883054e+06 2.039230e+06 8.679043e+04 1.920144e+06 1.783365e+06 1.888407e+06 1.355916e+05 1.603639e+06 2.124185e+06 2.461533e+06 70264.964 1.579364e+06 2.044989e+06 1.731661e+06 1.882438e+05 1.840912e+06 1.884536e+06 2.215130e+06 87396.55 1.748474e+06 1.935783e+06 2.091272e+06 2.894652e+05 1.709436e+06 1.873434e+06 2.195736e+06 8.872664e+04 1.689779e+06 1.883911e+06 2.351694e+06 4.057171e+04 1.526987e+06 1.864748e+06 2.017397e+06 1.010635e+06 1.140329e+06 1.252156e+06 8.106928e+06 1.309079e+06 1.742753e+06 1.243338e+07 2.401665e+06 3.603621e+06 3.256341e+06 3.450338e+06 1.804028e+06 2.290326e+06 9.003727e+06 6.149714e+06 1.808308e+06 6.571582e+06 2.276066e+06 1.585528e+06 1.682049e+06 2.773765e+06 3.643422e+06 6.900693e+06 4.201507e+06 3.552901e+06 7.783133e+05 1.456164e+06 8.475839e+06 5.874316e+06 1.100894e+06 5.209466e+06 2.261419e+06 1.783503e+06 3.169759e+06 1.553421e+06 1.065918e+06 1.470969e+06 1.105127e+06 7.234060e+05 1.853645e+06 1.391938e+06 1.138773e+06 1.616046e+06 1.159441e+06 1.726181e+06 1.064874e+06 2.169204e+06 1.122686e+06 2.489088e+06 1.634836e+06 9.467569e+05 1.063093e+06 1.828418e+06 3.774914e+06 1.189745e+06 1.147434e+06 1.353993e+06 1.638782e+06 1.283600e+06 5.497976e+06 1.118913e+06 1.269477e+06 9.579115e+05 2.479308e+06 1.593811e+06 1.887666e+06 1.297007e+06 1.027857e+06 1.458866e+06 1.265910e+06 5.134653e+06 1.718594e+06 1.732110e+06 1.498583e+06 1.371195e+06 1.020305e+06 1.038007e+06 9.933226e+05 7.912979e+05 8.756500e+05 1.427494e+06 1.209396e+06 2.440757e+06 1.542501e+06 1.229079e+06 1.579004e+06 1.673149e+06 1.200915e+06 1.542566e+06 1.378350e+06 1.851651e+06 1.094202e+06 1.363096e+06 1.923768e+06 1.322645e+06 1.173700e+06 2.608269e+06 1.341768e+06 2.226798e+06 2.199697e+06 1.135626e+06 8.319300e+05 1.157485e+06 1.553202e+06 9.727176e+05 1.525343e+06 2.251787e+06 1.454613e+06 2.192811e+06 1.156772e+06 6.534138e+06 5.204121e+06 1.125631e+06 2.314593e+06 6.104255e+06 1.235662e+06 2.176776e+06 1.616544e+06 7.095752e+06 3.041378e+06 9.443843e+05 2.704614e+06 1.120817e+06 1.015907e+06 1.450804e+06 1.356859e+06 9.992986e+06 1.107806e+06 1.963656e+06 6.666480e+05 1.511831e+06 4.032607e+06 1.160904e+06 8.707914e+05 1.246726e+06 1.190459e+06 1.180136e+06 7.559177e+05 3.228582e+06 1.266499e+06 1.390827e+06 6.458856e+06 3.021417e+06 9.022965e+05 1.192472e+06 2.203259e+06 8.988121e+05 1.438383e+06 1.376750e+06 1.551751e+06 1.605002e+06 8.632826e+06 1.220253e+06 1.593088e+06 1.437725e+06 1.180029e+06 7.306009e+05 4.924894e+05 9.655705e+05 1.680502e+06 1.724335e+06 2.881840e+06 1.274340e+06 2.001391e+06 1.796863e+06 8.442917e+05 8.801288e+05 1.335112e+06 7.100807e+05 1.737883e+06 1.550760e+06 1.068354e+06 1.686224e+06 4.284574e+06 1.159512e+06 1.004189e+06 1.422894e+06 1.035184e+06 1.536329e+06 9.576369e+05 2.046843e+06 4.618192e+06 1.976662e+06 1.037596e+06 1.307570e+06 1.020296e+06 1.397772e+06 1.199653e+06 9.268004e+05 9.507287e+05 1.313367e+06 1.605821e+06 1.600449e+06 4.481726e+06 1.161216e+06 1.506315e+06 7.741767e+05 9.437761e+05 1.630561e+06 5.816351e+06 2.635699e+06 3.425795e+06 1.814954e+06 1.638985e+06 1.968028e+06 1.615935e+06 1.569021e+06 1.333295e+06 8.713490e+05 1.057480e+06 1.585324e+06 1.031791e+06 5.749215e+06 1.589972e+06 C7 H10 N2 O3_2.995 3.960443e+06 2.182179e+06 1.994015e+06 1.877846e+06 9.171074e+04 1.418435e+06 1.888733e+06 2.079127e+06 111084.08 1.939136e+06 2.101740e+06 2.191327e+06 91279.38 1.650168e+06 1.874431e+06 1.986716e+06 1.012839e+05 1.686895e+06 1.849525e+06 1.958820e+06 1.206373e+05 1.686567e+06 2.239769e+06 2.302865e+06 70526.703 1.601771e+06 1.861700e+06 1.931603e+06 5.979557e+04 1.686597e+06 1.997960e+06 2.176402e+06 73024.48 1.833776e+06 1.885084e+06 2.022723e+06 1.010137e+05 1.696273e+06 1.908361e+06 2.126228e+06 8.090615e+04 1.733534e+06 2.038308e+06 2.048786e+06 4.374096e+04 1.666901e+06 1.958065e+06 1.936349e+06 1.809475e+06 2.377311e+06 1.973671e+06 1.927822e+06 2.053794e+06 1.744213e+06 3.791328e+06 2.010801e+06 2.201432e+06 3.926133e+06 3.188346e+06 1.714573e+06 2.477374e+06 2.445803e+06 2.159614e+06 2.703710e+06 1.547279e+06 1.786034e+06 2.786352e+06 1.574318e+06 2.526513e+06 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6.818026e+04 4.669763e+05 5.431096e+05 6.510124e+05 7.661181e+04 5.111914e+05 5.036034e+05 6.863998e+05 48405.803 3.568271e+05 7.047641e+05 5.280342e+05 3.663962e+04 2.998486e+05 5.558518e+05 6.037959e+05 50029.22 5.963772e+05 4.645283e+05 6.897462e+05 6.357787e+04 5.107673e+05 4.468168e+05 5.504033e+05 4.965276e+04 5.554955e+05 4.575211e+05 5.708637e+05 3.161654e+04 5.477136e+05 6.364006e+05 4.675122e+05 1.263765e+05 1.511672e+06 9.369072e+05 2.738037e+05 6.742078e+05 7.138352e+05 2.300902e+06 3.026591e+05 1.074157e+06 1.211383e+06 1.837093e+06 4.011624e+05 6.276725e+05 1.053253e+06 9.087988e+05 2.163858e+06 8.113910e+04 3.122600e+05 6.643068e+05 9.977402e+05 1.398403e+06 1.360012e+06 8.019060e+04 1.019467e+06 6.069566e+05 2.357845e+05 1.829954e+06 1.767224e+05 9.978333e+05 9.224333e+05 1.386201e+07 7.291852e+05 7.056706e+05 6.105295e+05 3.271621e+06 8.930004e+05 2.184731e+06 3.075222e+06 4.554084e+05 2.827879e+06 1.790144e+06 4.389254e+06 9.134054e+05 7.438407e+04 7.324857e+05 2.670836e+06 9.933413e+05 4.061078e+05 4.192081e+05 2.805229e+05 1.285657e+05 1.884834e+06 1.402516e+06 1.222282e+05 2.812301e+05 2.278165e+05 1.316167e+06 2.070758e+06 1.707431e+06 2.708081e+06 1.154545e+06 1.022621e+06 1.989950e+05 2.918120e+06 6.772066e+05 8.409162e+04 1.379084e+05 9.500826e+05 7.156669e+05 9.859402e+04 2.165581e+06 1.490187e+06 2.937941e+05 6.863553e+05 8.712879e+05 1.059582e+05 5.696243e+05 1.755572e+06 1.593763e+06 3.721238e+05 3.940249e+05 5.868109e+05 7.672979e+05 7.755372e+06 5.692002e+05 5.998308e+05 6.772790e+05 1.627081e+05 4.514290e+05 2.791707e+05 6.293413e+05 1.134343e+06 4.922393e+05 3.890263e+05 1.665069e+05 6.641653e+05 3.847140e+05 7.855654e+04 6.799236e+04 1.365078e+05 6.797469e+04 3.372461e+05 4.965676e+05 7.373889e+05 1.750170e+06 1.429696e+06 6.848515e+05 1.868376e+06 1.475923e+06 2.094853e+06 4.061782e+05 5.117315e+05 1.227238e+06 1.305474e+06 1.217265e+06 9.570717e+05 1.123737e+06 1.295391e+06 1.548037e+06 4.462609e+05 1.854180e+06 1.887970e+06 7.297560e+05 7.679088e+05 1.168900e+06 1.102133e+06 8.304138e+05 6.782396e+04 3.079836e+06 7.853300e+05 1.597060e+06 6.249281e+04 8.080624e+04 2.694474e+05 3.898359e+06 1.662224e+05 6.456247e+04 3.088649e+05 2.946211e+06 1.693374e+06 4.640785e+06 1.670211e+06 3.341888e+06 6.903294e+04 1.574436e+05 7.957029e+05 7.918984e+04 9.012495e+05 1.322081e+06 7.029391e+04 2.763142e+06 2.138289e+06 8.164511e+06 1.504318e+05 3.530516e+06 2.043790e+06 6.316738e+05 6.856216e+04 4.224403e+05 1.689858e+06 1.206226e+06 3.175309e+05 6.530066e+05 1.360304e+06 3.201975e+06 5.907404e+05 7.938650e+04 7.407467e+05 1.502078e+06 2.223076e+06 2.875532e+05 1.354849e+06 1.481838e+06 6.425726e+05 1.599201e+06 1.798046e+06 4.961344e+05 7.303611e+05 1.288065e+06 7.868150e+04 8.843753e+05 1.168259e+06 1.297591e+05 1.000202e+05 5.075388e+05 3.237009e+05 2.221449e+06 5.608700e+05 9.172093e+05 4.162968e+05 2.417643e+06 2.130130e+05 5.975687e+05 2.195594e+05 7.712942e+04 2.948422e+06 1.766998e+05 4.982242e+05 1.398928e+06 2.783130e+06 2.219890e+06 2.428813e+05 3.455995e+05 1.169411e+06 3.194175e+05 2.091618e+06 6.429053e+05 3.608532e+05 2.585236e+06 1.174699e+06 6.494162e+05 7.850376e+04 2.381995e+06 1.011564e+06 C9 H7 N3 O3 S_2.996 5.784964e+06 1.067912e+06 1.021990e+06 1.328433e+06 1.404930e+05 1.150771e+06 1.463867e+06 1.336420e+06 151083.06 1.203927e+06 1.352035e+06 1.057762e+06 165739.48 1.056810e+06 1.154836e+06 1.646264e+06 1.549305e+05 1.094438e+06 1.074641e+06 1.179430e+06 1.131282e+05 1.253992e+06 1.243884e+06 1.630072e+06 71512.845 8.620308e+05 1.209632e+06 1.374336e+06 6.219481e+04 9.238227e+05 1.238409e+06 1.245893e+06 71056.82 1.324196e+06 1.054162e+06 1.157875e+06 8.786988e+04 1.449797e+06 1.249838e+06 1.223769e+06 7.193487e+04 1.127572e+06 1.084462e+06 1.469834e+06 4.307086e+04 1.267330e+06 1.157576e+06 1.136901e+06 8.865466e+05 2.270884e+06 1.644354e+06 8.016152e+05 1.274248e+06 1.388516e+06 2.551337e+06 9.495017e+05 2.019875e+06 1.990587e+06 2.068578e+06 9.521916e+05 1.259136e+06 1.533781e+06 1.234372e+06 2.550924e+06 5.062076e+05 8.550349e+05 1.143690e+06 1.472405e+06 2.042068e+06 1.820653e+06 3.858357e+05 1.542252e+06 1.277497e+06 7.757843e+05 2.216725e+06 9.626663e+05 1.770618e+06 1.532004e+06 5.096699e+06 1.105970e+06 1.070276e+06 1.117758e+06 3.094609e+06 1.391693e+06 2.624175e+06 2.924528e+06 1.019304e+06 2.937650e+06 2.471993e+06 3.694199e+06 1.274085e+06 5.984353e+05 1.528531e+06 2.852233e+06 1.567752e+06 1.019743e+06 8.740276e+05 8.299083e+05 3.512271e+05 2.356509e+06 1.905463e+06 5.429049e+05 1.013354e+06 4.668436e+05 1.886096e+06 2.221709e+06 2.308671e+06 3.227521e+06 1.843225e+06 1.853784e+06 7.379417e+05 2.996444e+06 1.703179e+06 5.572957e+05 5.059658e+05 1.888858e+06 1.518415e+06 3.729314e+05 2.324889e+06 1.797394e+06 6.912324e+05 1.335216e+06 1.499359e+06 7.430262e+05 1.321180e+06 1.884657e+06 2.005653e+06 1.103086e+06 9.338829e+05 1.290201e+06 1.500664e+06 5.315795e+06 1.277672e+06 1.355954e+06 1.075653e+06 7.053451e+05 1.189432e+06 8.276820e+05 1.457831e+06 1.831007e+06 9.639255e+05 1.042158e+06 5.769050e+05 1.365934e+06 1.062499e+06 4.632591e+05 1.148613e+05 7.253769e+05 6.067917e+05 8.796686e+05 1.087497e+06 1.595880e+06 2.042681e+06 2.196031e+06 1.345013e+06 2.465400e+06 1.997502e+06 2.547826e+06 9.744592e+05 7.613930e+05 1.822923e+06 1.943440e+06 1.717092e+06 1.507093e+06 1.791830e+06 1.720441e+06 1.980966e+06 1.023127e+06 1.847650e+06 2.184685e+06 1.333049e+06 1.467410e+06 1.679021e+06 1.976886e+06 1.772441e+06 4.250215e+05 2.964254e+06 1.252730e+06 1.972530e+06 1.449802e+05 1.886722e+05 1.004088e+06 3.550464e+06 6.145927e+05 9.555329e+04 9.301571e+05 2.690446e+06 2.489636e+06 3.793181e+06 1.694819e+06 3.288079e+06 2.453031e+05 7.962650e+05 1.369952e+06 2.493926e+05 1.603079e+06 1.829986e+06 4.357172e+05 3.026766e+06 2.669428e+06 5.913044e+06 7.289657e+05 2.857719e+06 2.407825e+06 1.366425e+06 4.833571e+05 1.303634e+06 2.560320e+06 1.870989e+06 8.217844e+05 1.272076e+06 2.198454e+06 2.751886e+06 1.276865e+06 7.135899e+05 1.300545e+06 1.876413e+06 2.443130e+06 7.300197e+05 1.975656e+06 2.035420e+06 9.997052e+05 2.631250e+06 2.041562e+06 1.223860e+06 1.398263e+06 1.804956e+06 5.980155e+05 1.681447e+06 2.139094e+06 7.015882e+05 6.065041e+05 1.190549e+06 8.959708e+05 3.644878e+06 1.114843e+06 1.912818e+06 1.026487e+06 2.618185e+06 1.102938e+06 1.290434e+06 7.905543e+05 7.492557e+05 3.342453e+06 7.469225e+05 1.140110e+06 2.108601e+06 2.956409e+06 2.557338e+06 5.954843e+05 8.295730e+05 1.717176e+06 9.053951e+05 2.271347e+06 1.399258e+06 7.897229e+05 3.217487e+06 1.572381e+06 1.104211e+06 3.184013e+05 2.825293e+06 1.498537e+06 C5 H14 N O P3_2.997 8.760277e+06 3.668028e+05 5.708433e+05 6.111756e+05 8.658056e+04 4.706869e+05 5.858925e+05 7.037650e+05 66460.98 5.107504e+05 5.296114e+05 5.688325e+05 67376.23 4.737232e+05 4.664426e+05 5.930248e+05 6.585474e+04 4.669763e+05 5.431096e+05 6.510124e+05 7.399870e+04 5.111914e+05 5.036034e+05 6.863998e+05 46754.755 3.568271e+05 7.047641e+05 5.280342e+05 3.538990e+04 2.998486e+05 5.558518e+05 6.037959e+05 48322.80 5.963772e+05 4.645283e+05 6.897462e+05 6.140933e+04 5.107673e+05 4.468168e+05 5.504033e+05 4.795918e+04 5.554955e+05 4.575211e+05 5.708637e+05 3.053815e+04 5.477136e+05 6.364006e+05 4.675122e+05 1.263765e+05 1.511672e+06 9.369072e+05 2.738037e+05 6.742078e+05 7.138352e+05 2.425225e+06 3.026591e+05 1.074157e+06 1.573974e+06 1.837093e+06 4.011624e+05 6.276725e+05 1.053253e+06 9.087988e+05 2.163858e+06 7.837157e+04 3.122600e+05 6.643068e+05 9.977402e+05 1.398403e+06 1.439178e+06 7.745542e+04 1.019467e+06 6.069566e+05 2.357845e+05 1.829954e+06 1.767224e+05 9.978333e+05 9.224333e+05 1.341858e+07 7.291852e+05 7.056706e+05 6.105295e+05 3.271621e+06 8.930004e+05 2.060512e+06 3.075222e+06 4.554084e+05 3.151643e+06 1.790715e+06 4.767422e+06 9.134054e+05 7.184694e+04 7.324857e+05 2.662188e+06 9.933413e+05 4.061078e+05 4.192081e+05 2.805229e+05 1.241805e+05 1.884834e+06 1.388703e+06 1.222282e+05 2.812301e+05 2.200461e+05 1.316167e+06 2.136777e+06 1.707431e+06 2.891759e+06 1.154545e+06 1.022621e+06 1.989950e+05 2.867355e+06 6.772066e+05 8.122338e+04 1.379084e+05 9.500826e+05 7.156669e+05 9.859402e+04 2.165581e+06 1.490187e+06 2.937941e+05 6.863553e+05 8.712879e+05 1.059582e+05 5.696243e+05 1.766583e+06 1.756232e+06 3.721238e+05 3.940249e+05 5.868109e+05 7.672979e+05 7.670109e+06 5.692002e+05 5.998308e+05 6.772790e+05 1.627081e+05 4.514290e+05 2.791707e+05 6.293413e+05 1.134343e+06 4.922393e+05 3.890263e+05 1.665069e+05 6.641653e+05 3.847140e+05 7.587710e+04 6.567325e+04 1.365078e+05 6.565618e+04 3.372461e+05 4.965676e+05 7.373889e+05 1.750170e+06 1.461371e+06 6.848515e+05 1.788555e+06 1.475923e+06 2.181311e+06 4.061782e+05 5.117315e+05 1.324576e+06 1.305474e+06 1.217265e+06 9.570717e+05 1.123737e+06 1.295391e+06 1.548037e+06 4.462609e+05 1.854180e+06 1.887970e+06 7.297560e+05 7.679088e+05 1.168900e+06 1.102133e+06 8.304138e+05 6.551059e+04 3.127940e+06 7.853300e+05 1.597060e+06 6.036128e+04 7.805006e+04 2.694474e+05 4.426069e+06 1.605529e+05 6.236034e+04 3.088649e+05 2.877210e+06 1.693374e+06 4.807986e+06 1.670211e+06 3.277120e+06 6.667833e+04 1.574436e+05 7.957029e+05 7.648880e+04 9.012495e+05 1.322081e+06 6.789629e+04 2.705350e+06 2.023925e+06 8.252427e+06 1.504318e+05 3.608355e+06 2.078224e+06 6.316738e+05 6.622361e+04 4.224403e+05 2.187275e+06 1.206226e+06 3.175309e+05 6.530066e+05 1.360304e+06 3.201975e+06 5.907404e+05 7.667875e+04 7.407467e+05 1.502078e+06 2.223076e+06 2.875532e+05 1.354849e+06 1.481838e+06 6.425726e+05 1.599201e+06 1.798046e+06 4.961344e+05 7.303611e+05 1.288065e+06 7.599779e+04 8.843753e+05 1.168259e+06 1.297591e+05 1.000202e+05 5.075388e+05 3.237009e+05 2.668149e+06 5.608700e+05 9.172093e+05 4.162968e+05 2.559170e+06 2.130130e+05 5.975687e+05 2.195594e+05 7.449866e+04 2.956876e+06 1.766998e+05 4.982242e+05 1.316070e+06 2.782023e+06 2.203991e+06 2.428813e+05 3.455995e+05 1.169411e+06 3.194175e+05 1.897452e+06 6.429053e+05 3.608532e+05 2.759957e+06 1.174699e+06 6.494162e+05 7.582612e+04 2.502234e+06 1.011564e+06 C6 H5 N9 P2_2.997 1.631012e+07 3.003650e+06 2.882665e+06 3.081588e+06 2.917925e+05 2.742385e+06 3.586448e+06 3.533634e+06 212126.41 2.986465e+06 3.151320e+06 3.211834e+06 188489.91 3.103262e+06 2.676858e+06 3.460864e+06 6.685188e+05 2.835484e+06 2.953356e+06 3.268823e+06 2.363888e+05 3.025410e+06 3.303113e+06 3.853810e+06 131174.074 2.393914e+06 3.104462e+06 3.198961e+06 1.103198e+05 2.489256e+06 3.451805e+06 3.322093e+06 130452.21 3.115076e+06 3.052873e+06 3.159465e+06 1.768579e+05 2.973803e+06 2.965619e+06 3.058831e+06 1.424529e+05 3.265110e+06 2.999447e+06 3.494180e+06 8.136826e+04 3.257816e+06 2.698451e+06 3.150445e+06 2.281691e+06 4.955111e+06 4.624298e+06 2.287499e+06 3.057865e+06 3.887316e+06 6.686113e+06 2.063161e+06 5.506217e+06 6.018210e+06 5.996385e+06 3.048822e+06 3.448760e+06 4.509097e+06 3.832762e+06 6.685542e+06 1.483667e+06 2.589385e+06 3.534416e+06 4.318464e+06 5.390040e+06 5.075997e+06 1.657107e+06 4.574976e+06 2.814422e+06 2.056110e+06 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3.339497e+06 9.765348e+05 2.649483e+06 4.080923e+06 2.747812e+06 1.460753e+06 2.321551e+06 2.094119e+06 1.133838e+06 6.621199e+05 1.969013e+06 3.341488e+06 2.726696e+06 2.644342e+06 1.836615e+06 1.884142e+06 4.814872e+06 2.240886e+06 2.227150e+06 1.867931e+06 2.201744e+06 2.230844e+06 7.226245e+05 2.767268e+06 4.183629e+06 2.076673e+06 3.590515e+06 3.938704e+06 1.348776e+06 1.726941e+06 2.775082e+06 1.652651e+06 2.380819e+06 2.685063e+06 7.996092e+05 3.026352e+06 2.028072e+06 1.888764e+06 3.442132e+06 2.238332e+06 3.427572e+06 2.370034e+06 2.417050e+06 3.330975e+06 1.287295e+06 1.110495e+06 8.179823e+05 2.521095e+06 1.162430e+06 9.532124e+05 1.342409e+06 4.101740e+06 4.559616e+06 1.785737e+06 5.172912e+05 2.827158e+06 1.901106e+06 6.351479e+06 3.231091e+06 1.295509e+06 4.459179e+06 2.861272e+06 3.425878e+06 6.870519e+05 3.410809e+06 4.247213e+06 "(7Z,17Z,21R)-27-Amino-24-hydroxy-24-oxido-19,23,25-trioxa-24lambda~5~-phosphaheptacosa-7,17-dien-21-yl (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoate_3.118" 1.571353e+07 2.145792e+07 1.820584e+07 1.860530e+07 1.795813e+05 7.853667e+06 1.753257e+07 2.389930e+07 167797.81 1.483551e+07 2.179033e+07 1.074594e+07 165285.63 1.344199e+07 2.061339e+07 1.882667e+07 1.463566e+05 2.190409e+07 1.006316e+07 1.978849e+07 2.073157e+05 1.896990e+07 1.566463e+07 1.711244e+07 95798.874 1.796433e+07 1.736217e+07 1.528072e+07 1.059073e+05 1.601726e+07 1.733651e+07 2.228044e+07 101335.29 1.620338e+07 1.894394e+07 1.665417e+07 1.527709e+05 1.637646e+07 1.617856e+07 1.411374e+07 9.009420e+04 1.884965e+07 1.559019e+07 1.928536e+07 6.040115e+04 1.920804e+07 2.022679e+07 1.369027e+07 1.457701e+07 1.786783e+07 1.191679e+07 2.358504e+07 1.243300e+07 1.269075e+07 2.038596e+07 2.445817e+07 1.659495e+07 2.522318e+07 2.684373e+07 1.944773e+07 1.491400e+07 3.038169e+07 2.693220e+07 3.151062e+07 2.628631e+07 1.679501e+07 1.299709e+07 9.503678e+06 1.929025e+07 1.777201e+07 1.940881e+07 2.320844e+07 2.912110e+07 1.217105e+07 1.465258e+07 1.221429e+07 1.271575e+07 1.716366e+07 2.360227e+07 1.346326e+07 2.077266e+07 1.801533e+07 8.335072e+06 2.780206e+07 7.562193e+06 1.444104e+07 2.394408e+07 1.779630e+07 1.182314e+07 5.882438e+06 1.892927e+07 1.342098e+07 2.242411e+07 1.286772e+07 1.950090e+07 1.423372e+07 1.635162e+07 1.271168e+07 1.252043e+07 7.715116e+06 1.843443e+07 1.904777e+07 8.090964e+06 7.867561e+06 2.193626e+07 9.628122e+06 1.660507e+07 1.644909e+07 1.184378e+07 1.115436e+07 1.180784e+07 2.252009e+07 2.585072e+07 1.147322e+07 1.448386e+07 2.163004e+07 1.477286e+07 1.359166e+07 1.197614e+07 9.202352e+06 1.254015e+07 1.102640e+07 9.536253e+06 1.612932e+07 1.736759e+07 8.322785e+06 1.569768e+07 2.310735e+07 1.605050e+07 8.330960e+06 1.090890e+07 2.657378e+07 1.251206e+07 2.875578e+07 1.354504e+07 1.612165e+07 1.355993e+07 1.284672e+07 1.156023e+07 1.310860e+07 2.355187e+07 1.069665e+07 2.107413e+07 1.867278e+07 2.204985e+07 1.038155e+07 8.105621e+06 1.203163e+07 1.016036e+07 1.461419e+07 1.622317e+07 1.042082e+07 1.509262e+07 9.328223e+06 1.875571e+07 1.397329e+07 2.064724e+07 1.653405e+07 1.535204e+07 2.571028e+07 1.092794e+07 1.936125e+07 1.420595e+07 1.192769e+07 3.006897e+07 1.767720e+07 1.790386e+07 1.380461e+07 2.041095e+07 1.255107e+07 1.614682e+07 1.944106e+07 1.457276e+07 1.402027e+07 1.298480e+07 1.228227e+07 1.977476e+07 1.477679e+07 1.371438e+07 1.738310e+07 8.819087e+06 1.759996e+07 1.596685e+07 1.014588e+07 1.799292e+07 6.048010e+06 1.957216e+07 9.044061e+06 4.511144e+07 2.265195e+07 1.377409e+07 1.543157e+07 1.423412e+07 9.507975e+06 5.933074e+06 6.830849e+06 1.625884e+07 1.014711e+07 1.027014e+07 2.220386e+07 6.789643e+06 1.295176e+07 1.548569e+07 1.304634e+07 1.666825e+07 6.441250e+06 1.446098e+07 1.446296e+07 1.567198e+07 1.872199e+07 1.174387e+07 1.027005e+07 1.984273e+07 1.413616e+07 2.386840e+07 8.945701e+06 1.609918e+07 1.767401e+07 8.054495e+06 1.127481e+07 1.987825e+07 1.496861e+07 2.715577e+07 2.209321e+07 1.305428e+07 1.722912e+07 1.605192e+07 1.396037e+07 1.589975e+07 2.104613e+07 8.729621e+06 1.232648e+07 9.226946e+06 1.983678e+07 9.422318e+06 9.435442e+06 2.396508e+07 1.167440e+07 1.136171e+07 2.406926e+07 1.837075e+07 1.493739e+07 1.081377e+07 1.675934e+07 1.189299e+07 8.322629e+06 1.141492e+07 2.431840e+07 1.280144e+07 1.603523e+07 7.027229e+06 1.338296e+07 1.769642e+07 2.909370e+07 1.875908e+07 8.611929e+06 2.475588e+07 1.354124e+07 2.214974e+07 1.082480e+07 1.627066e+07 3.050244e+07 C44 H70 N O8 P S_3.121 2.359090e+07 1.251882e+07 1.390872e+07 1.372772e+07 1.962550e+05 1.404380e+07 1.265204e+07 1.604543e+07 175525.14 1.507148e+07 1.547697e+07 1.179372e+07 168938.79 1.131521e+07 1.555578e+07 1.187049e+07 1.435129e+05 1.533543e+07 1.308253e+07 1.240330e+07 1.842491e+05 1.524551e+07 1.562947e+07 1.487797e+07 86367.095 1.342204e+07 1.195617e+07 1.545637e+07 1.086260e+05 9.961595e+06 1.642871e+07 8.456169e+06 107664.34 1.935559e+07 1.280749e+07 1.581912e+07 1.303570e+05 1.373769e+07 1.132511e+07 1.159143e+07 8.368909e+04 1.712227e+07 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1.241557e+07 1.252280e+07 173851.49 1.267494e+07 1.394379e+07 1.096367e+07 1.582213e+05 1.315081e+07 1.175138e+07 1.227637e+07 2.104630e+05 1.529868e+07 1.613409e+07 1.400378e+07 142657.035 1.072117e+07 7.148157e+06 1.668663e+07 1.359094e+05 1.062671e+07 1.559494e+07 1.124085e+07 128298.89 1.337057e+07 1.263591e+07 1.483428e+07 1.626675e+05 1.297783e+07 1.048086e+07 1.052462e+07 8.713292e+04 1.553733e+07 1.864065e+07 9.945360e+06 6.845182e+04 1.116818e+07 1.010614e+07 1.564887e+07 9.964311e+06 1.820520e+07 8.836078e+06 1.226686e+07 8.171368e+06 1.000952e+07 9.950479e+06 1.667158e+07 2.205127e+07 2.020083e+07 1.976999e+07 1.283009e+07 1.313227e+07 1.997247e+07 1.318896e+07 2.302950e+07 1.024727e+07 1.625011e+07 7.602023e+06 1.088372e+07 1.558769e+07 2.624961e+07 8.023316e+06 2.119643e+07 1.231715e+07 7.730796e+06 2.163807e+07 1.010944e+07 1.721228e+07 1.331815e+07 2.268926e+07 1.075920e+07 1.092880e+07 9.923651e+06 1.031692e+07 1.266849e+07 1.042499e+07 1.888226e+07 2.761619e+07 2.821881e+07 1.154556e+07 8.505950e+06 1.447757e+07 9.331703e+06 2.156935e+07 9.498583e+06 1.185101e+07 8.363639e+06 1.182782e+07 7.855054e+06 5.001872e+06 7.549701e+06 2.679751e+07 1.042471e+07 7.141415e+06 8.835675e+06 1.617270e+07 2.539249e+07 1.537361e+07 1.866547e+07 1.065628e+07 1.103888e+07 1.250584e+07 2.562178e+07 2.463868e+07 6.462045e+06 6.076566e+06 1.677651e+07 1.605090e+07 1.036062e+07 1.404761e+07 7.777006e+06 1.187149e+07 9.653800e+06 6.012198e+06 1.629174e+07 1.089453e+07 1.120516e+07 1.112041e+07 9.861351e+06 8.027743e+06 6.338976e+06 1.149947e+07 2.140185e+07 7.801206e+06 2.242356e+07 1.095890e+07 1.189012e+07 1.205884e+07 7.657780e+06 9.512603e+06 1.274830e+07 1.537048e+07 8.896194e+06 1.634230e+07 1.388424e+07 1.399405e+07 8.362272e+06 3.511541e+06 7.481752e+06 8.066484e+06 9.360608e+06 1.325205e+07 1.496699e+07 1.671494e+07 1.300950e+07 1.001218e+07 1.394919e+07 1.126852e+07 9.690450e+06 1.199982e+07 1.356567e+07 7.189014e+06 1.397407e+07 2.382561e+07 1.085894e+07 2.365629e+07 1.622967e+07 1.598712e+07 1.383219e+07 1.458700e+07 1.143246e+07 1.321080e+07 1.692617e+07 1.377819e+07 2.557935e+07 1.127917e+07 7.595588e+06 3.051356e+07 1.498674e+07 1.513604e+07 1.066296e+07 3.368888e+06 2.688665e+07 2.311958e+07 6.521383e+06 1.118756e+07 5.254154e+06 1.104567e+07 1.282324e+07 3.536546e+07 1.777922e+07 1.823769e+07 6.565816e+06 1.172434e+07 8.255608e+06 2.701830e+06 8.752640e+06 2.143676e+07 8.211673e+06 1.191435e+07 2.908013e+07 1.863407e+07 8.696097e+06 1.646627e+07 1.028413e+07 1.357233e+07 3.868832e+06 1.224329e+07 1.668031e+07 1.840347e+07 1.356113e+07 1.208421e+07 1.090878e+07 2.270621e+07 1.204639e+07 1.506592e+07 8.166159e+06 1.611798e+07 1.175997e+07 2.361719e+06 1.292551e+07 1.933704e+07 9.731028e+06 5.200641e+07 1.932942e+07 9.070212e+06 1.426202e+07 1.441701e+07 1.147668e+07 9.640804e+06 1.437137e+07 5.873377e+06 7.585960e+06 8.376923e+06 1.025547e+07 1.239428e+07 8.542951e+06 3.036060e+07 1.391899e+07 1.339699e+07 1.597198e+07 1.050718e+07 1.016316e+07 6.707268e+06 2.241894e+07 7.340292e+06 9.586463e+06 7.920548e+06 2.112730e+07 1.112454e+07 1.161807e+07 3.264446e+06 1.472394e+07 9.503251e+06 2.709672e+07 1.413904e+07 7.003030e+06 1.694061e+07 1.251995e+07 2.410514e+07 3.977553e+06 1.726644e+07 2.596283e+07 "(19R)-25-Amino-22-hydroxy-22-oxido-17,21,23-trioxa-22lambda~5~-phosphapentacosan-19-yl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-docosapentaenoate_3.127" 2.188904e+07 2.506872e+07 1.488726e+07 2.190151e+07 1.472637e+05 1.371861e+07 2.176330e+07 2.826724e+07 172430.32 8.624550e+06 2.386347e+07 8.272465e+06 169386.50 1.925335e+07 2.290363e+07 2.102466e+07 1.351681e+05 2.673369e+07 1.533583e+07 1.663028e+07 2.023800e+05 1.754885e+07 2.146370e+07 1.639340e+07 90496.420 2.005413e+07 1.712271e+07 1.753275e+07 1.032781e+05 3.117264e+07 1.283398e+07 1.977686e+07 120031.40 1.690937e+07 2.177831e+07 2.231401e+07 1.695726e+05 1.359032e+07 2.219635e+07 1.799920e+07 8.694810e+04 1.435597e+07 2.106896e+07 2.458737e+07 5.756490e+04 1.838053e+07 2.226676e+07 1.428987e+07 1.621631e+07 1.852404e+07 7.784962e+06 2.831281e+07 2.065468e+07 2.595797e+07 1.947230e+07 2.582442e+07 2.286948e+07 3.050895e+07 3.214812e+07 2.668218e+07 2.170858e+07 2.745763e+07 3.105100e+07 3.941190e+07 9.733255e+06 1.725547e+07 1.107751e+07 2.097256e+07 1.583757e+07 2.419387e+07 2.316098e+07 3.639709e+07 4.241038e+07 1.763030e+07 1.299834e+07 2.017238e+07 1.978233e+07 2.482404e+07 4.191097e+07 1.977680e+07 1.926538e+07 1.912042e+07 1.447998e+07 3.151789e+07 1.394520e+07 2.015280e+07 3.837369e+07 2.669372e+07 8.591934e+06 6.512643e+06 1.753706e+07 1.794322e+07 2.392158e+07 1.169209e+07 2.322419e+07 1.276342e+07 1.190327e+07 1.569079e+07 1.815054e+07 1.036586e+07 3.019821e+07 2.904872e+07 9.409936e+06 1.257470e+07 3.334800e+07 2.681280e+07 2.162586e+07 2.102755e+07 1.474399e+07 1.559535e+07 1.602596e+07 2.728880e+07 2.680959e+07 1.352246e+07 1.583155e+07 2.526775e+07 1.854366e+07 1.905837e+07 1.764908e+07 1.156642e+07 2.161808e+07 1.684117e+07 9.276602e+06 2.292184e+07 1.383298e+07 1.152755e+07 1.700175e+07 2.648533e+07 1.801484e+07 9.998907e+06 8.909457e+06 3.341702e+07 1.803366e+07 4.505569e+07 2.142630e+07 1.841272e+07 1.718053e+07 1.136405e+07 1.091068e+07 3.665976e+07 2.313881e+07 1.288437e+07 2.958176e+07 1.370153e+07 3.040467e+07 2.262265e+07 8.834983e+06 1.007135e+07 1.205604e+07 1.989985e+07 2.200846e+07 2.094063e+07 2.034745e+07 1.956252e+07 2.640172e+07 1.135801e+07 2.074820e+07 1.885281e+07 1.190723e+07 2.922002e+07 5.030949e+06 2.944018e+07 2.012822e+07 1.301120e+07 3.517094e+07 1.313380e+07 1.961549e+07 1.624572e+07 2.230447e+07 1.003855e+07 2.303928e+07 1.759428e+07 1.941559e+07 1.596695e+07 1.762371e+07 2.258896e+07 2.705164e+07 3.016191e+07 1.335070e+07 1.724542e+07 9.575738e+06 3.746160e+07 9.961020e+06 9.204443e+06 1.870335e+07 8.326344e+06 2.908040e+07 1.483850e+07 5.122482e+07 1.945909e+07 1.240349e+07 1.224709e+07 2.750536e+07 1.389919e+07 6.337929e+06 8.346246e+06 1.128392e+07 1.080785e+07 8.691721e+06 1.999951e+07 9.153712e+06 1.543908e+07 1.564072e+07 1.264240e+07 2.374709e+07 3.726101e+06 1.211582e+07 1.892911e+07 1.160866e+07 2.614240e+07 1.889351e+07 1.205262e+07 1.197499e+07 1.419976e+07 2.207111e+07 8.689516e+06 1.470568e+07 2.736136e+07 9.092274e+06 1.095020e+07 2.637714e+07 1.919452e+07 2.252083e+07 2.436844e+07 9.421112e+06 1.502831e+07 1.896652e+07 1.835652e+07 1.487849e+07 2.784301e+07 7.402963e+06 1.531924e+07 1.146344e+07 1.350100e+07 1.392195e+07 1.639267e+07 3.155948e+07 1.298363e+07 1.629990e+07 3.227027e+07 1.057552e+07 2.737985e+07 1.406462e+07 2.256409e+07 1.204254e+07 1.140534e+07 1.277070e+07 3.354105e+07 1.226807e+07 2.041190e+07 7.836612e+06 1.496989e+07 1.913670e+07 4.787026e+07 2.715793e+07 1.411895e+07 2.609548e+07 1.470632e+07 2.483230e+07 1.311892e+07 1.918037e+07 4.078611e+07 C37 H67 N5 O14_3.132 3.615770e+07 1.552689e+07 1.119146e+07 1.596604e+07 1.992992e+05 9.748526e+06 1.661211e+07 8.184548e+06 173555.50 1.568928e+07 1.413445e+07 1.330008e+07 154960.70 1.471893e+07 1.532635e+07 1.252115e+07 1.404571e+05 1.273670e+07 1.296995e+07 1.250478e+07 2.220020e+05 1.768060e+07 1.474931e+07 8.984648e+06 122057.779 5.948070e+06 2.132755e+07 1.462394e+07 1.080336e+05 9.205754e+06 1.533363e+07 1.331823e+07 103109.97 1.607741e+07 1.249710e+07 1.383274e+07 1.552631e+05 1.103914e+07 1.324952e+07 1.403342e+07 8.541141e+04 1.546381e+07 1.233816e+07 1.421035e+07 7.080660e+04 1.226033e+07 1.681477e+07 1.063247e+07 1.254737e+07 1.478260e+07 1.052142e+07 1.141995e+07 7.425237e+06 1.058705e+07 1.758239e+07 1.131187e+07 2.121411e+07 6.737529e+06 2.484671e+07 1.412432e+07 6.271250e+06 2.962738e+07 1.623229e+07 2.675657e+07 9.943587e+06 1.701257e+07 1.030381e+07 1.250342e+07 2.980997e+07 2.639984e+07 9.140244e+06 2.288622e+07 3.259260e+07 1.066264e+07 1.771417e+07 1.465969e+07 1.374169e+07 1.465174e+07 3.983676e+07 1.629627e+07 7.420068e+06 1.519728e+07 1.047025e+07 1.934389e+07 1.078569e+07 1.204510e+07 3.369428e+07 1.716678e+07 1.833248e+07 9.097872e+06 9.918290e+06 5.647027e+06 1.507077e+07 9.205112e+06 1.810583e+07 8.322147e+06 1.349142e+07 1.437496e+07 6.967966e+06 6.950861e+06 2.562312e+07 3.433250e+06 9.588743e+06 5.672624e+06 2.606606e+07 2.704137e+07 2.983023e+07 2.495519e+07 1.248810e+07 1.133954e+07 8.853035e+06 3.252837e+07 2.708851e+07 7.615790e+06 8.502201e+06 2.863593e+07 1.202985e+07 1.033244e+07 7.411375e+06 9.185224e+06 1.752212e+07 1.436941e+07 8.507802e+06 1.819170e+07 1.563217e+07 1.205297e+07 1.611233e+07 2.347308e+07 5.673722e+06 5.630833e+06 1.259944e+07 2.737078e+07 1.461666e+07 1.446526e+07 1.175947e+07 1.106222e+07 1.609231e+07 7.796046e+06 1.099815e+07 2.626454e+07 1.899767e+07 7.072558e+06 1.478077e+07 1.078760e+07 1.698084e+07 1.180358e+07 5.571271e+06 6.298916e+06 4.537446e+06 9.414215e+06 1.317189e+07 1.299820e+07 1.756619e+07 1.591482e+07 1.965154e+07 1.891196e+07 1.625848e+07 1.922196e+07 1.852125e+07 1.473654e+07 5.518486e+06 1.981111e+07 3.457791e+07 1.435859e+07 3.420321e+07 1.241484e+07 1.796721e+07 1.438738e+07 1.132540e+07 6.266260e+06 1.108952e+07 9.254914e+06 1.350008e+07 2.477772e+07 1.734304e+07 1.087205e+07 2.402192e+07 1.349882e+07 1.533424e+07 9.524416e+06 3.680407e+06 3.536019e+07 1.639446e+07 4.259393e+06 8.165421e+06 7.752264e+06 2.278396e+07 1.590007e+07 4.789096e+07 2.407591e+07 1.156631e+07 5.229732e+06 1.551002e+07 1.148364e+07 3.572229e+06 9.713604e+06 2.313255e+07 5.999568e+06 1.246969e+07 4.263319e+07 1.600127e+07 8.192300e+06 1.651658e+07 1.300707e+07 1.538593e+07 4.728272e+06 7.378438e+06 1.481713e+07 2.011616e+07 1.770907e+07 1.005036e+07 1.220480e+07 1.691292e+07 1.131290e+07 2.401986e+07 8.288806e+06 2.206752e+07 2.342485e+07 5.569919e+06 1.599809e+07 2.567440e+07 9.709875e+06 1.264031e+07 2.362553e+07 1.010588e+07 1.292681e+07 1.374115e+07 1.248163e+07 1.055622e+07 1.846680e+07 6.812424e+06 1.798561e+07 6.828580e+06 9.095992e+06 1.501536e+07 8.404003e+06 2.712980e+07 1.929137e+07 1.454194e+07 1.856198e+07 1.176384e+07 1.461708e+07 1.162134e+07 3.524300e+07 8.758310e+06 1.089331e+07 7.786723e+06 2.753448e+07 1.376965e+07 1.000026e+07 4.414383e+06 1.222055e+07 6.924281e+06 2.308232e+07 1.846440e+07 9.266464e+06 2.034378e+07 1.404022e+07 2.250649e+07 5.392568e+06 1.947928e+07 2.121737e+07 C38 H71 N9 O2 P2_3.15 9.333213e+06 7.841410e+06 6.374458e+06 7.386858e+06 1.385428e+05 6.159364e+06 8.185333e+06 8.414189e+06 141783.08 5.256382e+06 9.711247e+06 5.563688e+06 149640.15 6.547139e+06 6.595138e+06 8.758482e+06 1.300464e+05 6.091715e+06 7.279798e+06 8.639485e+06 1.814011e+05 6.692483e+06 6.427696e+06 6.147334e+06 96182.075 7.711721e+06 8.573703e+06 6.668449e+06 1.065217e+05 6.224285e+06 7.406509e+06 7.592943e+06 101372.13 7.761815e+06 5.731511e+06 7.617204e+06 1.478394e+05 7.439348e+06 7.403126e+06 8.111915e+06 7.397066e+04 6.218933e+06 6.279411e+06 7.784454e+06 4.873240e+04 7.722548e+06 6.410200e+06 7.508488e+06 3.265405e+06 9.019727e+06 6.372845e+06 1.733178e+07 8.019271e+06 6.889599e+06 9.875466e+06 6.624148e+06 9.202011e+06 9.584209e+06 4.212328e+06 5.145406e+06 5.683429e+06 1.103596e+07 1.011496e+07 1.430436e+07 7.793815e+06 5.113827e+06 6.164201e+06 5.152612e+06 1.056616e+07 1.055374e+07 8.383249e+06 1.036826e+07 6.146636e+06 6.304605e+06 7.951264e+06 7.759406e+06 5.572479e+06 5.920126e+06 1.196048e+07 6.435798e+06 6.187835e+06 6.713958e+06 4.305594e+06 9.923183e+06 5.423920e+06 8.336519e+06 9.260530e+06 9.064548e+06 5.846058e+06 4.070757e+06 9.284195e+06 7.524349e+06 1.102845e+07 5.008698e+06 7.702764e+06 5.509060e+06 5.322366e+06 6.434230e+06 4.897388e+06 5.690001e+06 6.676572e+06 5.140072e+06 4.435377e+06 5.862534e+06 1.116972e+07 6.386101e+06 4.067854e+06 7.808632e+06 3.815423e+06 7.300026e+06 5.089148e+06 8.311981e+06 7.745020e+06 5.184256e+06 4.882368e+06 7.032393e+06 6.958782e+06 3.860357e+06 6.176766e+06 4.180446e+06 8.456151e+06 8.844785e+06 3.344960e+06 9.047035e+06 6.483047e+06 6.615384e+06 6.877101e+06 7.808430e+06 7.652619e+06 5.810049e+06 5.039360e+06 1.598739e+07 7.598501e+06 1.085685e+07 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5.300187e+06 8.911257e+06 4.819141e+06 8.118271e+06 5.733437e+06 2.797491e+06 5.527493e+06 3.131563e+06 5.449903e+06 9.720077e+06 6.795282e+06 8.732103e+06 3.404097e+06 4.284942e+06 4.168734e+06 6.435589e+06 6.712401e+06 6.381769e+06 6.599261e+06 4.566668e+06 5.919027e+06 4.388799e+06 6.684981e+06 7.906139e+06 6.562122e+06 1.047427e+07 7.591000e+06 5.527693e+06 9.507362e+06 5.963638e+06 5.365575e+06 2.991408e+06 4.610892e+06 6.364196e+06 5.648411e+06 5.373435e+06 1.051922e+07 1.030985e+07 7.777422e+06 4.172188e+06 7.416471e+06 5.199721e+06 1.696740e+07 1.067725e+07 5.404691e+06 6.813148e+06 8.660209e+06 7.824852e+06 4.005464e+06 1.060555e+07 1.371757e+07 URACIL 3.585690e+05 3.905749e+05 3.079453e+05 3.278197e+05 7.634946e+04 3.727060e+05 3.677977e+05 4.147198e+05 78653.66 3.197913e+05 4.143573e+05 3.377919e+05 88500.61 3.215490e+05 4.038317e+05 3.636062e+05 8.519073e+04 3.107995e+05 3.411660e+05 2.953150e+05 1.166638e+05 3.154128e+05 4.449195e+05 3.609804e+05 69727.177 4.487856e+05 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5.200822e+05 6.659424e+05 118637.71 4.887391e+05 4.322321e+05 4.853249e+05 129078.06 3.940286e+05 4.945239e+05 5.108284e+05 1.087366e+05 5.032743e+05 5.140793e+05 4.754231e+05 1.595813e+05 4.246134e+05 4.779035e+05 5.264287e+05 85216.013 4.582445e+05 6.129012e+05 4.688127e+05 8.974223e+04 4.138113e+05 4.982896e+05 5.092845e+05 93481.88 4.636722e+05 4.734583e+05 5.074714e+05 1.632859e+05 4.873771e+05 4.773582e+05 5.450747e+05 8.254772e+04 3.919997e+05 4.570670e+05 6.456623e+05 8.164310e+04 4.091026e+05 4.760795e+05 4.876559e+05 7.457020e+05 3.955220e+05 3.636984e+05 5.800503e+05 2.247075e+05 2.237320e+05 8.899987e+05 7.674565e+05 4.252463e+06 6.358040e+05 2.374555e+06 6.950329e+05 3.403565e+05 3.958768e+05 7.194156e+05 1.475976e+06 3.313510e+05 2.183773e+05 6.972560e+05 5.763019e+05 3.144744e+05 4.533046e+05 1.294603e+06 1.838848e+06 4.957401e+05 1.566481e+05 5.204755e+05 1.513596e+05 2.763751e+06 2.447265e+05 5.424108e+05 1.760948e+05 1.420742e+06 2.938486e+05 4.158980e+05 4.457671e+05 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1.133720e+06 5.374257e+05 7.886856e+05 1.287543e+05 3.597466e+05 8.548285e+05 1.533945e+05 1.569498e+06 6.950324e+05 1.280360e+06 3.520214e+05 3.570011e+05 7.059300e+05 2.924175e+06 1.140982e+06 2.815154e+05 8.015797e+05 1.390712e+05 2.061391e+05 9.307406e+05 5.730496e+05 2.560441e+05 1.042261e+06 2.846659e+05 1-(1Z-hexadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine_3.199 2.051917e+07 2.154760e+07 1.667841e+07 1.774521e+07 1.302071e+05 1.495447e+07 2.136785e+07 2.472619e+07 138901.42 1.225148e+07 1.900377e+07 1.968624e+07 164522.69 1.646167e+07 1.780836e+07 1.772372e+07 1.437322e+05 1.790304e+07 1.890037e+07 1.744386e+07 2.123992e+05 2.037251e+07 2.138580e+07 1.633540e+07 121694.292 1.680414e+07 1.817694e+07 1.577961e+07 1.088100e+05 1.780144e+07 2.373173e+07 1.770418e+07 95380.21 1.704386e+07 2.210220e+07 1.473870e+07 1.609188e+05 1.896054e+07 1.795988e+07 1.393200e+07 8.254913e+04 1.951896e+07 2.079303e+07 2.396484e+07 6.130258e+04 1.699874e+07 1.382130e+07 1.962460e+07 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1.225985e+07 1.042895e+07 1.075221e+07 4.534479e+06 1.497174e+07 1.185812e+07 1.160117e+07 1.018565e+07 1.632054e+07 6.762823e+06 1.206625e+07 9.610656e+06 2.171071e+07 1.121278e+07 9.535419e+06 1.583747e+07 7.028920e+06 1.146149e+07 1.882071e+07 1.443082e+07 2.422509e+07 1.239920e+07 1.204587e+07 1.340692e+07 1.251513e+07 1.097878e+07 1.819424e+07 2.673024e+07 8.242488e+06 1.979348e+07 1.075698e+07 2.158886e+07 1.363730e+07 1.159908e+07 2.358057e+07 2.588081e+07 7.137986e+06 1.605363e+07 1.231710e+07 1.744824e+07 1.072995e+07 1.169326e+07 1.772835e+07 1.381246e+07 1.658805e+07 2.445211e+07 1.654625e+07 1.815967e+07 5.170811e+06 1.404371e+07 1.820208e+07 3.263072e+07 1.810537e+07 1.163201e+07 2.392349e+07 1.425595e+07 1.635116e+07 6.674163e+06 1.812431e+07 3.108183e+07 C35 H63 N5 O14_3.203 2.989087e+07 1.364036e+07 1.036314e+07 2.273671e+07 1.736521e+05 1.111174e+07 1.820677e+07 1.312940e+07 168101.73 1.821813e+07 1.718394e+07 1.138207e+07 171294.62 1.085320e+07 1.694794e+07 1.716647e+07 1.274003e+05 1.396715e+07 1.718752e+07 1.534407e+07 1.982596e+05 1.918787e+07 8.668109e+06 1.138675e+07 123074.456 1.818225e+07 1.546420e+07 1.425660e+07 1.078862e+05 1.368182e+07 1.848915e+07 1.946508e+07 96331.13 9.712281e+06 1.734537e+07 1.149955e+07 1.654486e+05 1.718839e+07 1.409392e+07 1.242720e+07 8.917860e+04 1.942329e+07 1.268875e+07 1.915882e+07 6.799528e+04 1.144808e+07 1.704671e+07 1.406217e+07 1.081026e+07 1.735764e+07 9.826795e+06 2.494270e+07 1.643737e+07 1.528586e+07 8.909294e+06 1.081504e+07 2.062125e+07 1.834017e+07 2.469034e+07 1.598314e+07 7.886769e+06 1.758632e+07 2.326742e+07 3.218547e+07 1.280123e+07 1.896891e+07 9.736330e+06 1.113194e+07 4.022036e+07 4.755538e+07 6.712763e+06 2.869535e+07 3.364764e+07 4.472332e+06 2.053009e+07 2.147069e+07 1.891392e+07 1.370995e+07 4.074066e+07 2.049951e+07 1.229265e+07 1.777194e+07 1.436725e+07 2.402652e+07 1.245155e+07 1.935317e+07 2.486059e+07 4.743502e+07 1.375658e+07 1.142064e+07 1.134617e+07 9.701140e+06 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9.090573e+06 1.448179e+07 1.459028e+07 8.137463e+06 1.787444e+07 1.939972e+07 1.194477e+07 3.017055e+07 1.624755e+07 1.506452e+07 9.180608e+06 4.004926e+06 2.395235e+07 1.550527e+07 5.901395e+06 4.440422e+06 5.554118e+06 1.906826e+07 1.439646e+07 4.355985e+07 1.833397e+07 2.073017e+07 1.045928e+07 1.760951e+07 8.889677e+06 2.645697e+06 8.205835e+06 2.172269e+07 4.018961e+06 8.487917e+06 2.410736e+07 2.155218e+07 1.123990e+07 1.388569e+07 5.599462e+06 1.691258e+07 4.414618e+06 8.942635e+06 1.377163e+07 1.643644e+07 1.685374e+07 2.162960e+07 1.103471e+07 1.735734e+07 1.120244e+07 1.295317e+07 1.203393e+07 1.368442e+07 2.216796e+07 4.912750e+06 1.419829e+07 2.771451e+07 1.135666e+07 2.943021e+07 1.787185e+07 6.514839e+06 1.294307e+07 1.113524e+07 8.232068e+06 1.499098e+07 2.026609e+07 8.023530e+06 1.318564e+07 8.128906e+06 1.456529e+07 1.053634e+07 9.835924e+06 2.898996e+07 1.694133e+07 1.158331e+07 1.196026e+07 1.224621e+07 1.328337e+07 5.418897e+06 2.104944e+07 1.058458e+07 8.555865e+06 1.351018e+07 2.814850e+07 1.383989e+07 1.080101e+07 4.099631e+06 1.368095e+07 1.198891e+07 2.889738e+07 2.273883e+07 9.290215e+06 3.009606e+07 1.091350e+07 1.478859e+07 4.126676e+06 2.118642e+07 2.946762e+07 C40 H73 N9 O5 S_3.232 4.600562e+06 1.897891e+06 2.142237e+06 1.872102e+06 1.294063e+05 1.816581e+06 1.997437e+06 2.455174e+06 155595.63 1.538132e+06 1.788491e+06 1.991990e+06 156181.20 1.967458e+06 1.966602e+06 1.913241e+06 1.253803e+05 1.898904e+06 1.940741e+06 1.936374e+06 1.856321e+05 2.049488e+06 2.185196e+06 1.841504e+06 108263.823 1.923057e+06 1.695896e+06 1.763012e+06 1.024775e+05 2.011723e+06 1.942579e+06 2.479597e+06 101829.03 2.011778e+06 1.703453e+06 1.786151e+06 1.279265e+05 1.832685e+06 1.969894e+06 1.927966e+06 7.663784e+04 1.934259e+06 2.060016e+06 2.309133e+06 5.343777e+04 1.825293e+06 1.621553e+06 2.059332e+06 1.063290e+06 4.897533e+05 3.364885e+06 7.850673e+05 5.575626e+06 7.567177e+05 1.521054e+06 1.417659e+06 5.901435e+05 7.306752e+05 5.619129e+06 1.425147e+06 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5.894536e+06 1.781457e+05 6.488747e+06 6.493812e+06 6.624325e+06 160161.31 6.226383e+06 8.078907e+06 4.592450e+06 193267.07 6.016075e+06 7.590886e+06 4.430383e+06 1.767011e+05 4.879931e+06 5.892165e+06 6.187571e+06 2.011745e+05 8.286549e+06 6.580165e+06 5.943022e+06 72177.951 4.639756e+06 7.766240e+06 5.851919e+06 1.078252e+05 5.832330e+06 6.005328e+06 6.310893e+06 113917.63 6.971266e+06 5.117603e+06 6.167192e+06 1.700900e+05 7.836701e+06 5.324844e+06 4.083932e+06 1.233042e+05 7.697119e+06 6.209575e+06 6.917707e+06 7.391590e+04 6.116364e+06 6.033624e+06 6.124230e+06 4.460881e+06 1.146534e+07 5.825705e+06 1.124445e+07 4.443392e+06 5.028830e+06 7.212842e+06 8.515878e+06 8.521042e+06 1.160344e+07 6.125446e+06 8.535862e+06 3.920449e+06 7.512325e+06 1.425064e+07 1.239644e+07 5.210663e+06 8.407372e+06 3.640696e+06 5.123266e+06 7.833469e+06 1.571433e+07 5.209692e+06 1.072813e+07 9.389036e+06 3.376194e+06 1.084889e+07 6.372019e+06 5.251889e+06 9.816635e+06 1.232294e+07 7.135902e+06 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1.096472e+06 5.307914e+06 1.853861e+06 C8 H11 N2 P S_3.367 4.715264e+06 2.526250e+06 2.656959e+06 2.487190e+06 1.002008e+05 2.582277e+06 2.438924e+06 2.428940e+06 108713.93 2.503595e+06 2.624442e+06 2.500257e+06 121527.84 2.692743e+06 2.591317e+06 2.470303e+06 1.101324e+05 2.684687e+06 2.382613e+06 2.522605e+06 1.500802e+05 2.283724e+06 2.790866e+06 2.890765e+06 66984.828 2.157651e+06 2.395926e+06 2.897212e+06 1.080409e+05 2.484532e+06 2.494928e+06 2.603114e+06 85304.75 2.410062e+06 2.544621e+06 2.552786e+06 1.360720e+05 2.426904e+06 2.594891e+06 2.599390e+06 7.752093e+04 2.342756e+06 2.721440e+06 2.796534e+06 5.967034e+04 2.323478e+06 2.436870e+06 2.588217e+06 2.365878e+06 1.645724e+06 3.139220e+06 4.434901e+06 3.207303e+06 3.166122e+06 4.875589e+06 1.694509e+06 5.533377e+06 4.303850e+06 3.774864e+06 2.817416e+06 6.283914e+06 3.913640e+06 3.533190e+06 2.465384e+06 2.075573e+06 1.164033e+06 2.553120e+06 3.146779e+06 2.152060e+06 2.696512e+06 1.629037e+06 2.271551e+06 4.723252e+06 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1.539855e+07 7.119810e+06 2.237128e+07 1.208281e+07 3.096664e+07 8.489292e+06 7.995713e+06 1.785410e+07 5.396030e+06 1.563591e+07 5.433408e+06 6.556408e+06 1.210502e+07 1.518303e+07 6.050629e+06 9.447336e+06 1.423230e+07 8.518063e+06 5.639374e+06 7.954654e+06 6.276144e+06 1.880924e+07 6.355654e+06 8.282053e+06 5.893224e+06 9.292229e+06 2.351789e+07 1.542659e+07 3.211095e+07 1.507216e+07 9.013595e+06 4.939273e+06 2.152165e+07 6.060966e+06 1.016022e+07 5.448512e+06 1.765445e+07 1.000462e+07 2.557098e+07 1.671286e+07 1.528401e+07 1.363204e+07 8.150894e+06 2.526616e+07 1.071767e+07 6.899928e+06 1.871566e+07 1.813238e+07 1.187854e+07 8.122594e+06 9.892457e+06 5.956570e+06 1.075595e+07 1.586424e+07 1.307755e+07 4.112211e+06 9.031356e+06 1.101239e+07 1.320050e+07 7.525617e+06 1.553227e+07 1.463342e+07 C8 H12 N2 O2_3.452 3.345740e+05 1.131650e+06 1.339444e+06 1.495000e+06 1.700832e+05 1.759067e+06 2.098473e+06 2.260898e+06 149090.22 1.262313e+06 1.602206e+06 1.832610e+06 150650.93 1.091655e+06 1.710148e+06 1.869245e+06 1.420925e+05 1.025701e+06 1.782200e+06 2.073997e+06 1.880412e+05 8.951134e+05 1.660889e+06 2.560330e+06 75966.752 1.101035e+06 1.600314e+06 1.729126e+06 1.390589e+05 9.879101e+05 1.772982e+06 2.029238e+06 146953.45 1.091925e+06 1.859348e+06 1.848566e+06 1.843218e+05 9.758940e+05 2.068893e+06 2.058422e+06 1.218718e+05 8.128106e+05 1.917714e+06 2.212652e+06 7.256096e+04 8.191498e+05 1.512232e+06 1.784656e+06 1.804985e+05 2.489456e+05 1.978489e+05 9.194980e+05 2.145206e+05 5.849378e+05 1.785084e+06 1.185338e+06 9.003716e+05 1.730272e+06 4.301326e+06 3.800082e+05 1.168773e+06 1.722406e+05 1.608236e+06 7.138594e+05 7.102462e+05 3.770100e+05 6.482669e+05 4.112709e+05 6.217236e+05 3.933079e+05 2.002317e+06 1.579025e+06 2.374738e+06 4.816768e+05 5.152788e+05 8.475712e+05 1.971681e+06 2.024460e+05 1.895767e+05 5.625851e+05 5.376399e+05 3.343129e+05 4.208726e+05 1.095030e+06 4.805063e+05 3.205648e+06 2.040239e+05 8.032276e+05 2.542257e+06 1.042194e+06 1.641903e+06 3.999446e+05 2.166466e+05 8.291208e+05 1.594949e+06 2.865345e+05 3.598875e+05 2.924841e+05 2.037036e+06 9.273587e+05 9.410771e+05 2.033838e+05 1.749737e+05 7.924313e+05 2.109216e+05 2.584122e+05 1.965510e+06 1.973649e+05 7.068975e+06 1.474145e+06 1.200341e+06 8.582883e+05 2.812640e+06 4.458784e+05 1.293186e+06 1.719376e+05 1.276712e+06 1.891912e+05 1.042136e+06 2.718492e+05 7.194817e+05 2.647086e+05 6.976910e+05 9.283742e+05 9.586103e+05 9.151579e+05 1.379915e+06 3.318932e+05 3.184201e+05 9.856696e+05 5.265930e+05 1.619126e+06 2.292033e+05 1.673232e+06 1.885630e+05 1.460087e+06 8.471062e+05 4.168104e+05 6.527426e+05 5.094629e+05 2.887030e+05 3.288929e+06 6.396309e+05 5.317066e+05 1.341808e+06 6.189615e+05 4.282078e+05 9.870256e+05 1.371377e+06 7.404698e+05 1.442305e+05 7.536226e+05 1.153951e+06 4.263903e+05 1.679144e+05 9.403059e+05 3.468676e+05 5.682365e+05 4.675892e+05 1.147042e+06 2.261600e+05 1.873041e+06 5.800740e+05 2.274230e+05 9.746517e+05 9.580580e+05 2.995311e+05 5.683496e+05 1.274412e+06 2.041741e+05 3.222722e+05 1.697363e+05 5.458919e+05 2.369734e+05 9.981123e+05 5.618037e+06 7.121125e+05 5.095510e+05 4.852749e+05 1.762163e+06 4.388856e+05 1.583301e+05 2.857547e+05 8.095246e+05 6.624688e+05 3.668880e+05 3.944162e+05 9.672316e+05 1.827105e+06 6.381318e+05 1.015791e+06 1.468598e+06 3.060403e+05 2.824051e+05 2.097893e+05 4.002717e+06 2.658922e+06 4.834435e+05 3.197320e+05 1.097804e+06 3.262078e+06 1.661113e+05 1.335707e+06 1.880499e+06 1.491799e+06 1.126703e+06 1.338993e+06 1.182125e+06 4.595234e+05 3.640442e+05 8.665486e+05 2.197498e+06 1.591329e+05 5.867887e+05 1.140007e+06 1.609197e+05 2.941181e+05 1.748945e+05 2.334748e+05 1.274871e+06 3.142152e+05 3.099340e+05 1.016323e+06 5.296232e+05 2.696974e+05 2.888277e+05 1.023609e+06 3.938689e+05 8.954407e+05 3.910521e+05 3.426022e+06 6.817600e+05 6.100323e+05 9.710020e+05 2.021202e+05 1.992703e+05 3.486144e+05 1.243306e+06 7.908941e+05 4.184549e+05 2.426115e+06 4.396505e+05 8.126315e+05 5.021821e+05 2.350147e+06 7.525367e+05 1.582876e+06 1.187363e+06 6.181947e+05 6.822250e+05 1.480555e+06 1.628985e+06 7.531386e+05 2.108441e+06 1.598970e+05 2.192619e+05 8.633008e+05 4.017461e+05 7.845170e+05 8.825835e+05 3.644994e+05 2.016459e+06 C34 H61 N9 O11_3.458 4.432341e+06 1.237352e+06 1.072483e+06 9.409983e+05 1.512453e+05 1.217849e+06 1.143068e+06 1.376284e+06 144117.92 1.099685e+06 1.273244e+06 9.677952e+05 133787.24 1.337411e+06 9.723861e+05 1.198845e+06 1.180823e+05 1.017355e+06 1.166750e+06 1.233654e+06 1.563090e+05 1.383454e+06 1.288498e+06 6.705279e+05 66004.244 1.053300e+06 1.234394e+06 1.439479e+06 9.239357e+04 1.057471e+06 1.190733e+06 1.053270e+06 90814.87 1.197773e+06 1.089076e+06 1.090243e+06 1.142238e+05 1.325094e+06 1.024428e+06 1.285560e+06 7.767772e+04 1.099388e+06 1.145777e+06 1.360077e+06 4.962029e+04 9.918368e+05 1.155763e+06 1.127192e+06 5.185837e+05 6.924021e+05 6.229580e+05 7.317031e+05 7.842974e+05 5.736747e+05 1.447364e+06 1.792741e+06 1.764788e+06 1.171642e+06 2.675118e+06 8.084707e+05 2.272041e+06 2.439547e+06 8.827057e+05 1.456491e+06 6.315159e+05 3.477396e+05 7.480994e+05 9.146033e+05 1.003928e+06 1.475570e+05 9.870222e+05 9.615567e+05 7.487971e+05 9.989645e+05 1.468795e+06 6.650423e+05 4.380416e+05 2.143414e+06 1.422351e+06 4.269210e+05 2.170708e+06 6.252591e+05 1.014736e+06 6.209974e+05 6.417890e+05 9.171655e+05 1.426967e+06 1.657902e+06 1.033837e+06 8.096151e+05 1.231283e+06 6.031466e+05 8.590797e+05 1.911430e+06 5.530247e+05 1.410944e+06 1.002064e+06 5.463994e+05 1.801907e+05 8.882330e+05 1.512459e+06 2.327497e+06 9.495265e+05 5.012815e+05 4.012006e+05 1.180423e+06 6.255608e+05 1.721842e+06 2.035412e+06 1.041277e+06 1.046354e+06 1.500839e+06 1.551815e+06 1.398013e+06 4.189478e+05 8.136068e+05 7.191742e+05 2.591970e+05 8.399071e+05 3.251815e+06 8.820674e+05 6.184889e+05 1.190983e+05 1.423821e+06 4.620817e+05 1.341460e+06 1.738341e+06 1.113410e+06 1.390352e+06 5.179076e+05 2.469267e+06 2.057903e+06 1.280049e+06 5.827096e+05 5.990291e+05 3.700713e+05 1.985372e+06 1.268260e+06 1.350867e+06 6.989458e+05 1.345666e+06 1.604650e+06 1.171688e+06 6.015277e+05 1.455603e+06 4.551133e+05 5.620133e+05 1.147431e+06 5.191386e+05 1.310046e+05 7.840895e+05 5.294426e+05 1.774980e+06 2.302820e+06 9.897825e+05 1.084824e+06 7.240086e+05 1.446488e+06 1.204190e+06 1.698165e+06 6.223320e+05 1.398574e+06 1.118870e+06 1.958216e+06 6.262951e+05 5.540658e+05 1.573256e+06 1.083962e+06 6.607305e+05 1.135425e+06 3.820231e+06 7.356009e+05 1.161596e+06 1.622232e+06 1.031864e+06 1.218015e+06 1.160641e+06 1.055965e+06 2.145367e+06 5.192047e+05 1.277909e+05 1.073157e+06 2.171782e+06 4.190688e+05 9.356267e+05 1.372999e+05 2.961728e+06 7.037514e+05 1.143517e+06 5.926513e+05 9.610111e+05 5.381813e+05 1.299387e+05 2.803542e+06 4.241693e+05 1.365585e+06 2.278627e+06 8.939058e+05 1.286301e+06 1.490835e+05 1.275198e+06 6.686238e+05 2.240497e+06 8.093885e+05 2.576633e+06 5.642696e+05 3.124908e+05 1.054915e+06 4.817362e+05 1.563234e+06 7.021751e+05 4.157287e+05 9.374052e+05 1.030918e+06 1.452427e+06 4.768745e+05 9.811256e+05 4.565727e+05 3.593152e+05 7.635614e+05 7.442794e+05 5.277024e+05 7.492379e+05 4.991591e+05 9.838937e+05 2.639585e+05 2.193056e+06 8.567278e+05 2.796786e+06 1.282106e+06 1.405053e+06 1.843682e+05 1.076337e+06 3.043538e+05 5.584336e+05 3.282121e+05 2.140273e+06 7.075333e+05 1.231785e+06 2.053780e+06 1.111975e+06 1.196010e+06 3.189819e+05 2.962516e+06 8.208722e+05 2.917971e+05 1.671123e+06 2.047472e+06 5.408692e+05 9.635907e+05 2.271080e+05 5.434073e+05 1.115092e+06 2.788173e+06 9.529831e+05 9.106471e+05 5.813468e+05 1.285646e+06 1.730310e+06 6.914563e+05 5.416415e+05 5.563402e+05 C34 H73 N9 O3 P2_3.475 3.981126e+06 1.452286e+06 1.592306e+06 1.196925e+06 1.225145e+05 1.229393e+06 1.301451e+06 1.403683e+06 133500.79 1.300823e+06 1.669654e+06 1.373032e+06 124334.40 1.247646e+06 1.490217e+06 1.321728e+06 1.139350e+05 1.309460e+06 1.282594e+06 1.499716e+06 1.628294e+05 1.378011e+06 1.721803e+06 8.648856e+05 66237.167 1.275881e+06 1.318635e+06 1.500470e+06 8.907420e+04 1.597318e+06 1.291202e+06 1.494263e+06 89180.82 1.356401e+06 1.360504e+06 1.478477e+06 1.228003e+05 1.167274e+06 1.364894e+06 1.377045e+06 8.080980e+04 1.343239e+06 1.389274e+06 1.489717e+06 4.290155e+04 1.099761e+06 1.906885e+06 1.057384e+06 4.455878e+05 3.920855e+05 5.683097e+05 1.028389e+06 1.328046e+06 3.891435e+05 1.473361e+06 1.865903e+06 1.918605e+06 1.731216e+06 6.621060e+06 9.192192e+05 2.581439e+06 2.909190e+06 8.118721e+05 1.897999e+06 1.068488e+06 3.141324e+05 1.043179e+06 6.363557e+05 9.718498e+05 2.361040e+05 1.888868e+06 1.068399e+06 9.757746e+05 1.482913e+06 1.189841e+06 7.882108e+05 2.916270e+05 2.423976e+06 1.808220e+06 4.323415e+05 2.499045e+06 8.031951e+05 9.521976e+05 6.909423e+05 4.901361e+05 7.298603e+05 1.521831e+06 1.135191e+06 8.557215e+05 6.934324e+05 1.408596e+06 7.429979e+05 6.802018e+05 1.522744e+06 8.290769e+05 1.598096e+06 1.454791e+06 6.726362e+05 5.460521e+05 1.108106e+06 1.410302e+06 2.994720e+06 1.113890e+06 8.401470e+05 4.265497e+05 9.454928e+05 3.888795e+05 1.710869e+06 1.714848e+06 9.757223e+05 1.424399e+06 1.339534e+06 1.839840e+06 2.445578e+06 9.984779e+05 5.474700e+05 4.726814e+05 3.136405e+05 1.281419e+06 3.591702e+06 1.004017e+06 6.343512e+05 1.145280e+05 1.547193e+06 2.323652e+05 1.695815e+06 1.573022e+06 7.664953e+05 1.531949e+06 4.365346e+05 1.596067e+06 1.772436e+06 1.466335e+06 5.630100e+05 6.955995e+05 2.086525e+05 1.783777e+06 1.773572e+06 1.512004e+06 6.515125e+05 2.327669e+06 1.921967e+06 1.721874e+06 5.374604e+05 1.901228e+06 6.811118e+05 9.158729e+05 1.965681e+06 9.407795e+05 1.379735e+05 1.051700e+06 2.715006e+05 1.258986e+06 2.529080e+06 1.308290e+06 1.222162e+06 3.150391e+05 1.950563e+06 1.378359e+06 1.853831e+06 6.589739e+05 1.470609e+06 1.306801e+06 1.587938e+06 4.850253e+05 4.406112e+05 1.563995e+06 1.047540e+06 6.136423e+05 9.702616e+05 4.175510e+06 5.156896e+05 1.386584e+06 1.176111e+06 7.451590e+05 1.827636e+06 9.086048e+05 1.049817e+06 2.730700e+06 6.334152e+05 1.363735e+05 1.048623e+06 2.041908e+06 6.367045e+05 1.186949e+06 1.562454e+05 3.188425e+06 6.857624e+05 7.673658e+05 6.486710e+05 7.333595e+05 1.341313e+06 2.005951e+05 3.687532e+06 6.387119e+05 1.382809e+06 1.834974e+06 1.088907e+06 7.823290e+05 1.318630e+05 9.127714e+05 9.400566e+05 2.054936e+06 7.388698e+05 3.131715e+06 5.599863e+05 3.446822e+05 6.703363e+05 2.303238e+05 2.115976e+06 5.453502e+05 3.750944e+05 6.250440e+05 1.053527e+06 1.416601e+06 5.636547e+05 1.130862e+06 2.355582e+05 8.790421e+05 7.276031e+05 4.655166e+05 4.971697e+05 6.251342e+05 3.094716e+05 1.280712e+06 1.190982e+05 2.321576e+06 1.411568e+06 3.126559e+06 1.674209e+06 1.747507e+06 2.810229e+05 1.272374e+06 4.574390e+05 5.778546e+05 2.739370e+05 1.855794e+06 5.025134e+05 1.038463e+06 2.629821e+06 1.184369e+06 1.688586e+06 4.794777e+05 2.680220e+06 1.051396e+06 7.330117e+05 1.777889e+06 2.173949e+06 4.596292e+05 1.479305e+06 6.802554e+05 3.834069e+05 1.358625e+06 3.043323e+06 8.802117e+05 1.345677e+06 4.801253e+05 1.432361e+06 1.667538e+06 1.293333e+06 3.216903e+05 8.504472e+05 C7 H8 N2 O2_3.477 1.432161e+07 1.519333e+07 1.220603e+07 1.210064e+07 3.116156e+05 1.229135e+07 1.566069e+07 1.560113e+07 341721.76 1.197261e+07 1.244583e+07 1.427384e+07 377617.82 1.466469e+07 1.184710e+07 1.284351e+07 3.450818e+05 1.346929e+07 1.292691e+07 1.319588e+07 3.984366e+05 1.281322e+07 1.414614e+07 1.721337e+07 170559.323 1.267695e+07 1.321926e+07 1.242898e+07 3.059514e+05 1.209476e+07 1.254412e+07 1.476748e+07 286078.60 1.377955e+07 1.287073e+07 1.477412e+07 3.687720e+05 1.233246e+07 1.397689e+07 1.498117e+07 2.765189e+05 1.103487e+07 1.353566e+07 1.550997e+07 1.528402e+05 1.302490e+07 1.141159e+07 1.456265e+07 1.170145e+07 6.330139e+06 1.057312e+07 1.984211e+07 1.814880e+07 1.433330e+07 1.951826e+07 1.444613e+07 1.219805e+07 1.675295e+07 2.743710e+07 1.521072e+07 1.385242e+07 1.179601e+07 1.568958e+07 1.435947e+07 1.988071e+07 1.133292e+07 5.959859e+06 2.511447e+07 4.365993e+07 9.272454e+06 3.358880e+07 1.680381e+07 1.514868e+07 2.893526e+06 1.359314e+07 9.635520e+06 1.333671e+07 1.046739e+07 3.440537e+07 1.918050e+07 3.547054e+07 3.020810e+07 8.637578e+06 1.901222e+07 1.233795e+07 7.380825e+06 2.172081e+07 1.560392e+07 5.351119e+06 2.047564e+07 1.581567e+07 1.008651e+07 2.651164e+07 2.458096e+07 8.201484e+06 4.691156e+06 4.656732e+06 1.400151e+07 1.160356e+07 1.327066e+07 1.043787e+07 8.162376e+06 2.563346e+06 8.518605e+06 5.663951e+06 7.640576e+06 2.150423e+07 9.704922e+06 1.490953e+07 2.127621e+07 4.061033e+06 4.259334e+07 2.612674e+07 7.489355e+06 5.467130e+06 1.107251e+07 2.169317e+07 1.090784e+07 1.169417e+07 7.512045e+06 1.088240e+07 8.193844e+06 8.279444e+06 2.211879e+07 1.009220e+07 3.693063e+06 9.896799e+06 8.543401e+06 1.568939e+07 2.416315e+07 2.123779e+07 1.047552e+07 6.656899e+06 1.786926e+07 9.510482e+06 1.597520e+07 7.605620e+06 7.346201e+06 7.397078e+06 1.296831e+07 3.274841e+07 5.005852e+07 5.895282e+06 1.143574e+07 1.851359e+07 3.803676e+07 4.455388e+06 2.720649e+07 3.931677e+07 5.589664e+06 7.420014e+06 1.901305e+07 3.535821e+07 9.035971e+06 8.055826e+06 1.166080e+07 1.669401e+07 7.933575e+06 1.472147e+07 2.393981e+07 5.739824e+06 1.775121e+07 3.363874e+06 1.433902e+07 2.128918e+07 1.043799e+07 8.832152e+06 2.060880e+07 1.136741e+07 1.599960e+07 5.306938e+06 1.054919e+07 1.208882e+07 1.544244e+07 1.740765e+07 1.285084e+07 1.543629e+07 4.629742e+06 2.807321e+07 1.005705e+07 1.098531e+07 4.723427e+06 9.432556e+06 1.085633e+07 6.378391e+06 5.533699e+06 1.017439e+07 7.055459e+06 1.560526e+07 1.627277e+07 2.074732e+07 1.599619e+07 5.967609e+06 2.822549e+07 3.755344e+06 2.254737e+07 3.090376e+07 1.000927e+07 4.116261e+07 3.733004e+07 1.954546e+07 1.512263e+07 2.020254e+07 1.426941e+07 9.315319e+06 7.119723e+06 1.009675e+07 6.925431e+06 1.386739e+07 3.139297e+07 1.421088e+07 5.942777e+06 2.404164e+07 1.115418e+07 2.202652e+07 5.537251e+07 4.730683e+06 1.590792e+07 7.261831e+06 1.039614e+07 1.918381e+07 1.123648e+07 2.081641e+07 1.901389e+07 5.894406e+06 1.100058e+07 1.892997e+06 4.708098e+06 1.399738e+07 8.509320e+06 3.556978e+07 8.741554e+06 4.342639e+06 1.284648e+07 1.417732e+07 6.692404e+06 1.160590e+07 7.166617e+06 2.323664e+07 1.467959e+07 1.592806e+07 9.082970e+06 5.894926e+06 1.569470e+07 1.759941e+07 1.257321e+07 1.103450e+07 1.528614e+07 1.233144e+07 1.337271e+07 1.431704e+07 2.239308e+07 1.674884e+07 1.285264e+07 9.937011e+06 5.583727e+06 1.039039e+07 1.851560e+07 1.406122e+07 1.898402e+07 7.951099e+06 4.130186e+07 C32 H76 N7 O4 P3_3.487 9.303814e+06 5.131779e+06 5.659284e+06 5.980135e+06 1.015422e+05 5.570599e+06 4.415162e+06 5.437658e+06 133642.73 6.294405e+06 6.104415e+06 3.495469e+06 131126.28 6.194199e+06 6.059320e+06 6.077722e+06 1.132319e+05 3.944754e+06 5.994725e+06 5.637501e+06 1.417420e+05 5.812884e+06 5.638280e+06 5.568900e+06 56923.355 4.327393e+06 6.199835e+06 4.449040e+06 8.536857e+04 6.371114e+06 6.113250e+06 4.637215e+06 94382.61 5.832883e+06 6.179419e+06 3.814460e+06 1.243150e+05 5.195901e+06 6.035702e+06 6.156578e+06 7.429216e+04 4.983871e+06 5.376031e+06 6.497945e+06 4.080366e+04 5.198924e+06 4.775868e+06 5.679326e+06 2.650848e+06 2.247195e+06 3.902640e+06 3.952508e+06 9.577336e+06 3.812822e+06 5.323956e+06 6.514460e+06 6.861019e+06 5.766266e+06 1.583805e+07 5.348649e+06 8.924175e+06 1.116882e+07 5.307052e+06 1.052306e+07 3.484893e+06 2.786194e+06 4.443405e+06 4.146388e+06 4.566163e+06 1.659998e+06 8.019782e+06 4.113702e+06 3.855137e+06 3.694995e+06 4.820618e+06 3.956240e+06 1.363943e+06 7.934100e+06 9.644250e+06 5.260218e+06 9.389249e+06 4.161423e+06 3.797473e+06 3.585336e+06 2.698263e+06 4.830403e+06 6.220922e+06 4.640451e+06 4.004247e+06 4.642404e+06 7.217644e+06 3.568070e+06 4.369960e+06 1.085408e+07 5.812095e+06 4.834303e+06 5.198551e+06 3.125932e+06 3.678413e+06 3.376692e+06 4.128800e+06 9.833569e+06 5.470448e+06 5.338094e+06 3.936046e+06 5.736477e+06 3.695565e+06 9.727294e+06 6.270822e+06 6.675058e+06 2.937175e+06 5.591620e+06 4.039822e+06 7.372533e+06 4.279797e+06 3.334912e+06 4.352085e+06 3.610240e+06 6.516476e+06 9.755454e+06 3.270712e+06 3.932084e+06 1.513720e+06 6.068432e+06 2.522698e+06 9.650065e+06 5.604660e+06 3.422234e+06 7.022120e+06 2.646189e+06 5.381474e+06 7.463521e+06 6.076984e+06 3.710388e+06 5.738341e+06 3.141968e+06 7.110787e+06 6.978562e+06 5.534797e+06 5.385587e+06 9.123567e+06 7.951613e+06 4.481289e+06 3.673270e+06 8.201567e+06 5.385005e+06 3.599125e+06 8.763163e+06 4.871386e+06 1.615813e+06 4.230425e+06 2.855379e+06 4.453528e+06 8.922861e+06 5.722700e+06 5.388703e+06 4.439439e+06 6.818629e+06 5.234425e+06 6.655674e+06 5.535417e+06 5.621193e+06 4.967981e+06 5.752085e+06 3.574449e+06 4.406519e+06 5.259243e+06 4.518596e+06 3.737985e+06 8.198723e+06 1.287954e+07 3.318036e+06 6.371006e+06 3.880605e+06 5.628620e+06 7.600255e+06 5.279132e+06 4.571200e+06 1.001638e+07 2.764535e+06 2.761661e+06 7.097821e+06 7.845314e+06 4.958106e+06 2.425066e+06 3.030885e+06 9.107386e+06 1.811767e+06 2.552806e+06 3.965592e+06 4.600383e+06 5.742055e+06 2.369040e+06 1.467248e+07 3.248959e+06 6.459097e+06 5.702599e+06 4.040491e+06 3.043345e+06 1.676079e+06 4.134651e+06 2.747996e+06 5.377050e+06 4.701599e+06 1.007461e+07 4.343691e+06 2.646089e+06 4.953392e+06 2.292843e+06 6.168068e+06 2.520615e+06 2.836561e+06 4.645713e+06 3.403965e+06 3.505755e+06 2.915582e+06 3.523916e+06 3.167027e+06 4.428955e+06 3.711888e+06 4.713732e+06 7.689209e+06 3.144427e+06 2.891738e+06 4.608552e+06 3.174961e+06 1.082120e+07 5.038911e+06 1.168305e+07 5.311933e+06 4.641874e+06 2.137336e+06 1.199305e+07 2.683231e+06 3.594262e+06 3.041801e+06 5.235291e+06 5.178246e+06 7.504874e+06 6.570379e+06 6.485642e+06 6.373912e+06 3.118109e+06 9.532798e+06 4.968808e+06 3.963622e+06 7.219739e+06 7.259171e+06 3.308955e+06 5.301109e+06 4.418833e+06 2.654923e+06 4.680786e+06 6.273734e+06 4.249399e+06 5.645553e+06 2.765640e+06 4.944680e+06 8.590025e+06 4.103508e+06 5.634716e+06 5.082493e+06 C30 H67 N5 O15 S_3.49 1.557925e+07 5.836477e+06 5.823365e+06 6.534299e+06 1.319020e+05 7.304927e+06 7.630903e+06 6.195593e+06 158535.07 5.285425e+06 6.850558e+06 4.491269e+06 138354.39 7.690415e+06 7.404383e+06 7.141863e+06 1.135609e+05 4.617487e+06 7.113435e+06 6.109269e+06 1.449514e+05 7.066321e+06 7.050889e+06 6.008562e+06 58077.268 4.918533e+06 6.923535e+06 6.359628e+06 7.973765e+04 6.517962e+06 6.937920e+06 5.768675e+06 80633.81 7.280238e+06 6.169925e+06 5.427826e+06 1.095876e+05 7.103984e+06 6.686367e+06 5.211699e+06 7.859993e+04 7.172658e+06 7.184136e+06 7.827910e+06 5.186689e+04 4.320830e+06 6.670853e+06 6.388761e+06 3.324313e+06 3.660110e+06 6.787973e+06 4.035475e+06 9.706957e+06 3.656062e+06 8.624286e+06 7.082661e+06 8.566113e+06 6.020774e+06 1.696558e+07 5.981102e+06 9.071335e+06 5.098262e+06 5.088646e+06 1.023389e+07 2.539815e+06 3.633762e+06 5.813564e+06 4.830010e+06 6.787894e+06 4.026782e+06 6.901478e+06 4.793682e+06 4.230882e+06 4.287894e+06 6.766384e+06 3.761423e+06 2.004472e+06 1.060422e+07 9.283281e+06 5.676230e+06 1.122576e+07 4.920325e+06 6.075098e+06 3.561502e+06 2.876111e+06 8.376775e+06 7.159905e+06 8.745347e+06 5.781433e+06 6.925822e+06 7.054030e+06 4.093940e+06 6.167627e+06 1.242352e+07 8.081929e+06 5.564770e+06 5.898586e+06 3.884048e+06 3.035004e+06 5.224563e+06 4.775619e+06 7.223219e+06 6.057140e+06 4.125142e+06 4.592000e+06 5.543668e+06 5.653316e+06 1.038490e+07 9.450495e+06 6.740902e+06 3.515369e+06 8.070415e+06 5.599517e+06 8.970962e+06 3.922907e+06 3.824986e+06 4.893147e+06 3.013567e+06 7.885977e+06 1.237645e+07 4.721111e+06 4.937828e+06 2.331611e+06 4.382546e+06 3.856840e+06 1.044394e+07 1.042069e+07 5.392685e+06 1.070799e+07 2.868486e+06 7.141452e+06 9.222200e+06 7.600552e+06 3.078551e+06 6.515620e+06 4.068913e+06 9.722041e+06 7.399956e+06 6.264797e+06 5.493181e+06 9.504602e+06 6.780223e+06 4.413574e+06 4.003104e+06 7.923835e+06 3.749519e+06 3.761165e+06 6.979473e+06 3.562125e+06 2.832872e+06 4.865122e+06 3.669092e+06 7.503004e+06 1.050249e+07 6.893428e+06 8.759537e+06 4.901549e+06 1.124796e+07 8.286596e+06 5.458889e+06 6.228872e+06 7.424839e+06 5.785717e+06 1.007668e+07 2.607265e+06 5.062452e+06 8.095347e+06 5.434266e+06 6.427843e+06 8.583199e+06 1.836910e+07 6.623029e+06 9.447079e+06 5.539110e+06 8.876450e+06 6.601445e+06 6.260497e+06 5.893039e+06 1.046380e+07 2.293359e+06 1.696266e+06 1.050759e+07 1.143187e+07 5.399841e+06 2.772648e+06 2.510032e+06 1.442365e+07 3.844686e+06 4.469554e+06 5.990549e+06 4.101507e+06 4.449296e+06 2.035916e+06 1.375710e+07 2.941354e+06 8.160091e+06 1.116597e+07 4.597314e+06 5.723305e+06 2.844592e+06 1.010150e+07 3.881811e+06 1.046663e+07 6.192969e+06 1.063294e+07 4.110138e+06 3.133605e+06 9.073018e+06 3.866143e+06 9.550962e+06 3.001000e+06 4.193640e+06 6.874137e+06 5.213078e+06 4.959089e+06 4.473560e+06 5.146479e+06 3.929561e+06 3.692885e+06 5.034192e+06 6.488005e+06 6.998167e+06 4.341724e+06 4.356772e+06 5.320346e+06 4.185006e+06 1.571784e+07 5.633426e+06 1.140710e+07 6.887516e+06 5.698119e+06 2.944253e+06 1.087292e+07 2.863278e+06 4.612286e+06 3.392401e+06 5.424005e+06 4.341974e+06 1.044397e+07 8.371026e+06 6.341178e+06 4.866796e+06 3.340560e+06 1.304954e+07 5.269562e+06 4.116975e+06 7.853797e+06 8.714801e+06 4.880923e+06 4.621373e+06 4.188337e+06 2.940357e+06 7.734203e+06 6.055743e+06 5.508875e+06 4.598447e+06 5.123603e+06 5.540204e+06 9.240183e+06 2.882685e+06 5.413706e+06 4.392755e+06 NICOTINAMIDE 1.856379e+07 2.117201e+07 2.178625e+07 2.167302e+07 1.233867e+05 2.145923e+07 2.403162e+07 2.350691e+07 122652.85 2.078099e+07 2.265321e+07 2.526820e+07 136434.30 2.019587e+07 2.101771e+07 2.348558e+07 1.522877e+05 2.076170e+07 1.927488e+07 2.327915e+07 1.382140e+05 2.008187e+07 2.352656e+07 2.856555e+07 37725.645 1.900940e+07 2.142369e+07 2.174197e+07 2.517175e+05 1.904016e+07 2.261130e+07 2.574717e+07 83845.27 2.153857e+07 2.005689e+07 2.239781e+07 1.349061e+05 2.045317e+07 2.258710e+07 2.605806e+07 1.081728e+05 2.130753e+07 1.790075e+07 2.676613e+07 6.169955e+04 2.003553e+07 2.010681e+07 2.360069e+07 1.190482e+07 1.847927e+07 9.836468e+06 7.826043e+07 2.515530e+07 1.437350e+07 1.245620e+07 2.231737e+07 1.098828e+07 1.549551e+07 1.092112e+07 4.208844e+07 1.460654e+07 1.275065e+07 1.621558e+07 1.770261e+07 3.944341e+07 3.591440e+07 2.069730e+07 1.158077e+07 8.829872e+06 1.457315e+07 6.192868e+07 3.565526e+07 2.244714e+07 5.293571e+07 9.596398e+06 2.898136e+07 1.691196e+07 2.834760e+07 4.154705e+07 2.333945e+07 1.411858e+07 3.836764e+07 1.840320e+08 3.750063e+07 2.755026e+07 2.472135e+07 7.163117e+06 1.018289e+07 1.841981e+07 1.578977e+07 3.086412e+07 4.868018e+07 1.056662e+07 1.320304e+07 3.407193e+07 4.445032e+07 3.762586e+07 1.444711e+07 5.959000e+07 5.134765e+07 1.597257e+07 2.273261e+07 9.173333e+06 1.981526e+07 2.972692e+07 1.429262e+07 8.909858e+06 1.419770e+07 2.108610e+07 3.273754e+07 1.475330e+07 2.820381e+07 2.481956e+07 4.199661e+07 8.110519e+07 9.315360e+06 4.495109e+07 2.994994e+07 9.775117e+06 1.625856e+07 1.725184e+07 1.257799e+07 8.503058e+06 1.320109e+07 1.104889e+07 1.166428e+07 2.038028e+07 1.464970e+07 1.023405e+07 1.468339e+07 2.538275e+07 3.340467e+07 8.999843e+06 1.242201e+07 9.380499e+06 1.391435e+07 2.373139e+07 1.389927e+07 1.305145e+07 1.000664e+07 1.122944e+07 2.314290e+07 1.364724e+07 8.628032e+06 1.006217e+07 1.174936e+07 9.118100e+06 1.159084e+07 2.244018e+07 1.282679e+07 3.442780e+07 1.299680e+07 1.315249e+07 1.686930e+07 2.138014e+07 8.683235e+06 1.218706e+07 2.265854e+07 2.913788e+07 1.128771e+07 1.651870e+07 1.617663e+07 9.775763e+06 9.003483e+06 2.497185e+07 1.819192e+07 1.393127e+07 1.529060e+07 1.027965e+07 2.566852e+07 2.405353e+07 1.873396e+07 6.689232e+06 1.441188e+07 1.166971e+07 2.922540e+07 2.494696e+07 2.483470e+07 1.754033e+07 2.397549e+07 4.869149e+07 5.728074e+06 1.378985e+07 1.780551e+07 3.565618e+07 2.403012e+07 2.454791e+07 9.721920e+06 1.427583e+07 1.059157e+07 9.054491e+06 2.490847e+07 2.052735e+07 1.883628e+07 9.497487e+06 1.492190e+07 1.486521e+07 8.965409e+06 1.627045e+07 1.729594e+07 1.278789e+07 1.795845e+07 1.967937e+07 1.111587e+07 8.662601e+06 6.112753e+07 9.287234e+06 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1.573169e+07 4.422191e+05 2.606560e+05 4.446432e+06 2.530364e+05 3.047479e+05 1.635646e+05 4.498368e+06 2.472517e+05 2.708351e+05 5.688007e+05 2.336185e+06 1.335247e+06 2.989494e+05 2.380434e+05 1.003018e+06 4.272297e+05 3.175210e+05 1.783680e+05 2.076937e+05 9.361913e+05 3.771015e+05 4.782957e+05 1.906268e+05 2.640121e+06 3.753776e+05 1.858739e+05 6.710995e+05 3.212493e+05 1.912412e+05 9.560070e+05 2.588322e+05 2.095206e+05 7.394421e+05 2.466505e+05 3.790719e+05 1.335754e+06 2.002397e+05 5.057713e+05 9.449803e+05 2.020656e+05 2.878531e+05 3.975791e+05 4.144901e+05 2.784556e+05 6.041137e+05 1.616581e+06 8.702898e+05 1.920496e+06 2.457746e+05 2.267469e+06 1.125160e+06 1.927581e+05 2.188360e+05 4.384371e+05 1.079529e+06 1.902517e+06 2.621436e+05 7.523122e+05 3.125012e+05 2.529905e+05 2.238520e+06 1.679326e+05 2.406750e+05 2.695173e+05 4.669777e+06 3.303807e+05 1.727376e+05 C27 H57 N7 O2_3.684 1.932412e+06 5.669224e+05 5.663085e+05 5.136948e+05 1.086883e+05 4.321544e+05 8.771782e+05 6.194142e+05 92624.73 4.768077e+05 5.497823e+05 7.547577e+05 111923.48 5.307779e+05 5.430819e+05 4.685143e+05 9.939060e+04 4.806791e+05 5.825263e+05 7.076709e+05 1.177554e+05 5.884914e+05 6.445972e+05 6.205583e+05 56736.251 3.673131e+05 7.446263e+05 5.242343e+05 7.605690e+04 4.813896e+05 6.718138e+05 6.556178e+05 78902.41 5.146229e+05 4.866501e+05 7.071175e+05 1.347441e+05 5.433597e+05 6.389067e+05 4.875301e+05 6.231480e+04 4.901083e+05 8.181209e+05 5.577136e+05 4.545034e+04 4.123712e+05 5.456015e+05 6.634815e+05 8.519266e+04 9.012718e+05 6.955396e+05 3.221864e+06 4.429516e+05 9.287266e+05 2.234881e+05 9.128742e+04 1.384638e+06 1.082736e+06 1.485957e+06 6.853591e+05 2.990507e+05 4.997139e+05 5.362766e+05 1.312256e+06 1.595946e+05 2.408004e+05 6.039347e+05 3.260271e+05 8.208036e+05 1.403968e+06 1.787459e+05 3.332433e+05 3.866074e+05 1.332142e+05 7.664443e+05 1.257018e+05 2.690064e+05 5.080141e+05 2.099433e+06 3.550373e+05 2.986516e+05 4.574165e+05 1.330947e+05 4.222585e+05 4.842155e+05 5.914500e+05 3.423309e+05 1.424719e+06 1.143987e+05 5.295617e+05 1.311910e+05 9.281244e+04 5.522467e+05 3.530954e+05 5.892652e+05 1.516532e+05 1.259160e+05 1.187274e+05 1.632019e+05 1.302537e+05 6.184665e+05 2.182102e+05 1.220425e+05 1.581592e+05 2.672966e+05 2.748019e+05 4.136807e+05 6.929423e+05 1.148896e+06 3.646498e+05 5.159825e+05 4.114763e+05 3.576454e+05 1.244242e+05 1.422576e+05 3.704706e+05 6.157358e+05 1.317529e+05 1.669986e+05 9.480354e+05 1.102448e+05 5.619153e+05 1.381053e+06 6.082102e+05 2.079268e+05 9.644291e+05 6.385333e+05 7.877381e+04 1.899200e+05 8.943153e+04 1.193216e+05 1.917769e+06 8.503718e+05 3.535652e+05 3.701207e+05 2.057199e+05 2.655760e+05 2.558228e+05 1.876108e+05 2.219378e+05 1.223194e+05 2.455629e+05 1.081500e+05 3.996429e+05 6.751452e+05 4.470147e+05 1.104020e+05 6.712847e+05 1.222668e+06 2.394703e+05 2.814600e+05 3.001006e+06 1.273125e+06 1.331714e+05 1.076061e+05 5.427432e+05 8.291160e+05 1.041218e+06 3.011253e+05 3.854723e+05 5.457562e+05 5.663789e+05 3.137108e+06 3.029102e+05 1.084802e+06 6.803749e+05 6.088680e+05 5.249270e+05 5.068010e+05 1.166614e+06 1.141959e+05 5.256809e+05 3.380252e+05 4.494946e+05 2.064160e+05 2.051710e+05 1.930801e+06 2.384038e+05 4.288391e+05 1.127876e+05 1.294429e+05 6.049598e+05 1.108110e+05 1.402929e+05 1.003854e+05 1.520716e+05 4.879745e+05 3.189837e+05 6.718495e+05 4.933716e+05 5.848910e+05 1.296345e+05 3.974064e+05 1.431722e+05 1.338589e+05 1.226616e+05 1.261441e+06 1.182834e+05 2.744617e+05 3.456582e+05 3.923145e+05 1.697397e+05 6.963622e+05 5.968439e+05 4.248964e+05 1.154180e+05 3.840513e+05 9.261939e+05 3.805500e+05 3.845541e+05 7.315701e+05 1.173315e+06 7.184587e+05 7.502690e+05 7.948138e+04 1.011017e+06 3.862973e+05 3.158592e+05 1.098626e+05 4.261688e+05 1.047075e+06 3.140086e+05 6.124798e+05 2.787598e+05 1.056678e+05 1.924473e+05 9.114983e+05 1.740645e+05 1.028119e+06 2.018738e+05 1.135719e+05 1.030886e+06 1.192486e+06 1.595680e+05 6.591729e+05 5.752685e+05 1.101956e+06 1.091047e+06 9.601019e+05 5.914100e+05 3.245240e+05 9.466119e+04 1.328960e+05 7.940289e+05 2.055764e+05 1.961601e+05 4.570533e+05 1.310726e+06 4.739175e+05 1.026861e+05 2.045366e+05 1.130305e+06 9.862816e+04 1.945734e+06 4.427584e+05 6.422044e+05 4.574477e+05 6.473558e+05 9.901828e+05 1.272342e+05 1.381354e+06 9.944346e+05 C5 H9 N_3.699 1.275583e+06 3.828752e+05 2.440836e+05 2.900641e+05 1.147943e+05 2.761531e+05 2.698026e+05 2.470143e+05 120023.12 3.333563e+05 3.470443e+05 3.473056e+05 134921.74 1.998497e+05 2.801031e+05 3.607395e+05 1.044353e+05 3.321196e+05 2.172315e+05 3.756322e+05 1.292498e+05 1.884497e+05 2.685026e+05 4.375136e+05 54995.369 2.588041e+05 2.237516e+05 2.997412e+05 7.064827e+04 1.041257e+05 3.901254e+05 3.484126e+05 78464.79 1.695294e+05 2.404965e+05 3.676852e+05 1.564835e+05 1.608858e+05 3.162654e+05 2.784701e+05 8.270971e+04 2.243873e+05 3.181333e+05 4.449759e+05 6.348800e+04 1.823880e+05 2.379816e+05 3.429230e+05 1.765715e+05 2.674021e+05 8.246231e+05 2.487049e+05 2.109607e+05 4.258793e+05 1.170891e+05 9.870767e+05 1.319575e+06 1.089929e+06 2.189165e+05 2.531926e+05 1.283169e+05 3.599464e+05 1.166856e+05 1.787088e+05 1.508933e+05 1.230581e+05 3.838698e+05 2.226146e+05 6.645097e+05 2.528958e+05 1.668450e+05 5.738583e+05 2.631234e+05 1.212102e+05 1.722607e+05 2.008629e+05 1.204107e+05 1.189596e+05 1.087121e+05 1.576606e+05 1.403517e+05 1.231802e+05 2.001086e+05 1.055890e+05 1.682074e+05 1.441463e+05 5.994413e+05 1.898277e+05 1.200345e+05 1.858904e+06 1.749637e+05 1.902187e+05 4.699004e+05 1.174449e+05 1.615500e+05 1.187646e+05 2.044447e+05 1.075957e+06 1.481289e+05 1.921414e+05 1.199721e+06 1.400295e+05 8.512756e+05 1.508049e+05 8.057385e+05 3.893672e+05 4.694077e+05 8.975511e+05 1.693495e+05 1.230436e+05 1.608120e+05 5.627921e+05 1.738549e+05 3.941746e+05 1.193812e+05 2.156153e+05 1.145975e+05 3.134393e+05 2.418409e+05 2.070093e+05 1.564341e+05 1.752118e+05 1.820281e+05 1.114472e+05 1.868744e+05 2.327574e+05 1.229074e+05 1.145958e+05 7.359366e+05 2.488617e+05 2.236544e+05 2.045712e+05 1.681011e+05 4.400193e+05 2.038619e+05 3.638551e+05 3.321042e+05 1.173415e+05 1.525869e+05 1.815602e+05 6.293398e+05 1.515971e+05 1.250166e+05 1.206530e+05 2.270433e+05 1.618854e+05 1.404903e+05 1.487312e+05 1.805648e+05 1.510429e+05 2.034017e+05 3.079260e+05 1.167138e+05 3.190345e+05 1.878235e+05 1.334172e+05 1.857001e+05 1.454421e+05 1.182063e+05 3.991698e+05 7.001964e+05 1.818087e+05 3.221285e+05 2.156888e+05 1.532710e+05 1.309538e+06 1.825623e+05 1.351944e+05 1.394184e+05 1.630695e+05 1.668005e+05 1.169044e+05 1.650936e+05 1.697789e+05 1.216864e+05 1.863939e+05 1.839458e+05 4.791130e+05 3.779913e+05 1.194936e+05 3.320159e+05 1.286393e+05 6.369683e+05 2.732624e+05 1.527923e+05 3.397671e+05 4.594053e+05 2.133371e+05 2.619840e+06 1.376265e+05 3.155422e+05 1.291732e+05 1.476738e+05 3.129768e+05 2.129396e+05 6.165981e+05 8.320116e+05 1.101463e+05 1.293628e+05 5.383090e+05 7.702433e+05 3.147531e+05 3.882073e+05 3.023976e+05 2.747973e+05 1.326867e+05 1.200579e+05 1.850611e+05 1.620235e+05 2.513581e+05 1.497278e+05 1.063944e+06 1.928863e+05 1.909648e+05 1.125419e+05 4.370075e+05 1.342675e+06 5.381320e+05 2.285136e+05 1.454599e+05 5.704391e+05 1.240336e+05 1.518743e+05 1.907633e+05 1.132825e+05 1.724649e+05 4.785529e+06 2.176380e+05 9.187034e+06 2.137495e+05 3.893714e+05 1.398811e+05 2.502818e+05 1.835640e+05 1.987141e+05 1.749765e+05 1.182282e+05 2.821647e+05 6.738666e+05 4.458567e+05 4.826535e+05 1.718286e+05 1.151214e+05 1.229723e+07 4.341304e+05 3.323798e+05 4.340393e+05 1.315364e+05 1.527202e+06 1.664190e+05 1.061543e+05 1.251703e+05 2.742033e+05 1.267178e+05 1.861043e+05 1.632083e+05 1.154826e+05 2.246990e+05 1.044749e+06 1.799954e+05 1.543229e+05 2.982693e+05 C7 H13 N O2 S_3.764 2.935608e+05 3.909401e+05 5.485204e+05 6.352245e+05 2.550622e+05 5.281374e+05 6.611443e+05 6.854479e+05 158555.57 4.866049e+05 6.050844e+05 6.530678e+05 150553.68 5.820965e+05 5.252158e+05 4.899929e+05 1.335289e+05 5.600536e+05 5.154937e+05 7.639431e+05 1.349388e+05 3.634028e+05 6.801028e+05 6.986871e+05 56095.142 4.490993e+05 5.831839e+05 6.344500e+05 6.996165e+04 5.083029e+05 5.190650e+05 6.760906e+05 118352.10 1.608081e+05 5.550866e+05 7.302468e+05 1.610974e+05 2.987024e+05 5.750575e+05 7.089951e+05 1.082860e+05 4.553330e+05 5.305536e+05 5.572765e+05 6.591408e+04 7.338131e+05 4.948791e+05 5.867126e+05 4.808020e+05 2.246256e+05 1.625725e+05 7.387152e+05 7.617879e+05 2.661065e+05 1.345959e+05 5.389770e+05 2.580948e+05 4.795768e+05 1.826526e+05 1.385703e+05 3.725686e+05 2.514634e+05 1.360113e+05 1.866656e+05 6.166007e+05 1.872222e+05 1.784615e+05 1.983913e+05 1.226949e+05 1.159422e+05 1.091359e+06 1.941141e+05 3.792226e+05 8.446561e+05 1.241660e+05 5.930331e+05 1.897086e+05 2.225843e+05 3.148362e+07 9.598963e+05 5.859349e+05 4.773296e+05 1.901719e+05 4.539391e+05 1.695029e+05 2.092456e+05 1.290154e+05 3.391900e+05 1.744082e+05 5.056602e+05 2.372412e+05 9.801452e+05 5.747731e+05 2.156727e+05 5.696735e+05 6.607525e+05 2.837635e+05 5.133277e+05 4.747743e+05 1.517732e+05 1.397747e+05 4.791399e+05 1.137828e+05 3.140388e+05 3.126012e+05 5.111066e+05 2.163361e+05 1.330507e+05 5.087553e+05 2.000972e+05 4.755759e+05 2.824486e+05 2.118748e+05 1.736000e+06 1.885795e+06 2.224852e+05 6.705168e+05 9.799867e+05 1.484349e+05 1.866826e+05 2.245195e+05 1.847503e+05 1.527946e+05 4.605753e+05 1.587137e+05 2.302522e+05 1.056378e+06 4.945258e+05 5.122816e+05 7.591663e+05 3.915496e+05 8.709395e+05 5.092114e+05 1.635325e+05 1.791198e+05 5.257096e+05 5.481396e+05 7.559532e+05 2.367919e+05 5.700681e+05 3.326535e+05 7.406843e+05 8.695562e+05 5.028501e+05 7.666487e+05 2.926301e+05 8.063982e+05 7.700986e+05 1.019844e+06 1.221408e+06 7.866070e+05 5.791585e+05 2.974162e+05 2.073720e+05 1.162634e+05 2.536505e+05 3.620428e+05 8.462680e+05 7.816016e+05 1.332963e+05 4.766094e+05 1.709236e+05 2.846913e+05 1.185832e+05 7.888448e+05 1.325190e+05 2.004240e+05 1.528690e+05 4.048771e+05 3.237189e+05 6.228263e+05 1.189078e+05 3.116523e+05 1.092574e+05 1.307775e+05 6.163475e+05 1.664846e+05 3.260530e+05 1.370998e+05 8.794323e+05 7.481380e+05 3.505271e+05 1.892946e+05 1.514752e+05 7.373382e+05 3.954669e+05 3.109544e+05 1.208227e+05 2.549983e+05 2.886156e+05 1.695908e+05 1.692368e+06 5.420468e+06 1.490618e+06 4.266452e+06 8.478454e+05 1.329046e+05 1.236860e+05 1.839787e+05 1.347130e+05 2.218293e+05 1.229533e+05 4.122863e+05 4.120489e+05 3.746457e+05 1.440169e+05 2.434946e+05 2.146653e+05 3.188520e+05 2.515993e+05 2.876114e+05 1.218543e+05 1.817548e+05 1.748627e+05 3.249622e+05 1.350769e+05 1.877768e+05 2.377620e+05 6.832498e+05 6.503691e+05 1.472621e+05 1.961186e+05 1.243856e+05 7.068490e+05 9.621765e+05 6.537256e+05 9.512199e+05 1.933003e+06 6.053951e+05 2.881879e+05 1.452645e+06 6.727143e+05 9.842782e+05 3.376694e+05 2.019661e+05 1.877565e+05 5.935054e+05 8.191319e+05 1.627833e+05 4.369819e+05 1.018099e+06 3.437508e+05 8.622057e+05 3.596708e+05 8.534770e+05 6.917308e+05 7.763268e+05 2.163452e+05 3.464303e+05 1.623930e+06 5.576034e+05 7.137528e+05 5.360295e+05 1.809016e+05 3.163162e+06 9.490061e+05 1.169030e+06 4.677155e+05 3.668181e+05 7.386874e+05 3.529937e+05 1.916309e+05 C12 H27 N_3.789 1.327259e+05 7.256678e+05 6.373278e+05 6.553871e+05 1.276819e+05 7.477670e+05 7.888681e+05 9.429914e+05 112642.04 6.176368e+05 7.742562e+05 8.993155e+05 123139.83 6.204988e+05 6.375045e+05 6.857695e+05 1.246843e+05 6.353096e+05 7.391213e+05 7.791956e+05 1.366188e+05 6.404787e+05 8.949990e+05 8.682903e+05 59847.314 5.447664e+05 6.931365e+05 8.382512e+05 7.342334e+04 7.293526e+05 6.330885e+05 6.809878e+05 81486.78 9.409846e+05 7.118588e+05 6.958143e+05 1.300467e+05 4.113187e+05 7.286784e+05 8.502514e+05 7.210201e+04 7.856463e+05 8.815808e+05 8.664556e+05 5.367606e+04 5.312382e+05 5.400206e+05 8.491914e+05 9.368635e+05 1.214083e+06 1.101491e+06 1.936748e+05 7.023402e+05 1.624253e+06 1.872777e+06 1.119912e+06 1.315233e+06 2.557040e+06 1.797909e+06 8.266741e+05 1.972261e+06 1.619874e+06 1.478307e+06 1.620139e+06 2.668349e+05 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8.531427e+05 3.836466e+05 4.081772e+05 6.575851e+05 9.281883e+04 5.106704e+05 4.402225e+05 5.619979e+05 90923.10 4.915921e+05 6.792254e+05 4.551151e+05 100635.95 3.564076e+05 4.336238e+05 4.426393e+05 9.320795e+04 4.897958e+05 6.226760e+05 5.515968e+05 1.026948e+05 4.559014e+05 5.396695e+05 6.095837e+05 56274.309 2.701677e+05 4.998528e+05 3.674166e+05 7.063471e+04 5.743322e+05 5.071281e+05 6.877265e+05 68131.60 3.770181e+05 5.434408e+05 3.953874e+05 1.139895e+05 4.824873e+05 5.341255e+05 6.415221e+05 7.534544e+04 4.440719e+05 3.667583e+05 6.056274e+05 4.819340e+04 3.912632e+05 4.363584e+05 5.774930e+05 4.580074e+05 3.363410e+05 7.312597e+05 4.134136e+05 7.301029e+05 8.697161e+05 3.658120e+05 5.354911e+05 1.380117e+06 1.866909e+06 1.244306e+06 6.579370e+05 6.357176e+05 5.069732e+05 3.083915e+05 3.426120e+05 6.055175e+05 1.994530e+05 8.245142e+05 5.946364e+05 4.219459e+05 6.025626e+05 8.535810e+05 6.831065e+05 8.055424e+05 1.692953e+05 5.040515e+05 1.411314e+06 2.493215e+05 6.690695e+05 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1.442341e+06 1.879383e+06 2.492414e+06 2.387600e+06 1.715180e+06 1.595861e+06 1.636113e+06 3.194007e+06 9.269603e+05 7.256477e+05 1.893999e+06 2.213704e+06 1.363205e+06 1.992989e+06 7.827852e+05 1.661786e+06 1.195135e+06 1.704945e+06 1.241653e+06 1.163602e+06 4.276590e+06 1.451718e+06 1.808969e+06 1.404548e+06 1.244733e+06 1.382168e+06 1.718779e+06 1.555581e+06 2.048030e+06 3.692974e+06 1.471246e+06 8.338943e+05 1.800607e+06 1.455027e+06 1.420215e+06 1.277938e+06 2.556184e+06 1.531478e+06 1.947041e+06 3.011547e+06 2.729749e+06 1.112094e+06 2.765412e+06 2.528156e+06 2.083178e+06 2.146202e+06 2.612623e+06 1.220430e+06 2.210764e+06 1.339779e+06 1.400201e+06 1.307229e+06 1.426706e+06 2.015417e+06 2.306282e+06 1.455789e+06 8.901891e+05 1.914709e+06 2.518540e+06 1.749452e+06 2.074373e+06 1.869817e+06 C47 H94 N7 P_3.822 1.467680e+05 1.053346e+06 1.322623e+06 1.074462e+06 1.416313e+05 1.038578e+06 1.185471e+06 1.251650e+06 118794.50 1.294729e+06 1.226165e+06 1.354067e+06 120967.13 1.103974e+06 1.006941e+06 1.112022e+06 1.151169e+05 1.001474e+06 1.288869e+06 1.282759e+06 1.159553e+05 9.055964e+05 1.294809e+06 1.675422e+06 50556.198 8.407458e+05 1.110205e+06 1.179673e+06 6.573801e+04 1.198602e+06 1.054658e+06 1.436863e+06 70133.33 8.558746e+05 1.250014e+06 1.104245e+06 1.068139e+05 1.274054e+06 1.130810e+06 1.192143e+06 6.599034e+04 1.104969e+06 1.293393e+06 1.529107e+06 4.496039e+04 7.880644e+05 9.807504e+05 1.345178e+06 1.191731e+06 6.053289e+05 7.590201e+05 1.997455e+06 1.567211e+06 9.879413e+05 1.352397e+06 1.971325e+06 2.050723e+06 2.985495e+06 8.864539e+05 1.612295e+06 2.809100e+06 1.453435e+06 1.000487e+06 4.236258e+05 2.538140e+06 7.756914e+05 2.252903e+06 1.486526e+06 7.095244e+05 5.385151e+05 4.188744e+06 9.309563e+05 1.519858e+06 1.720001e+06 4.358601e+05 3.990662e+06 5.498810e+05 1.178616e+06 1.187178e+05 2.163701e+06 2.195519e+06 1.077325e+06 2.480116e+05 9.846235e+05 1.090452e+06 1.050383e+06 7.657714e+05 2.543322e+05 4.300495e+05 2.394786e+05 1.138133e+06 1.713958e+06 8.376502e+05 4.461083e+05 8.855838e+05 1.600694e+06 2.027159e+06 1.385325e+06 3.179975e+06 6.837153e+05 6.891029e+05 2.097278e+06 1.521694e+06 2.355501e+06 7.876435e+05 5.669939e+05 2.374119e+05 2.586973e+05 6.927436e+05 8.889955e+05 1.174767e+06 8.082558e+05 1.268398e+06 2.770828e+06 3.346196e+06 7.743829e+05 1.592712e+06 2.684396e+06 1.206430e+06 1.912344e+06 1.440675e+06 1.104059e+06 1.151873e+06 1.241723e+06 1.072623e+06 1.151768e+06 6.506595e+05 9.540783e+05 1.599318e+06 1.835276e+06 1.643810e+06 1.179986e+05 1.147097e+06 2.750515e+06 2.177668e+06 2.463972e+06 1.446316e+06 2.004933e+06 1.153448e+06 1.431571e+06 1.289544e+06 2.274619e+06 1.975321e+06 1.696881e+06 6.579329e+06 2.367339e+06 3.911650e+06 2.218832e+06 2.071197e+06 1.237572e+06 1.612195e+06 1.344744e+06 1.653885e+06 1.320017e+06 9.362816e+05 1.408972e+06 1.067765e+06 9.584258e+05 5.893731e+05 2.706023e+06 1.084426e+06 6.959770e+05 1.095272e+06 5.097233e+05 1.819832e+05 1.172537e+06 7.648381e+05 9.853892e+05 1.100133e+06 3.565646e+05 1.248973e+06 5.546323e+05 9.995834e+05 2.538492e+05 1.255662e+06 1.828669e+06 7.113012e+05 1.071868e+06 6.911753e+05 3.090344e+06 4.248433e+06 2.068636e+05 1.449763e+05 1.608165e+06 1.667969e+06 1.532175e+06 1.040930e+05 7.128233e+05 1.019015e+05 2.419959e+05 2.166992e+05 1.999613e+06 6.336751e+06 1.080824e+06 1.845507e+06 8.244660e+05 2.230506e+05 1.765115e+06 4.536706e+05 2.832056e+05 1.820941e+05 2.134847e+06 1.134101e+05 1.395106e+06 1.266483e+06 2.114971e+06 1.818634e+06 6.961844e+05 3.082471e+05 6.887446e+05 1.223732e+06 8.826037e+05 1.549869e+05 8.982224e+05 7.575766e+05 1.378608e+06 2.191143e+05 1.977895e+05 1.768501e+06 7.221542e+05 8.615979e+05 1.091416e+06 6.070824e+05 4.010262e+05 1.589225e+06 6.284455e+05 7.541066e+05 1.105104e+06 1.079259e+06 1.850494e+06 1.756201e+06 5.042289e+05 9.953486e+05 1.590950e+06 1.127228e+05 9.408613e+05 8.873344e+05 8.825269e+05 4.887237e+05 2.084448e+06 2.486689e+06 8.568132e+05 2.710685e+06 5.796027e+05 2.086167e+06 1.736629e+06 1.326761e+06 2.470823e+05 8.464566e+05 1.181829e+06 1.462851e+06 7.399994e+05 1.046125e+06 7.050941e+05 1.611549e+06 1.231719e+06 2.715130e+05 8.917901e+05 6.182679e+05 2.709085e+06 5.989713e+05 7.937663e+05 C3 H3 N7 O P2_3.825 7.735523e+06 3.129333e+06 3.306062e+06 3.146779e+06 2.688648e+05 3.281367e+06 3.587425e+06 3.608416e+06 249392.46 3.182389e+06 3.414664e+06 3.786005e+06 244353.12 3.079215e+06 3.370108e+06 3.175296e+06 2.286877e+05 2.922029e+06 3.058611e+06 3.197732e+06 2.304464e+05 3.222635e+06 4.537968e+06 3.882492e+06 104990.880 2.248221e+06 3.416731e+06 3.465664e+06 1.469202e+05 2.633330e+06 3.489048e+06 3.718272e+06 137704.99 3.402445e+06 3.215913e+06 2.976519e+06 2.257766e+05 2.988512e+06 3.932707e+06 3.678674e+06 1.531391e+05 3.332017e+06 3.247040e+06 3.434892e+06 1.171876e+05 2.724557e+06 2.659944e+06 4.085380e+06 2.746382e+06 2.825827e+06 4.454287e+06 2.926005e+06 4.303063e+06 3.979225e+06 3.067941e+06 3.747983e+06 8.816566e+06 8.030926e+06 4.639453e+06 4.056109e+06 4.195203e+06 3.684473e+06 2.773882e+06 2.720296e+06 3.262719e+06 1.523768e+06 4.291851e+06 3.102863e+06 3.151711e+06 2.915912e+06 5.545173e+06 3.505354e+06 3.321199e+06 2.261981e+06 2.948482e+06 4.945429e+06 2.168933e+06 3.741233e+06 1.094332e+07 4.133903e+06 5.339020e+06 2.442019e+06 3.009721e+06 2.511993e+06 2.967137e+06 4.345477e+06 3.314677e+06 3.339246e+06 2.669883e+06 3.316371e+06 2.962368e+06 2.719049e+06 3.203144e+06 2.706890e+06 2.944910e+06 2.846554e+06 3.043031e+06 2.581857e+06 2.960115e+06 1.973528e+06 4.033816e+06 2.364195e+06 2.638011e+06 3.276671e+06 3.721315e+06 3.201606e+06 3.173452e+06 2.500407e+06 2.884324e+06 3.238445e+06 2.036845e+06 1.413198e+07 5.048458e+06 4.074467e+06 3.397168e+06 2.664506e+06 4.302163e+06 2.727579e+06 6.640933e+06 5.449855e+06 3.600798e+06 3.044181e+06 2.805006e+06 3.616278e+06 2.783558e+06 2.829675e+06 3.067854e+06 1.894144e+06 3.776146e+06 2.780051e+06 3.965850e+06 4.018188e+06 3.213571e+06 6.938472e+06 3.652971e+06 4.619509e+06 4.224130e+06 3.800907e+06 3.016374e+06 3.313867e+06 3.485790e+06 4.498896e+06 3.092031e+06 4.236406e+06 1.122952e+07 3.389497e+06 4.164234e+06 2.691952e+06 2.787518e+06 2.360332e+06 4.996112e+06 4.581337e+06 9.141676e+06 5.499618e+06 3.455384e+06 5.134705e+06 3.576165e+06 3.462392e+06 2.360485e+06 7.051581e+06 4.815655e+06 3.536147e+06 3.613960e+06 3.314007e+06 2.690362e+06 4.806161e+06 2.744893e+06 3.343580e+06 5.154846e+06 1.835259e+06 4.561651e+06 2.707885e+06 5.393124e+06 2.722859e+06 4.205932e+06 2.740353e+06 3.931283e+06 3.028885e+06 3.422622e+06 2.835745e+06 2.033648e+06 2.000338e+06 2.583434e+06 2.499841e+06 2.274909e+06 2.130358e+06 3.176589e+06 2.769012e+06 2.742282e+06 1.878834e+06 2.458421e+06 2.428222e+06 3.289278e+07 2.973525e+06 2.252390e+06 3.230155e+06 3.939201e+06 3.319371e+06 3.069389e+06 2.967959e+06 2.665242e+06 3.528984e+06 3.410084e+06 5.208915e+06 3.170456e+06 2.608353e+06 3.013248e+06 5.730949e+06 1.720245e+06 1.462663e+06 2.870006e+06 4.089865e+06 2.363709e+06 3.398381e+06 1.337113e+06 3.249616e+06 2.190015e+06 3.113890e+06 2.155773e+06 2.330818e+06 7.367005e+06 2.812368e+06 3.238991e+06 2.713481e+06 2.214554e+06 2.263537e+06 3.046691e+06 2.863803e+06 4.396627e+06 6.465836e+06 3.059353e+06 1.622933e+06 3.329171e+06 2.486963e+06 2.381245e+06 1.933053e+06 4.638097e+06 2.720528e+06 3.333830e+06 5.040210e+06 4.708530e+06 1.982732e+06 4.747899e+06 4.365026e+06 3.586362e+06 3.888584e+06 4.584060e+06 1.818270e+06 4.151547e+06 2.266433e+06 3.030227e+06 2.187452e+06 2.380417e+06 3.454768e+06 3.800521e+06 2.429848e+06 1.698659e+06 3.670421e+06 4.212284e+06 2.976442e+06 4.098353e+06 2.955109e+06 C25 H49 N O4_3.839 5.075755e+06 2.663245e+06 2.645097e+06 2.129988e+06 1.208208e+05 2.422358e+06 2.835853e+06 2.620673e+06 135152.79 2.419647e+06 2.325994e+06 2.810580e+06 108933.56 2.447370e+06 2.691893e+06 2.976845e+06 1.089069e+05 2.004239e+06 2.429251e+06 2.527698e+06 1.300500e+05 2.343029e+06 2.888178e+06 2.575723e+06 56643.966 2.166023e+06 2.536504e+06 2.521491e+06 7.562516e+04 2.703667e+06 2.267092e+06 3.283836e+06 70483.41 2.336609e+06 2.342087e+06 2.488949e+06 1.288733e+05 2.312483e+06 2.566365e+06 2.761949e+06 7.977716e+04 2.245062e+06 2.476319e+06 2.913311e+06 5.547311e+04 2.534677e+06 2.162161e+06 2.704530e+06 6.314146e+05 2.978543e+06 2.910900e+06 3.974043e+06 1.963636e+06 1.844241e+06 2.487264e+06 2.479091e+06 7.194847e+06 5.378606e+06 4.774024e+06 2.032248e+06 3.437098e+06 4.292837e+06 2.360351e+06 4.824950e+06 1.857104e+06 2.425653e+06 2.986248e+06 1.066935e+06 1.159774e+06 2.597439e+06 1.493337e+06 2.828044e+06 2.705547e+06 1.358394e+06 2.400849e+06 1.249956e+06 2.573853e+06 2.493518e+06 6.003094e+06 4.911216e+06 1.720540e+06 1.829400e+06 1.820372e+06 2.802451e+06 2.249707e+06 2.971585e+06 1.595789e+06 3.733814e+05 1.576752e+06 1.926534e+06 3.197275e+06 1.065599e+06 1.792628e+06 1.112099e+06 3.060161e+06 1.975406e+06 1.590868e+06 2.014991e+06 4.660326e+05 1.882102e+06 2.478771e+06 1.318700e+06 1.398415e+06 1.040872e+06 1.731463e+06 3.132655e+06 1.054403e+06 1.517268e+06 5.286304e+06 2.996411e+06 1.339922e+06 3.040283e+06 1.842958e+06 1.092781e+06 1.664137e+06 8.648895e+05 3.475308e+06 1.153027e+06 1.697144e+06 2.407381e+06 1.004463e+06 2.173866e+06 1.455117e+06 1.106387e+06 9.746755e+05 1.873115e+06 3.973162e+06 9.504642e+05 1.387206e+06 7.280778e+05 2.624187e+06 4.627210e+06 1.694784e+06 1.609591e+06 2.695734e+06 2.766974e+06 2.389351e+06 1.522041e+06 1.424462e+06 2.709402e+06 1.347482e+06 1.990792e+06 1.762174e+06 1.750809e+06 4.793555e+06 3.068545e+06 5.817569e+05 8.390666e+05 1.655564e+06 9.878442e+05 1.779927e+06 1.445410e+06 2.294516e+06 1.684535e+06 1.934960e+06 1.670760e+06 2.408668e+06 1.837230e+06 3.314869e+06 2.304356e+06 3.516418e+06 2.123371e+06 6.022177e+06 2.030184e+06 2.862976e+06 4.017213e+06 3.567043e+06 2.486650e+06 1.067392e+06 1.862517e+06 2.513683e+06 3.713483e+06 1.562666e+06 8.884845e+05 1.103594e+06 1.746146e+06 3.929080e+06 2.755258e+06 1.844216e+06 6.406861e+05 1.399876e+05 2.363324e+06 1.471324e+06 9.503102e+05 1.029741e+06 1.709857e+06 4.537619e+06 1.434039e+06 1.669359e+06 2.401058e+06 1.360004e+06 1.054312e+06 1.941712e+06 9.664557e+05 2.968029e+05 1.301617e+06 2.338608e+06 2.588461e+06 2.606858e+06 2.201720e+06 2.381597e+06 1.452049e+06 2.654217e+06 1.643263e+06 2.007272e+06 1.207204e+06 2.699289e+06 1.132335e+06 2.655420e+06 3.160856e+06 1.824988e+06 2.844684e+06 2.679257e+06 2.387097e+06 1.616892e+06 1.979815e+06 1.110106e+06 1.749095e+06 1.862288e+06 2.519528e+06 2.467319e+06 2.222760e+06 2.680842e+06 1.597950e+06 1.868473e+06 1.777693e+06 2.810241e+06 1.127703e+06 3.329834e+06 1.204520e+06 2.246575e+06 1.914954e+06 2.625981e+06 1.468834e+06 2.888137e+06 3.990975e+06 2.816431e+06 1.787709e+06 3.561785e+06 2.613811e+06 3.647778e+06 2.263602e+06 1.119428e+06 3.315183e+06 1.154436e+06 1.557150e+06 2.353307e+06 4.289769e+06 2.618287e+06 1.190183e+06 1.781619e+06 2.523549e+06 1.752738e+06 3.362219e+06 2.754990e+06 3.197620e+06 2.083949e+06 2.904580e+06 3.385426e+06 1.649302e+06 2.169219e+06 4.692555e+06 C17 H37 N_3.84 1.366505e+05 3.613592e+05 4.412605e+05 3.653580e+05 1.257530e+05 4.104194e+05 4.359596e+05 5.865301e+05 102633.36 3.779840e+05 4.009080e+05 5.021872e+05 112657.94 3.012823e+05 3.738481e+05 5.190269e+05 8.522526e+06 2.633977e+05 5.187116e+05 4.424404e+05 1.240338e+05 3.626281e+05 3.350959e+05 5.795915e+05 52527.015 3.006503e+05 5.411753e+05 4.353315e+05 8.385609e+04 3.197220e+05 4.153419e+05 4.816624e+05 96995.55 3.783372e+05 3.611636e+05 4.868965e+05 1.744872e+05 2.366671e+05 5.695345e+05 3.892829e+05 9.718508e+04 4.511351e+05 5.506483e+05 4.818048e+05 6.252323e+04 1.983578e+05 1.903020e+05 6.237926e+05 1.092001e+05 1.435248e+05 1.106806e+05 1.657356e+05 1.829241e+05 1.929788e+05 1.123220e+05 9.016075e+04 1.293440e+05 1.106678e+05 1.784328e+05 1.125526e+05 1.612149e+05 1.902945e+05 1.181036e+05 1.749469e+05 1.921802e+05 1.291569e+05 1.199968e+05 1.879894e+05 1.183114e+05 1.311230e+05 9.850748e+04 1.222441e+05 9.513594e+04 1.180740e+05 1.414749e+05 1.368277e+05 1.140605e+05 1.104420e+05 1.089181e+05 1.647593e+05 1.068792e+05 1.127028e+05 2.431022e+05 1.464087e+05 1.145515e+05 1.502290e+05 1.176002e+05 1.232420e+05 1.586879e+05 1.164604e+05 1.607607e+05 1.008776e+05 1.542145e+05 1.145163e+05 1.421357e+05 1.182157e+05 2.142927e+07 1.449284e+05 1.202023e+05 1.009601e+06 2.207072e+05 1.432228e+05 1.313290e+05 1.907391e+05 1.896514e+05 1.032092e+08 4.834120e+07 3.220572e+05 1.268600e+05 1.636086e+05 1.566601e+05 1.217003e+05 5.373694e+05 1.476962e+05 1.220011e+05 1.162969e+05 1.275718e+05 1.734106e+05 1.638276e+05 1.926220e+05 1.480986e+05 1.366505e+05 1.389910e+05 1.459498e+05 1.481833e+05 3.723572e+05 1.586788e+05 9.378728e+04 1.080248e+05 1.010363e+05 1.267090e+05 1.844325e+05 1.059411e+05 1.061407e+06 1.099608e+05 1.161129e+05 2.565809e+05 1.620037e+05 1.264115e+05 1.170878e+05 1.385487e+05 1.168238e+05 1.268198e+05 1.299418e+05 1.051683e+05 1.724988e+05 1.437824e+05 1.637168e+05 9.846557e+04 1.920743e+05 1.019972e+05 1.570027e+05 1.221111e+05 1.798915e+05 1.198374e+05 1.010658e+05 1.912303e+05 1.000592e+05 1.117406e+05 1.115716e+05 1.930772e+05 1.811639e+05 1.139399e+05 9.273560e+04 1.873666e+05 1.072054e+05 1.880126e+05 1.321130e+05 1.551047e+05 1.754515e+05 1.079386e+05 1.094902e+05 1.583556e+05 1.153260e+05 9.211088e+04 1.263501e+05 1.702009e+05 1.663442e+05 1.432038e+05 1.170655e+05 1.736267e+05 9.988594e+04 1.109718e+05 9.825101e+04 1.141518e+05 1.958941e+05 8.975792e+04 9.063137e+04 9.021624e+04 1.371266e+05 1.444142e+05 1.659965e+05 1.859712e+05 1.811741e+05 1.671060e+05 9.099910e+04 2.156022e+05 1.361616e+05 1.483106e+05 1.108051e+05 9.425300e+04 1.150076e+05 1.741582e+05 1.045679e+05 1.006917e+05 1.109818e+05 1.351957e+05 1.082291e+05 1.395251e+05 1.136400e+05 1.979972e+05 1.165627e+05 1.179754e+05 1.536485e+05 8.932324e+04 1.059164e+05 1.066944e+05 1.358992e+05 1.143714e+05 1.100544e+05 1.006605e+05 9.851978e+04 1.510932e+05 1.347351e+05 1.084314e+05 9.646147e+04 1.445583e+05 1.332694e+05 1.192378e+05 1.140359e+05 1.137172e+05 1.402880e+05 1.732279e+05 1.132254e+05 1.282720e+05 1.898658e+05 1.096925e+05 1.738799e+05 1.762337e+05 1.036341e+05 1.210980e+05 4.115998e+05 1.193916e+05 1.010256e+05 1.214554e+05 1.023995e+05 1.300693e+05 1.643184e+05 1.161005e+05 1.115882e+05 9.681367e+04 1.459919e+05 9.719547e+04 9.571382e+04 1.069491e+05 1.095243e+05 1.016207e+05 1.792430e+05 1.156183e+05 1.707237e+05 1.470948e+05 1.770005e+05 263.88454_3.841 2.534371e+05 5.963250e+07 6.119467e+07 5.721219e+07 2.523357e+05 6.497808e+07 7.486413e+07 6.622332e+07 227523.81 5.318383e+07 6.816596e+07 5.342031e+07 235020.94 7.047414e+07 6.714099e+07 5.959043e+07 2.349825e+05 5.597480e+07 7.065737e+07 6.659160e+07 2.739017e+05 5.280952e+07 6.539780e+07 7.527279e+07 126228.845 4.356853e+07 7.756079e+07 7.097598e+07 1.700082e+05 3.750851e+07 6.704987e+07 7.523309e+07 212664.28 6.240791e+07 5.285358e+07 6.244551e+07 2.829243e+05 6.035591e+07 6.781673e+07 8.709306e+07 2.108397e+05 6.511902e+07 6.098045e+07 2.738174e+07 1.904557e+05 3.970612e+07 7.597637e+07 7.544001e+07 6.442158e+07 6.888672e+07 5.097415e+07 5.427022e+07 4.451516e+07 9.446048e+07 1.792163e+07 1.721342e+07 5.790789e+07 2.058193e+07 7.546063e+07 7.401365e+07 3.558498e+07 1.957592e+07 7.892305e+07 2.701712e+07 3.313650e+07 4.492409e+07 6.291357e+07 1.982163e+07 4.058157e+07 5.303150e+07 2.835173e+07 3.692101e+07 6.705562e+07 4.121197e+07 5.098854e+07 1.710893e+07 5.078927e+07 2.321704e+07 3.076476e+05 3.174342e+07 1.835162e+07 3.864846e+07 3.519507e+07 2.285328e+07 1.747250e+07 5.019287e+07 4.190570e+07 1.056630e+07 4.325386e+07 2.420581e+07 4.427055e+07 3.923581e+07 5.953097e+07 2.763978e+07 2.400936e+07 1.402420e+07 5.061205e+07 1.492581e+07 2.340070e+07 5.010067e+07 2.122386e+07 3.921028e+07 1.184014e+07 4.898458e+07 3.188788e+07 4.876984e+07 4.583759e+07 5.839243e+07 1.211052e+07 7.441731e+06 1.000008e+07 3.237259e+07 1.964413e+07 2.506005e+07 1.076999e+07 1.782416e+07 1.887929e+07 1.886429e+07 1.419903e+07 1.154856e+07 1.434153e+07 1.440036e+07 1.659273e+07 1.593359e+07 1.248115e+07 9.551070e+06 2.317434e+07 1.159269e+07 1.417626e+07 1.973953e+07 1.684011e+07 2.912963e+05 1.318227e+07 1.357913e+07 1.435486e+07 1.343828e+07 1.701921e+07 1.884896e+07 1.574365e+07 1.438695e+07 9.368657e+06 2.056714e+07 2.071043e+07 1.103750e+07 1.310712e+07 1.223974e+07 2.236001e+07 1.516916e+07 1.098321e+07 1.226501e+07 1.825856e+07 2.072913e+07 2.295964e+07 2.208439e+07 1.541223e+07 1.345931e+07 2.069646e+07 2.132233e+07 4.548727e+07 1.097661e+07 1.152744e+07 1.924290e+07 1.559489e+07 1.164737e+08 1.309301e+08 8.582312e+07 7.621642e+07 7.918464e+07 5.866028e+07 1.057734e+08 7.217503e+07 7.034143e+07 9.083274e+07 6.069794e+07 1.006336e+08 5.912631e+07 4.927710e+07 4.311449e+07 3.776556e+07 3.569565e+07 7.112378e+06 3.966940e+07 7.242577e+07 5.525225e+07 4.150838e+07 2.769280e+07 8.361089e+07 3.205653e+07 3.773687e+07 3.350316e+07 1.414014e+08 5.507743e+07 5.687862e+07 5.769703e+07 1.815378e+07 6.767601e+07 6.819021e+07 1.733934e+07 2.174528e+07 7.215214e+07 6.858668e+07 5.818869e+07 1.030474e+08 1.179806e+08 7.561347e+07 6.474573e+07 1.643714e+07 5.103017e+07 7.381541e+07 5.746282e+07 4.180143e+07 4.732622e+06 4.575037e+07 8.026586e+06 2.199920e+07 3.120064e+07 1.491311e+08 1.109300e+08 1.650467e+07 2.194723e+07 1.163280e+08 4.309960e+07 3.759191e+07 5.332506e+07 4.588724e+07 3.004784e+07 7.509099e+07 7.556709e+07 1.061846e+08 6.443060e+07 1.163119e+08 5.350178e+07 7.750902e+07 3.783299e+07 4.960864e+07 6.295776e+07 1.241889e+08 4.919618e+07 7.477408e+07 3.937521e+07 2.712408e+07 3.711704e+07 4.659742e+07 6.828202e+07 5.326136e+07 3.278788e+07 5.730462e+07 5.704414e+07 2.239908e+07 6.481944e+07 3.042705e+07 3.042201e+07 3.771219e+07 2.860679e+07 2.848079e+07 1.962373e+07 2.207426e+07 2.250165e+07 4.267504e+07 3.385620e+07 5.563469e+07 6.092012e+07 "NAE 23:2;O2 (60, 85, M+H-59 m/z)_3.864" 2.218229e+07 9.300398e+06 9.000614e+06 8.927106e+06 1.372547e+05 8.706956e+06 1.057448e+07 9.718972e+06 124860.06 8.521116e+06 8.853891e+06 9.996196e+06 127180.37 8.732849e+06 9.905107e+06 9.527127e+06 1.311183e+05 8.855824e+06 8.724769e+06 1.096468e+07 1.464961e+05 6.410730e+06 9.527894e+06 1.138105e+07 62250.414 8.278317e+06 1.003002e+07 7.631952e+06 8.949352e+04 9.033198e+06 8.457351e+06 1.179461e+07 82649.01 9.399682e+06 8.959301e+06 7.903729e+06 1.470069e+05 8.293819e+06 1.042610e+07 1.034176e+07 7.480710e+04 7.533500e+06 9.906121e+06 1.059279e+07 6.459872e+04 8.669620e+06 7.251040e+06 1.045464e+07 6.070212e+06 1.237596e+07 1.443757e+07 8.047897e+06 6.903358e+06 4.265500e+06 1.008046e+07 7.353275e+06 1.773886e+07 1.296753e+07 2.139953e+07 7.528726e+06 1.473980e+07 1.617670e+07 9.194801e+06 3.053113e+07 9.701635e+06 1.116572e+07 1.515454e+07 4.550692e+06 4.850730e+06 7.610025e+06 5.041344e+06 6.353458e+06 1.103617e+07 7.366263e+06 8.434679e+06 3.739239e+06 1.966258e+07 7.785927e+06 1.804092e+07 7.194814e+06 5.037396e+06 5.373395e+06 1.219456e+07 1.293858e+07 9.520261e+06 1.518601e+07 5.829898e+06 5.016255e+06 6.177099e+06 7.479050e+06 1.771330e+07 6.022013e+06 6.232812e+06 7.067512e+06 1.343234e+07 8.372540e+06 3.321304e+06 8.057432e+06 3.845834e+06 1.117578e+07 5.528015e+06 8.315431e+06 5.714289e+06 5.315199e+06 8.636376e+06 1.147916e+07 4.597368e+06 6.101439e+06 1.921265e+07 1.186796e+07 5.151239e+06 8.031760e+06 9.657351e+06 4.569097e+06 4.899723e+06 3.882064e+06 1.140261e+07 6.935905e+06 7.101209e+06 8.363242e+06 5.230728e+06 1.208797e+07 4.331336e+06 5.309846e+06 4.031573e+06 8.021581e+06 1.351731e+07 5.069620e+06 5.815591e+06 1.121228e+07 7.800251e+06 1.382938e+07 5.752291e+06 1.325633e+07 6.388923e+06 1.125685e+07 1.139747e+07 6.286789e+06 6.724465e+06 1.317620e+07 5.911727e+06 9.688687e+06 5.871189e+06 7.227036e+06 1.345875e+07 5.305505e+06 2.254210e+06 5.059591e+06 8.116602e+06 3.905804e+06 3.826752e+06 5.104065e+06 7.172708e+06 5.916336e+06 4.392183e+06 6.991270e+06 9.700282e+06 6.748529e+06 1.029264e+07 5.570793e+06 9.924062e+06 8.931819e+06 1.223814e+07 6.872941e+06 1.053945e+07 1.042235e+07 1.286800e+07 9.135501e+06 4.416761e+06 1.605314e+07 6.424804e+06 6.458344e+06 5.076085e+06 7.124784e+06 5.344138e+06 1.032785e+07 1.302839e+07 1.232407e+07 8.726364e+06 2.972947e+06 3.354547e+05 7.475806e+06 5.827949e+06 5.761459e+06 5.347132e+06 1.095028e+07 1.045172e+07 9.726845e+06 7.904095e+06 6.702631e+06 8.512296e+06 3.047856e+06 8.467399e+06 4.403220e+06 1.294979e+06 6.809730e+06 9.625726e+06 1.348227e+07 7.317661e+06 7.667041e+06 1.025583e+07 5.606442e+06 7.450102e+06 5.019334e+06 5.194358e+06 4.919749e+06 9.424846e+06 5.690803e+06 9.229688e+06 5.441896e+06 1.003086e+07 1.068803e+07 7.203369e+06 6.312074e+06 2.367740e+06 7.024120e+06 4.470309e+06 6.600630e+06 4.319567e+06 9.806007e+06 5.761188e+06 6.306016e+06 1.384314e+07 3.394826e+06 9.550770e+06 7.573524e+06 7.928131e+06 3.625200e+06 7.211271e+06 4.615297e+06 1.113020e+07 7.097615e+06 7.013243e+06 6.690040e+06 1.265259e+07 1.584595e+07 8.460281e+06 8.105772e+06 8.177518e+06 7.516462e+06 1.438865e+07 5.549322e+06 7.320215e+06 1.164883e+07 5.447163e+06 1.129217e+07 1.072246e+07 1.670660e+07 1.244572e+07 5.143662e+06 4.955456e+06 9.909838e+06 7.484058e+06 1.070092e+07 7.980982e+06 1.441071e+07 7.313343e+06 1.585274e+07 1.006161e+07 3.223275e+06 6.358781e+06 1.511725e+07 C7 H N O9 P2_3.877 1.694903e+05 2.280594e+07 2.579318e+07 1.957839e+07 1.627839e+05 2.209287e+07 2.202960e+07 2.976654e+07 160011.14 1.642934e+07 2.478438e+07 1.780313e+07 148649.15 2.553768e+07 2.467453e+07 2.016433e+07 1.434530e+05 2.738233e+07 2.731287e+07 1.956549e+07 1.844575e+05 2.066051e+07 1.286072e+07 2.628747e+07 74877.146 1.567445e+07 3.921656e+07 2.521814e+07 9.641096e+04 1.329145e+07 2.459269e+07 2.901502e+07 113530.51 1.611351e+07 2.093149e+07 2.438618e+07 1.846729e+05 1.864173e+07 2.335086e+07 3.036114e+07 9.920763e+04 2.253886e+07 1.887924e+07 1.900990e+07 9.292437e+04 2.480826e+07 2.413674e+07 2.283669e+07 2.095427e+07 2.260344e+07 1.542280e+07 2.067523e+07 2.208216e+07 3.346483e+07 4.391654e+06 7.556689e+06 2.239819e+07 7.661067e+06 2.816926e+07 2.400820e+07 1.475566e+07 7.252386e+06 1.717607e+07 1.088029e+07 1.209819e+07 1.106479e+07 2.824868e+07 8.586439e+06 1.611988e+07 1.879971e+07 1.079061e+07 1.402633e+07 2.234133e+07 1.695947e+07 1.705315e+07 5.525010e+06 2.010598e+07 9.166558e+06 1.931866e+05 1.084701e+07 6.890197e+06 1.108792e+07 1.583756e+07 8.929068e+06 7.034109e+06 1.433236e+07 1.028760e+07 3.672845e+06 1.710864e+07 9.084575e+06 1.649073e+07 1.502757e+07 2.025839e+07 9.999606e+06 7.201062e+06 6.090231e+06 1.680841e+07 5.531771e+06 8.354021e+06 1.729845e+07 7.799919e+06 1.316408e+07 4.387359e+06 2.281826e+07 1.266781e+07 1.990338e+07 1.722973e+07 1.529646e+07 4.229702e+06 2.244867e+06 3.068123e+06 1.201523e+07 7.538312e+06 7.758106e+06 4.612973e+06 6.924873e+06 7.764977e+06 6.056988e+06 5.384449e+06 4.157049e+06 4.089095e+06 3.821781e+06 4.841075e+06 5.585913e+06 3.696971e+06 4.050555e+06 9.480336e+06 3.956438e+06 6.032707e+06 6.772455e+06 5.297936e+06 1.921488e+05 4.089931e+06 4.562431e+06 5.124679e+06 5.071583e+06 5.064639e+06 6.868929e+06 5.610394e+06 5.898461e+06 2.588522e+06 6.967645e+06 7.140773e+06 3.766900e+06 5.211592e+06 4.440220e+06 6.937501e+06 5.362547e+06 4.248847e+06 5.579407e+06 6.841867e+06 8.508812e+06 9.492918e+06 8.799742e+06 6.374268e+06 5.063908e+06 8.128675e+06 8.635313e+06 1.830019e+07 3.998746e+06 4.403392e+06 7.379981e+06 1.663778e+07 3.326193e+07 7.457336e+07 3.783878e+07 2.818957e+07 3.231261e+07 1.923333e+07 4.416745e+07 2.594645e+07 2.976593e+07 3.556049e+07 1.986144e+07 3.666214e+07 2.009203e+07 1.760421e+07 1.537754e+07 1.342156e+07 4.946996e+06 1.479021e+07 3.743616e+07 2.466743e+07 2.194286e+07 1.358174e+07 2.675086e+07 2.788024e+07 1.029764e+07 4.505679e+07 3.004815e+07 3.901940e+07 1.890514e+07 2.396766e+07 1.383354e+07 1.340099e+07 2.717878e+07 3.092956e+07 2.420489e+07 8.268291e+06 1.488781e+07 3.655647e+07 2.242535e+07 4.192120e+07 5.890359e+07 2.873127e+07 1.933960e+07 3.660540e+07 1.936964e+07 5.216743e+07 2.394498e+07 1.519078e+07 5.807665e+07 1.317129e+07 6.861644e+07 4.339931e+07 3.147771e+07 3.173803e+07 3.215727e+07 1.637024e+07 2.217914e+07 5.116545e+07 4.208879e+07 1.252339e+07 1.571642e+07 2.252420e+07 2.733720e+07 2.496128e+07 1.877738e+07 4.046676e+07 2.349227e+07 4.559969e+07 4.082963e+07 2.455664e+07 1.927378e+07 2.139935e+07 1.801412e+07 4.385871e+07 1.994926e+07 2.341896e+07 1.483973e+07 9.234159e+06 3.481699e+07 1.138173e+07 1.348982e+07 1.864587e+07 7.366440e+06 1.976767e+07 2.115180e+07 7.665939e+06 2.426050e+07 1.069187e+07 1.089216e+07 1.373964e+07 1.027131e+07 1.147904e+07 6.956627e+06 7.998302e+06 9.006129e+06 1.333616e+07 2.067649e+07 3.181643e+07 1.478556e+07 C11 H15 N3 O6_3.879 3.171750e+06 1.169262e+06 1.274346e+06 1.229053e+06 1.170363e+05 1.021374e+06 1.318980e+06 1.115352e+06 121402.01 1.195018e+06 1.260560e+06 1.226940e+06 121564.07 1.191163e+06 1.164493e+06 1.129273e+06 1.189983e+05 1.241069e+06 1.169033e+06 1.162663e+06 1.190404e+05 1.124154e+06 1.280700e+06 1.377371e+06 50614.439 1.137367e+06 1.141249e+06 1.107911e+06 6.438989e+04 1.158013e+06 1.311217e+06 1.281491e+06 83685.31 1.193472e+06 1.133533e+06 1.107693e+06 1.311826e+05 1.101435e+06 1.160918e+06 1.223425e+06 6.447292e+04 1.210966e+06 1.317467e+06 1.307882e+06 5.606205e+04 1.117548e+06 1.155242e+06 1.160729e+06 1.401392e+06 1.931720e+06 1.002097e+06 1.431050e+06 1.594630e+06 1.435416e+06 2.801690e+06 9.700057e+05 1.263537e+06 1.518203e+06 1.862535e+06 2.490310e+06 6.964419e+06 3.768647e+06 2.085793e+06 1.473090e+06 1.251548e+06 1.033732e+06 2.572880e+06 1.938366e+06 3.457641e+05 6.633469e+05 1.130141e+06 1.078131e+06 2.160445e+06 6.556106e+05 1.436491e+06 9.850910e+05 1.657211e+06 2.030235e+06 1.831723e+06 1.356513e+06 2.222594e+06 1.962925e+06 1.266000e+06 1.177548e+06 1.652724e+06 1.420506e+06 6.206326e+05 1.340329e+06 2.033138e+06 1.274064e+06 1.467567e+06 5.417490e+05 8.097364e+05 2.360915e+06 1.974761e+06 7.651024e+05 1.227640e+06 1.454915e+06 1.142872e+06 3.082929e+06 9.511352e+05 1.487737e+06 1.745402e+06 2.375092e+06 5.259719e+05 7.256214e+05 1.104560e+06 1.147084e+06 3.128090e+06 2.195137e+06 5.289397e+05 1.683632e+06 1.742116e+06 1.427358e+06 7.143226e+05 7.168829e+05 2.136239e+06 9.133984e+05 1.181376e+06 2.775293e+06 8.056566e+05 3.511913e+05 1.177292e+05 7.944003e+05 8.070855e+05 6.242606e+05 6.524089e+05 1.509706e+06 1.743701e+06 2.525165e+06 2.043481e+06 1.785981e+06 1.602280e+06 1.822981e+06 9.032983e+05 1.657985e+06 3.413044e+06 1.425679e+06 1.725918e+06 8.797731e+05 1.529422e+06 2.327812e+06 6.760695e+05 1.427607e+06 1.477272e+06 8.920948e+05 9.243404e+05 1.123465e+06 1.208524e+06 1.291851e+06 1.035289e+06 9.038572e+05 1.018352e+06 4.970721e+06 1.204534e+06 1.526771e+06 1.015631e+06 9.069211e+05 1.085107e+06 1.383899e+06 1.162481e+06 1.781366e+06 1.371018e+06 9.351051e+05 6.840120e+05 1.846847e+06 1.243508e+06 1.484540e+06 1.128613e+06 1.634926e+06 1.329472e+06 9.519628e+05 1.181706e+06 1.667236e+06 2.449269e+06 7.457264e+05 2.090177e+06 8.324926e+05 2.056360e+06 1.628624e+06 1.003599e+06 1.204693e+06 5.772150e+05 7.402621e+05 6.146928e+05 3.853493e+06 1.152350e+06 1.789935e+06 1.562745e+06 9.024640e+05 1.365830e+06 7.098608e+05 5.326526e+05 1.267858e+06 1.058335e+06 1.390799e+06 1.623009e+06 1.981953e+06 2.937360e+06 1.412332e+06 1.099296e+06 1.372601e+06 1.483840e+06 1.171179e+06 8.034437e+05 9.406384e+05 8.279665e+05 8.666603e+05 1.014570e+06 6.641520e+05 1.220836e+06 2.558982e+06 1.945491e+06 1.256860e+06 1.047511e+06 2.442225e+06 7.907823e+05 1.005269e+06 4.647603e+05 1.031971e+06 5.710649e+05 1.305864e+06 1.420530e+06 6.712719e+05 1.695286e+06 8.101250e+05 6.467454e+05 1.140235e+06 1.040358e+06 4.775911e+05 2.271635e+06 6.136270e+05 2.421795e+06 9.182813e+05 5.486322e+05 5.430167e+05 7.412829e+05 9.936673e+05 1.548512e+06 1.920537e+06 3.046135e+06 1.533293e+06 2.207883e+06 3.313903e+06 1.261690e+06 2.394227e+06 2.675340e+06 1.396509e+06 3.717248e+06 7.832817e+05 1.823007e+06 2.993060e+06 1.640605e+06 1.378757e+06 2.115654e+06 1.338224e+06 1.068383e+06 1.526144e+06 1.812125e+06 1.554905e+06 9.853068e+05 1.121326e+06 263.88454_3.89 3.416903e+05 5.280430e+07 6.384667e+07 5.962111e+07 3.260222e+05 6.756405e+07 7.713036e+07 6.176322e+07 325752.16 5.443617e+07 6.925517e+07 5.392465e+07 315027.83 7.107316e+07 6.744346e+07 5.974246e+07 3.048948e+05 5.610266e+07 7.070895e+07 6.650477e+07 3.276078e+05 5.270751e+07 6.505373e+07 7.742879e+07 146006.840 4.324569e+07 7.714663e+07 7.181742e+07 1.963097e+05 3.750814e+07 6.745598e+07 7.610039e+07 222176.04 6.322216e+07 5.363511e+07 6.283669e+07 3.515601e+05 6.030044e+07 6.509014e+07 7.792436e+07 1.942459e+05 5.658085e+07 4.710113e+07 9.536046e+07 1.753661e+05 3.731754e+07 6.210645e+07 6.696363e+07 5.005116e+07 6.933599e+07 3.998927e+07 4.967799e+07 4.516586e+07 9.583334e+07 5.986536e+06 1.512840e+07 5.770130e+07 2.057259e+07 7.603810e+07 7.444770e+07 3.592802e+07 1.470182e+07 7.914219e+07 2.647140e+07 3.113318e+07 3.427658e+07 6.290855e+07 2.012076e+07 4.059886e+07 5.268725e+07 2.919486e+07 3.688922e+07 5.656596e+07 4.101805e+07 5.086141e+07 1.704234e+07 5.080270e+07 2.315373e+07 3.179882e+05 3.016109e+07 1.875978e+07 3.871244e+07 3.460185e+07 2.292510e+07 1.746108e+07 3.730114e+07 3.171126e+07 6.825661e+06 4.308724e+07 2.404311e+07 4.467533e+07 4.008189e+07 5.928057e+07 2.813896e+07 1.774609e+07 1.404210e+07 4.599331e+07 1.235191e+07 2.342752e+07 5.036492e+07 2.129775e+07 3.926628e+07 1.175566e+07 4.972231e+07 3.228981e+07 4.909070e+07 4.648352e+07 5.844728e+07 1.205243e+07 7.498420e+06 1.007108e+07 3.213904e+07 1.954446e+07 2.115779e+07 1.375570e+07 7.577630e+06 1.876988e+07 1.738890e+07 1.434283e+07 1.168552e+07 1.174873e+07 1.133423e+07 1.240930e+07 1.596425e+07 9.555098e+06 9.288138e+06 2.380757e+07 9.983830e+06 1.432466e+07 1.995690e+07 1.674178e+07 3.660028e+05 1.014699e+07 1.364009e+07 9.229123e+06 1.344609e+07 1.376720e+07 1.871986e+07 1.563850e+07 1.435313e+07 7.446584e+06 2.045206e+07 2.081405e+07 1.097050e+07 1.351914e+07 1.233926e+07 1.813290e+07 1.530023e+07 1.115131e+07 1.239989e+07 1.910763e+07 2.081139e+07 2.286464e+07 2.241158e+07 1.536594e+07 1.383341e+07 2.100609e+07 2.187357e+07 4.519098e+07 1.105622e+07 1.168621e+07 1.950778e+07 2.748247e+07 9.229341e+07 1.337969e+08 8.623052e+07 7.440596e+07 9.450761e+07 5.001330e+07 1.043227e+08 7.337774e+07 7.016870e+07 8.583394e+07 6.027295e+07 8.400828e+07 5.999228e+07 4.979969e+07 4.117847e+07 3.783277e+07 3.054349e+07 4.898413e+07 8.767606e+07 7.256366e+07 5.640560e+07 4.132482e+07 6.998164e+07 8.605490e+07 2.732450e+07 1.184913e+08 8.153459e+07 1.438240e+08 5.603352e+07 5.768603e+07 5.707513e+07 1.362302e+07 6.894604e+07 1.268091e+08 7.857406e+07 2.179808e+07 5.666852e+07 7.450082e+07 5.799760e+07 1.022193e+08 1.194855e+08 7.832585e+07 6.500866e+07 9.497485e+07 5.281731e+07 1.064151e+08 5.532433e+07 4.235475e+07 1.603293e+08 4.541876e+07 1.627571e+08 7.833996e+07 8.156841e+07 9.682687e+07 8.647920e+07 7.653559e+07 8.375712e+07 1.186751e+08 9.202274e+07 3.745793e+07 3.911057e+07 4.565848e+07 7.652603e+07 6.772128e+07 5.736650e+07 1.062920e+08 6.654039e+07 1.156085e+08 1.213033e+08 7.862319e+07 3.782305e+07 4.944884e+07 6.261254e+07 1.287557e+08 4.993234e+07 7.060191e+07 4.072258e+07 2.693667e+07 1.055021e+08 4.630440e+07 5.668769e+07 5.359073e+07 2.624853e+07 5.714048e+07 5.767576e+07 2.241864e+07 6.509665e+07 3.072962e+07 3.059037e+07 3.844654e+07 2.936085e+07 2.939420e+07 1.966355e+07 2.270871e+07 2.179229e+07 4.279602e+07 5.577638e+07 7.392547e+07 4.498252e+07 "CAR 18:2 (85 m/z, no M+H-59 m/z)_3.899" 1.539464e+07 7.210130e+06 7.769795e+06 7.731824e+06 1.456501e+05 5.467891e+06 7.632533e+06 8.500801e+06 151287.48 7.445335e+06 7.908358e+06 7.518700e+06 156188.53 6.029013e+06 6.217838e+06 7.864018e+06 1.411268e+05 6.581295e+06 8.514926e+06 8.068707e+06 1.349547e+05 5.530135e+06 7.978902e+06 9.387822e+06 54599.317 6.332265e+06 5.601571e+06 7.193527e+06 7.476459e+04 7.832840e+06 7.082066e+06 8.537170e+06 91960.60 6.787420e+06 7.421193e+06 6.766001e+06 1.222391e+05 6.910279e+06 7.388093e+06 8.077931e+06 7.583578e+04 7.183105e+06 7.209275e+06 8.851010e+06 6.801064e+04 5.859892e+06 5.772360e+06 8.572773e+06 3.704932e+06 8.089666e+06 5.659007e+06 7.557697e+06 7.621636e+06 3.017272e+06 1.125555e+07 7.398425e+06 4.442175e+06 9.829663e+06 1.495448e+07 9.484971e+06 6.714456e+06 1.802639e+07 9.178386e+06 2.536606e+07 4.570249e+06 1.029856e+07 7.731188e+06 2.963000e+06 9.610202e+06 8.630945e+06 4.171142e+06 6.375966e+06 8.526229e+06 4.528652e+06 5.750585e+06 3.224289e+06 1.203374e+07 8.384333e+06 2.274432e+07 7.880051e+06 7.953658e+06 1.019972e+07 9.931013e+06 9.107362e+06 7.592152e+06 1.821651e+07 2.964660e+06 4.546241e+06 4.150846e+06 6.968064e+06 1.191295e+07 3.613820e+06 4.719022e+06 7.333023e+06 1.729553e+07 5.646104e+06 4.682474e+06 1.134892e+07 4.061773e+06 9.360736e+06 3.204017e+06 5.618808e+06 6.316656e+06 4.604185e+06 5.368022e+06 1.299619e+07 7.227323e+06 4.769063e+06 2.128808e+07 1.317297e+07 3.645840e+06 7.547905e+06 7.554940e+06 9.784363e+06 7.959463e+06 3.024733e+06 1.107562e+07 8.143579e+06 4.296099e+06 8.889163e+06 5.319913e+06 6.517576e+06 2.385884e+06 5.433285e+06 2.626849e+06 1.007951e+07 1.009624e+07 7.973859e+06 6.693550e+06 4.422936e+06 4.149219e+06 9.246521e+06 4.065818e+06 1.159230e+07 6.669961e+06 1.057800e+07 9.611878e+06 5.634584e+06 6.050109e+06 9.543221e+06 6.485506e+06 6.869396e+06 7.573047e+06 8.075148e+06 3.512458e+06 5.640100e+06 8.750077e+05 5.723623e+06 8.392751e+06 3.180877e+06 5.102953e+06 5.117707e+06 5.484994e+06 7.774807e+06 7.440279e+06 7.244834e+06 8.828093e+06 5.465784e+06 8.077930e+06 5.219865e+06 9.097009e+06 1.163137e+07 4.620684e+06 4.289585e+06 1.047408e+07 8.493595e+06 1.027032e+07 5.456157e+06 5.783949e+06 1.381647e+07 5.323909e+06 8.061326e+06 5.069913e+06 5.030150e+06 7.153531e+06 6.485307e+06 8.629461e+06 7.701016e+06 8.568692e+06 1.007177e+06 7.893902e+05 3.585209e+06 4.268328e+06 3.662330e+06 1.638578e+06 8.147147e+06 5.947746e+06 4.881690e+06 5.594519e+06 4.751199e+06 5.680198e+06 2.253752e+06 6.906646e+06 2.713807e+06 1.084366e+06 4.952266e+06 7.645130e+06 7.926782e+06 6.148748e+06 6.776373e+06 6.680270e+06 2.915601e+06 4.329904e+06 4.488363e+06 3.473135e+06 4.240192e+06 6.166594e+06 6.159487e+06 7.881289e+06 2.913029e+06 5.846213e+06 5.361253e+06 5.392157e+06 3.904712e+06 3.748250e+06 6.325644e+06 4.280330e+06 7.113588e+06 2.061202e+06 5.823834e+06 5.337794e+06 8.448579e+06 7.245486e+06 5.210758e+06 9.026800e+06 7.773329e+06 3.763553e+06 2.411384e+06 5.062899e+06 2.698873e+06 9.088693e+06 4.865428e+06 8.630777e+06 6.942716e+06 8.807373e+06 1.229446e+07 4.445065e+06 8.273273e+06 5.505283e+06 4.933341e+06 8.977215e+06 9.257894e+06 2.560719e+06 7.284401e+06 3.889342e+06 5.435861e+06 7.141734e+06 1.130737e+07 1.036094e+07 4.736473e+06 4.203826e+06 1.081787e+07 5.349684e+06 7.768991e+06 7.140596e+06 1.048554e+07 8.679409e+06 1.040254e+07 1.063694e+07 1.695932e+06 4.847061e+06 1.316405e+07 C5 H11 N O2 S_3.9 5.521490e+06 2.731102e+06 2.622901e+06 2.526023e+06 1.244558e+05 2.360876e+06 2.572321e+06 2.601789e+06 149009.77 2.569974e+06 2.587469e+06 2.885342e+06 154815.87 2.454828e+06 2.496936e+06 2.638320e+06 1.489189e+05 2.248955e+06 2.318645e+06 3.100856e+06 1.448462e+05 2.316936e+06 2.779279e+06 2.775114e+06 58008.238 2.428612e+06 2.575387e+06 2.275978e+06 7.998362e+04 2.608263e+06 2.517502e+06 2.773986e+06 98157.31 2.586118e+06 2.662019e+06 2.516709e+06 1.275511e+05 2.298697e+06 2.806213e+06 2.310929e+06 7.718006e+04 3.022751e+06 2.356808e+06 2.508190e+06 6.319779e+04 2.022142e+06 3.578524e+06 2.131622e+06 2.087600e+06 3.060797e+06 2.254947e+06 3.113695e+06 4.764842e+06 5.615902e+06 1.735103e+06 7.091409e+06 5.849131e+06 2.414626e+06 7.070587e+06 4.717185e+06 2.912236e+06 2.818752e+06 3.211292e+06 6.818683e+06 1.882791e+06 2.172713e+06 3.439383e+06 3.736805e+06 4.155167e+06 1.901399e+06 3.236967e+06 2.856010e+06 2.082446e+06 8.835665e+05 4.155819e+06 9.955334e+05 4.638069e+06 2.179241e+06 3.857104e+06 2.183236e+06 5.532068e+06 1.614531e+06 4.178921e+06 6.017341e+06 2.126458e+06 3.167110e+06 1.505390e+06 3.849918e+06 5.370229e+06 1.862126e+06 2.784888e+06 1.787791e+06 3.525546e+06 3.680213e+06 3.832389e+06 2.993511e+06 3.037446e+06 1.523862e+06 7.125189e+05 1.750312e+06 3.529795e+06 1.176123e+06 1.116400e+06 1.802166e+06 2.155932e+06 1.374704e+06 3.179294e+06 4.656300e+06 3.393402e+06 3.423004e+06 1.939582e+06 3.479773e+06 3.433424e+06 4.515110e+06 1.422469e+06 4.853563e+06 4.012293e+06 9.834829e+05 2.844959e+06 2.398222e+06 1.179883e+06 1.542837e+06 2.872627e+06 3.005870e+06 2.624304e+06 1.749780e+06 1.678052e+06 1.100122e+06 3.459577e+06 2.436074e+06 1.469988e+06 3.830271e+06 2.968735e+06 3.487347e+06 2.149099e+06 1.754905e+06 2.941052e+06 1.446516e+06 1.856222e+06 3.633125e+06 1.289872e+06 5.911237e+06 2.688638e+06 1.926406e+06 4.174110e+06 3.211602e+06 9.296051e+05 1.411715e+06 1.477665e+06 2.378412e+06 2.959657e+06 3.529428e+06 3.314111e+06 2.807364e+06 2.559479e+06 3.284362e+06 5.873334e+06 2.784975e+06 1.953931e+06 3.789243e+06 2.422395e+06 3.484039e+06 3.878306e+06 3.212374e+06 4.191726e+06 2.265223e+06 3.168134e+06 2.464318e+06 4.657199e+06 2.215783e+06 1.394216e+06 2.393541e+06 4.320878e+06 2.688192e+06 6.034881e+05 2.303790e+06 4.949391e+06 1.664436e+06 7.276775e+06 2.056658e+06 1.443630e+05 9.493285e+05 2.185930e+06 2.059592e+06 1.159560e+06 2.057804e+06 1.243719e+06 2.306622e+06 2.629096e+06 3.324356e+06 3.987968e+06 2.788456e+06 8.381394e+05 1.008640e+06 4.353124e+05 1.760196e+06 1.618748e+06 9.404482e+05 2.479889e+06 6.033704e+06 2.672385e+06 1.287897e+06 3.089796e+06 3.240287e+06 1.076762e+06 6.510468e+05 1.610218e+06 3.767014e+06 1.332602e+06 9.323800e+05 2.014631e+06 9.930621e+05 7.637480e+06 1.023501e+06 9.750930e+05 1.302078e+06 8.888368e+05 4.314867e+06 8.380863e+05 1.457612e+06 7.125027e+05 1.291946e+06 3.249453e+06 2.166766e+06 1.647628e+06 6.078534e+05 1.614665e+06 2.019205e+06 2.007557e+06 1.200028e+06 1.692915e+06 1.017466e+06 2.528421e+06 2.397701e+06 1.551396e+06 1.722739e+06 2.193384e+06 3.564780e+06 3.819934e+06 5.954431e+06 2.794138e+06 1.284621e+06 2.855785e+06 2.683571e+06 1.535668e+06 1.614219e+06 2.535361e+06 3.526294e+06 3.802897e+06 1.680463e+06 2.990335e+06 3.415802e+06 3.533763e+06 6.845100e+06 3.602849e+06 1.538136e+06 2.764786e+06 2.286168e+06 5.126669e+06 1.225601e+06 3.304257e+06 3.835811e+06 C2 H8 N2 O7_3.904 5.305719e+06 1.904745e+06 2.066116e+06 2.325572e+06 1.268400e+05 1.750948e+06 1.936567e+06 2.261117e+06 124788.02 1.937502e+06 2.072915e+06 2.306568e+06 121357.09 2.249658e+06 1.866713e+06 1.394139e+06 1.220380e+05 2.104917e+06 2.168803e+06 2.159157e+06 1.214041e+05 1.924881e+06 2.362166e+06 2.404680e+06 48933.541 1.578162e+06 1.777015e+06 2.093720e+06 6.328248e+04 1.985996e+06 2.232811e+06 2.299095e+06 76428.18 1.810972e+06 2.098487e+06 2.011497e+06 1.037921e+05 1.825176e+06 2.148815e+06 2.013433e+06 6.668440e+04 2.024093e+06 1.963318e+06 2.438547e+06 6.178854e+04 1.943086e+06 1.776031e+06 2.134456e+06 2.046849e+05 4.583339e+05 1.269822e+05 1.235742e+05 7.120415e+05 2.267799e+06 6.258662e+05 2.278383e+06 5.554980e+06 6.997737e+06 1.248232e+07 3.265403e+05 1.167086e+06 5.195561e+05 2.160628e+05 7.538309e+05 6.892318e+05 1.145978e+05 1.227188e+05 2.328003e+05 1.174432e+05 1.738880e+05 4.717922e+05 7.617528e+05 1.284158e+05 1.681064e+06 7.323176e+05 9.736216e+05 1.189847e+05 1.540729e+05 1.522149e+07 1.056825e+07 7.281019e+06 3.198981e+05 4.613135e+06 1.696280e+05 4.722327e+06 6.147532e+06 1.499058e+05 4.673491e+06 1.434236e+05 2.198865e+05 1.703045e+05 8.783606e+05 6.618092e+06 1.100170e+05 2.513909e+05 1.234912e+05 5.300777e+05 5.656135e+06 4.636425e+05 3.636468e+05 2.638012e+05 4.055039e+06 1.232758e+05 1.273846e+05 2.073940e+05 1.198935e+05 6.163059e+05 6.122477e+06 2.585516e+05 1.629089e+05 2.865258e+05 8.244919e+05 3.753584e+05 3.233904e+05 1.222616e+05 2.299700e+05 1.236120e+05 3.643817e+05 8.515088e+07 4.977600e+05 5.382304e+06 1.246701e+05 9.604635e+05 1.199140e+05 2.820982e+05 1.056918e+06 1.635773e+05 1.751082e+05 1.832824e+07 5.939528e+05 3.338214e+05 1.967086e+05 1.190101e+06 2.440565e+05 1.130142e+05 9.153548e+05 1.222230e+05 1.231504e+05 4.230707e+06 1.348556e+07 1.219148e+05 9.196753e+05 1.600794e+06 2.263971e+05 1.192273e+05 1.250377e+05 2.833755e+05 8.339850e+05 1.996410e+05 8.553711e+05 1.042759e+05 1.171466e+05 3.756866e+05 6.687992e+06 1.430952e+07 1.491878e+05 3.253088e+05 2.915691e+05 1.087965e+06 5.189861e+05 1.855971e+05 1.202156e+07 1.679966e+05 1.854717e+05 2.043443e+07 9.163369e+05 1.663492e+05 1.184333e+05 2.577516e+06 4.247046e+05 1.955711e+06 4.857054e+06 6.579969e+05 2.678917e+05 1.125124e+05 1.086273e+05 1.588505e+05 1.310033e+05 1.381807e+06 1.701835e+05 1.630849e+05 1.614374e+05 4.864541e+05 4.659474e+05 1.109720e+05 1.451638e+05 6.670127e+06 2.393351e+05 9.081132e+04 3.647121e+05 1.149739e+05 3.567927e+06 1.113323e+05 1.263332e+05 1.165252e+05 8.185154e+05 2.506331e+05 1.513308e+06 2.068179e+06 1.280636e+06 3.094641e+05 1.152655e+05 1.187815e+05 1.651428e+05 1.024987e+05 1.148764e+05 2.663527e+05 1.931397e+07 1.077622e+05 1.437543e+05 1.522767e+05 1.164881e+06 5.930385e+05 1.418863e+05 1.758968e+05 1.043267e+05 1.969827e+05 2.208995e+05 1.829236e+05 1.100679e+05 3.380098e+05 2.113407e+07 1.594973e+05 1.201946e+05 8.531015e+05 2.413718e+05 2.258556e+05 1.055820e+05 1.792509e+05 3.144304e+05 2.637743e+05 4.990336e+05 1.462383e+07 2.150406e+05 2.174049e+05 1.595396e+05 6.105683e+05 9.337284e+05 1.782981e+05 2.338909e+07 4.401177e+05 2.987502e+05 1.528853e+05 9.658325e+06 1.555090e+05 3.328986e+05 1.188507e+05 2.840021e+05 3.115800e+05 4.204679e+06 1.387165e+05 2.276135e+05 3.937151e+06 7.986888e+06 3.528465e+05 1.981776e+05 4.217048e+05 2.572026e+07 2.703740e+05 6.844335e+05 2.349665e+05 1.833819e+05 PALMITOYLCARNITINE (Peak 1) 1.785560e+07 9.030498e+06 8.335254e+06 8.439940e+06 3.320506e+05 6.476077e+06 9.852561e+06 9.772816e+06 310205.45 8.659302e+06 9.434502e+06 8.718643e+06 317946.31 7.300676e+06 8.373555e+06 8.619514e+06 3.118908e+05 8.727950e+06 7.641683e+06 8.289610e+06 3.019675e+05 7.807769e+06 1.006584e+07 1.074066e+07 116837.941 7.230706e+06 7.820101e+06 8.537246e+06 1.533421e+05 8.808872e+06 8.882561e+06 1.038959e+07 206245.89 6.827538e+06 8.507667e+06 8.392774e+06 2.816648e+05 7.619734e+06 8.369718e+06 9.226602e+06 1.643727e+05 8.712928e+06 8.877658e+06 1.137001e+07 1.458546e+05 6.875722e+06 5.983512e+06 1.014077e+07 6.053404e+06 8.488069e+06 7.395426e+06 1.232976e+07 9.300804e+06 5.173960e+06 9.118088e+06 7.621711e+06 1.729561e+07 1.657505e+07 1.566513e+07 8.547352e+06 1.110074e+07 7.766357e+06 1.015014e+07 1.358972e+07 1.114599e+07 8.213244e+06 8.345345e+06 4.298745e+06 5.284992e+06 5.952179e+06 6.683005e+06 6.137854e+06 7.756246e+06 6.145447e+06 6.634388e+06 4.611156e+06 1.305743e+07 4.827394e+06 8.399201e+06 5.832486e+06 7.055750e+06 7.149455e+06 9.413899e+06 1.075540e+07 6.319297e+06 9.694762e+06 4.345269e+06 4.035153e+06 5.943161e+06 4.372793e+06 1.374780e+07 9.738587e+06 4.271420e+06 5.094847e+06 9.832760e+06 7.849100e+06 6.156642e+06 7.928334e+06 5.039244e+06 1.707043e+06 7.834751e+06 7.044929e+06 4.411008e+06 7.402790e+06 5.858530e+06 8.823879e+06 4.955554e+06 5.658437e+06 1.410031e+07 8.817536e+06 5.514464e+06 6.775137e+06 7.237818e+06 4.277359e+06 7.685894e+06 3.831122e+06 9.655225e+06 5.036206e+06 6.065237e+06 1.093560e+07 4.379914e+06 8.369387e+06 3.184483e+06 3.953961e+06 4.270109e+06 7.200682e+06 1.067226e+07 7.271661e+06 6.539563e+06 8.448112e+06 8.480115e+06 1.066639e+07 6.569551e+06 9.123566e+06 5.960475e+06 9.000198e+06 9.033180e+06 5.485573e+06 5.085222e+06 7.653943e+06 5.916886e+06 8.620908e+06 8.165265e+06 5.116907e+06 8.224890e+06 6.739263e+06 4.627103e+06 5.205966e+06 5.044140e+06 4.196568e+06 7.629194e+06 4.894547e+06 5.652140e+06 5.774611e+06 6.088440e+06 8.656183e+06 7.101490e+06 6.470089e+06 1.109012e+07 1.044624e+07 6.500632e+06 9.627881e+06 6.717050e+06 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9.841979e+06 8.698811e+06 6.560727e+06 1.110949e+07 6.224012e+06 6.182241e+06 1.064933e+07 1.155791e+07 9.998341e+06 7.153768e+06 7.404546e+06 1.004831e+07 7.750774e+06 1.166008e+07 1.163981e+07 1.162619e+07 6.471915e+06 1.031916e+07 8.854511e+06 6.537303e+06 6.148350e+06 1.240555e+07 573.62809_3.909 1.519893e+05 7.238734e+05 1.083507e+06 1.056916e+06 1.446154e+05 1.122957e+06 1.062587e+06 1.031165e+06 141402.37 9.353761e+05 9.657104e+05 1.202974e+06 133310.11 1.048782e+06 8.674859e+05 9.952940e+05 1.293608e+05 1.023483e+06 9.539312e+05 1.014806e+06 1.352821e+05 8.998505e+05 1.177597e+06 1.265279e+06 56088.216 7.274718e+05 1.054107e+06 1.011829e+06 8.000140e+04 8.759928e+05 1.059469e+06 1.110634e+06 102090.49 9.618939e+05 9.985178e+05 1.018112e+06 1.341461e+05 9.041478e+05 1.018378e+06 1.024907e+06 8.094485e+04 1.025883e+06 9.430217e+05 1.477500e+06 7.328199e+04 7.432258e+05 7.695820e+05 1.133671e+06 5.388074e+05 1.276648e+06 1.505291e+05 6.065117e+05 4.822904e+05 1.527611e+06 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6.150415e+05 6.336157e+05 53539.065 6.009302e+05 5.238391e+05 6.754862e+05 7.224684e+04 4.601536e+05 6.836210e+05 6.015849e+05 95184.95 3.824994e+05 6.276466e+05 5.143390e+05 1.163684e+05 5.296836e+05 6.361102e+05 7.312408e+05 6.498871e+04 3.615865e+05 5.857794e+05 7.563265e+05 5.567531e+04 4.709747e+05 4.979634e+05 5.905458e+05 1.021646e+05 1.791037e+05 1.125420e+05 1.230681e+05 1.549363e+05 3.980015e+05 1.953143e+05 1.004659e+06 1.853444e+06 2.895031e+06 2.682369e+06 1.150433e+05 3.195736e+05 1.155297e+05 1.775820e+05 2.430995e+05 4.637947e+05 1.038005e+05 1.646486e+05 2.992329e+05 1.550578e+05 1.256397e+05 3.695769e+05 1.358352e+05 1.124155e+05 1.270809e+06 1.471311e+05 5.367666e+05 1.323914e+05 2.143399e+05 1.204782e+05 4.643651e+06 3.753710e+06 1.611261e+05 3.492376e+05 1.714471e+05 1.302463e+06 2.117876e+06 1.105855e+05 4.538219e+05 1.458271e+05 1.959052e+05 1.422084e+05 2.756064e+05 1.417557e+06 1.087405e+05 1.137981e+05 1.247257e+05 4.779931e+05 4.353951e+06 2.343669e+05 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1.658265e+06 1.413762e+05 1.540891e+05 2.769336e+05 5.080383e+06 1.135534e+05 4.038075e+05 3.029499e+05 1.477344e+05 C14 H17 O8 P_3.911 9.202340e+06 2.041548e+06 2.251812e+06 2.430208e+06 2.121158e+05 1.942924e+06 2.255362e+06 2.446538e+06 204464.42 2.111521e+06 2.203682e+06 2.346637e+06 193911.44 2.342743e+06 1.884939e+06 2.422357e+06 1.843765e+05 2.139684e+06 2.085439e+06 2.302901e+06 2.013816e+05 1.958700e+06 2.539198e+06 2.633355e+06 87294.301 1.763492e+06 2.088100e+06 2.093044e+06 1.013928e+05 2.094006e+06 2.541450e+06 2.453373e+06 123968.30 2.032677e+06 2.285349e+06 2.165029e+06 1.806795e+05 1.909947e+06 2.338138e+06 2.291458e+06 1.132706e+05 2.148889e+06 2.167231e+06 2.671809e+06 1.048791e+05 1.975334e+06 1.840816e+06 2.448326e+06 4.207783e+05 4.505846e+05 2.124181e+05 2.483075e+05 8.703547e+05 3.657093e+06 6.309339e+05 2.425851e+06 8.489562e+06 9.661861e+06 1.513105e+07 3.192006e+05 1.220016e+06 7.836732e+05 3.306151e+05 7.932173e+05 7.287125e+05 3.972554e+05 1.927700e+05 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8.665181e+05 8.089478e+05 1.068841e+06 1.095810e+06 9.084523e+05 6.262047e+05 7.733267e+05 1.210987e+06 4.902977e+05 4.143209e+05 5.297654e+05 7.225669e+05 3.093729e+05 4.799535e+05 5.089731e+05 6.644255e+05 3.227338e+05 6.319748e+05 3.583931e+06 2.898699e+05 4.115606e+05 1.026990e+06 7.133577e+05 4.234659e+05 6.712963e+05 3.140168e+05 5.153816e+05 4.063801e+05 5.103809e+05 5.114950e+05 6.348765e+05 7.623288e+05 2.776292e+06 5.302003e+05 8.155542e+05 4.258027e+05 6.894021e+05 5.205220e+05 8.617022e+05 5.397436e+05 6.175435e+05 3.913612e+05 5.990768e+05 2.809477e+06 6.557407e+05 5.624427e+05 7.315079e+05 1.254241e+06 4.759732e+05 4.258537e+05 4.194627e+06 9.793923e+05 3.804358e+05 4.922933e+05 2.292492e+06 6.579182e+05 9.447380e+05 8.926885e+05 4.555469e+05 8.743850e+05 8.913213e+05 5.522011e+05 9.738715e+05 1.188698e+06 2.071836e+06 1.407014e+06 3.166907e+05 4.399847e+05 6.386268e+06 7.066464e+05 9.111642e+05 7.980509e+05 6.311482e+05 C23 H43 N O4_3.925 6.324147e+06 1.184403e+06 1.240540e+06 1.243881e+06 1.432711e+05 8.764533e+05 1.239943e+06 1.321043e+06 129867.60 1.094607e+06 1.477847e+06 1.405371e+06 128241.45 9.245114e+05 9.989133e+05 1.181946e+06 1.182702e+05 1.158142e+06 1.070485e+06 1.294672e+06 1.190050e+05 9.502699e+05 1.405694e+06 1.615254e+06 50532.793 1.049370e+06 9.662586e+05 9.654486e+05 6.203005e+04 1.230510e+06 1.270775e+06 1.528974e+06 83582.84 9.284090e+05 1.184133e+06 1.036794e+06 1.093589e+05 1.105920e+06 1.254773e+06 1.415444e+06 6.648594e+04 1.326392e+06 9.805780e+05 1.368259e+06 6.092441e+04 8.684554e+05 1.051809e+06 1.390543e+06 8.307350e+05 8.981774e+05 2.285529e+06 1.032838e+06 5.649130e+05 1.369678e+05 1.527655e+05 6.653612e+05 1.229033e+06 1.284378e+06 2.015778e+06 7.643399e+05 1.996521e+06 2.025732e+06 1.162458e+06 3.804435e+06 1.489210e+06 2.968037e+06 1.334935e+06 4.211032e+05 3.822332e+05 5.738487e+05 3.001649e+05 7.035594e+05 1.265441e+06 1.552242e+06 9.371103e+05 1.220348e+05 3.567750e+06 2.931874e+05 1.861909e+06 4.394736e+05 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1.351929e+06 1.827997e+06 2.999205e+05 1.350780e+06 1.006546e+06 4.526094e+05 2.312284e+05 1.377329e+06 2.293239e+06 3.000309e+06 8.520523e+05 6.731328e+05 2.074838e+06 6.221572e+05 2.238001e+05 2.441903e+05 7.759469e+05 6.652864e+05 1.334627e+06 1.836834e+06 2.792980e+06 1.543269e+06 3.246097e+05 1.219914e+05 7.987223e+05 8.154362e+05 9.837466e+05 4.993021e+05 1.858236e+06 1.441611e+06 1.456266e+06 9.237124e+05 1.177178e+06 6.355049e+05 3.557112e+05 1.058495e+06 4.004267e+05 1.086749e+05 1.030898e+06 1.000299e+06 2.485394e+06 1.695098e+06 3.669718e+05 1.284040e+06 1.044431e+06 7.657992e+05 6.429932e+05 6.916569e+05 1.079172e+06 2.041025e+06 6.290251e+05 2.496898e+06 6.510643e+05 2.091814e+06 1.667505e+06 5.800280e+05 5.490357e+05 1.837243e+06 6.331122e+05 4.820896e+05 1.008596e+06 3.101957e+05 1.179783e+06 6.586725e+05 8.738991e+05 1.487584e+06 8.136765e+05 1.526688e+06 1.917192e+06 5.544543e+05 2.928845e+05 8.273141e+05 2.878333e+05 3.258506e+06 1.483871e+06 9.718183e+05 4.532639e+05 2.675756e+06 2.931373e+06 5.600424e+05 6.952830e+05 3.504252e+06 6.388061e+05 1.249702e+06 1.235710e+06 1.716203e+06 1.388256e+06 1.042396e+06 1.623345e+06 1.296011e+06 4.118207e+06 2.406121e+06 7.286983e+05 4.698279e+05 2.584536e+06 9.800743e+05 2.177954e+06 1.539229e+06 3.363562e+06 3.797759e+05 2.242948e+06 1.042822e+06 2.014058e+05 6.768858e+05 1.448387e+06 C21 H41 N O4_3.98 4.718036e+06 1.165771e+06 1.080243e+06 1.954453e+06 1.784196e+05 7.973800e+05 9.163378e+05 1.355391e+06 189897.70 1.072912e+06 1.157829e+06 1.411258e+06 149760.05 1.216870e+06 1.290601e+06 1.240440e+06 1.284814e+05 1.051001e+06 1.095828e+06 1.160634e+06 1.307351e+05 1.093753e+06 1.460716e+06 1.494908e+06 46375.953 1.084449e+06 1.181892e+06 1.015351e+06 8.134906e+04 1.180455e+06 1.254751e+06 1.446497e+06 91098.81 1.014401e+06 1.045911e+06 1.367812e+06 1.298160e+05 1.159701e+06 1.157552e+06 1.160746e+06 8.518392e+04 1.139923e+06 1.406750e+06 1.578639e+06 6.151724e+04 9.307844e+05 9.325825e+05 1.359985e+06 4.528922e+05 1.335780e+06 1.078790e+06 1.082057e+06 1.260686e+06 6.831551e+05 1.231028e+06 7.765977e+05 1.195332e+06 2.215795e+06 2.363889e+06 4.673238e+05 2.382667e+06 1.379548e+06 9.392032e+05 2.432517e+06 1.240938e+06 2.493963e+06 9.561793e+05 5.752562e+05 7.496310e+05 6.647469e+05 4.406453e+05 1.773883e+06 9.626762e+05 8.154794e+05 1.028118e+06 6.272326e+05 2.602149e+06 4.539079e+05 1.371126e+06 4.898916e+05 1.528234e+06 8.039452e+05 1.834808e+06 2.135400e+06 9.963677e+05 9.151671e+05 3.370453e+05 3.786015e+05 1.607671e+06 8.935770e+05 2.303516e+06 1.661946e+06 3.321802e+05 8.405703e+05 1.594796e+06 7.081291e+05 1.454996e+05 1.099782e+06 1.328960e+05 2.672459e+06 1.411186e+06 9.045842e+05 4.090832e+05 3.583741e+05 9.246054e+05 1.651164e+06 5.162806e+05 1.771990e+06 2.202305e+06 1.951965e+06 1.037186e+06 5.721529e+05 7.560868e+05 3.317132e+05 7.307863e+05 7.985111e+05 1.671861e+06 3.752726e+05 1.277533e+06 2.075353e+06 2.226916e+05 1.443776e+06 1.260177e+05 9.645635e+05 4.759412e+05 1.020623e+06 5.475961e+05 6.776626e+05 7.600105e+05 1.487361e+06 1.116620e+06 1.347631e+06 5.989336e+05 4.504045e+05 8.349097e+05 3.154864e+06 8.925551e+05 3.549487e+05 3.917353e+05 7.929610e+05 5.471637e+05 9.839863e+05 1.742133e+06 3.643466e+05 1.596329e+06 8.856301e+05 5.058210e+05 4.901217e+05 1.058989e+06 3.256460e+05 7.236894e+05 2.963388e+05 6.186462e+05 1.088748e+06 5.181244e+05 1.252347e+06 1.232223e+06 3.202806e+06 2.226424e+06 8.120461e+05 1.227461e+06 1.274660e+06 4.365365e+05 4.261240e+05 5.053028e+05 3.386286e+06 2.355489e+06 8.159726e+05 7.410027e+05 1.323733e+06 1.258944e+06 4.782594e+05 4.026409e+05 6.958111e+05 3.238959e+05 1.630349e+06 2.130238e+06 2.358577e+06 8.170464e+05 5.994490e+05 1.306284e+05 1.630033e+06 8.253261e+05 8.425740e+05 3.373852e+05 1.204484e+06 1.409734e+06 1.482872e+06 1.760048e+06 1.670496e+06 6.467202e+05 6.156624e+05 1.081731e+06 5.832316e+05 2.361741e+05 9.200792e+05 7.672679e+05 2.527001e+06 2.184113e+06 3.615918e+05 8.559175e+05 8.046002e+05 9.724277e+05 7.870473e+05 8.866443e+05 1.745360e+06 2.166220e+06 4.198357e+05 2.975043e+06 1.410123e+06 1.873487e+06 1.264818e+06 9.915460e+05 5.571103e+05 1.487159e+06 7.979660e+05 2.231581e+05 5.871905e+05 1.344500e+06 9.928572e+05 1.128046e+06 8.675114e+05 6.562936e+05 7.431776e+05 9.341214e+05 1.550106e+06 8.450818e+05 3.639396e+05 1.261455e+06 1.066796e+06 1.448276e+06 9.260700e+05 9.362658e+05 8.925638e+05 2.461349e+06 3.605715e+06 8.059173e+05 5.327228e+05 1.704779e+05 1.457928e+06 1.192541e+06 1.408649e+06 1.493997e+06 2.235440e+06 7.575983e+05 2.035541e+06 1.683799e+06 4.745591e+06 2.135597e+06 1.094688e+06 8.815104e+05 2.508621e+06 1.639856e+06 1.725321e+06 2.441564e+06 4.123662e+06 2.146478e+06 3.294600e+06 1.192482e+06 6.432007e+05 1.363036e+06 1.507029e+06 C12 H7 O8 P_3.981 4.468548e+05 2.934526e+05 4.152740e+05 3.940621e+05 2.863777e+05 2.685624e+05 4.875746e+05 4.174769e+05 255573.13 2.953828e+05 4.176770e+05 3.913737e+05 203993.08 3.444846e+05 3.898977e+05 4.917076e+05 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5.801618e+06 4.314077e+06 C9 H7 N O6 S_4.059 4.103737e+06 3.816528e+06 4.341823e+06 4.584016e+06 2.795933e+05 3.459902e+06 4.384777e+06 4.117424e+06 316117.99 4.348063e+06 4.399972e+06 4.571689e+06 258357.28 3.705973e+06 3.985326e+06 3.873207e+06 2.162974e+05 4.442953e+06 4.161890e+06 4.419000e+06 2.262373e+05 3.642288e+06 4.672867e+06 4.873045e+06 123431.343 3.510646e+06 3.700315e+06 4.882089e+06 1.351384e+05 3.104782e+06 4.249258e+06 5.149293e+06 183035.49 4.530006e+06 2.985238e+06 4.227217e+06 2.466933e+05 3.739772e+06 4.623962e+06 4.077144e+06 1.497796e+05 3.988858e+06 4.757084e+06 4.299282e+06 1.337166e+05 3.866641e+06 4.428446e+06 3.786246e+06 9.830953e+06 8.982061e+06 1.203324e+06 2.214690e+06 2.768043e+06 5.632064e+06 4.231001e+05 2.329413e+06 5.771738e+06 2.295988e+06 1.477976e+06 2.520070e+07 4.854021e+06 2.442358e+06 2.702989e+06 6.900578e+05 1.861904e+06 4.169924e+05 4.426931e+06 2.036070e+06 9.801227e+05 2.768586e+06 1.235325e+07 5.839551e+05 7.369637e+05 4.968602e+05 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2.203449e+07 3.308087e+07 1.253469e+06 1.446272e+06 1.195666e+06 3.152595e+06 5.226787e+05 2.596479e+06 1.992699e+06 3.035654e+06 3.766935e+06 8.478202e+06 1.869388e+06 3.112736e+05 1.067342e+06 5.304655e+06 1.028899e+06 2.927018e+05 2.095222e+06 2.748864e+05 4.046662e+06 5.393230e+06 1.741690e+06 3.539934e+05 1.039776e+06 2.463452e+05 6.857181e+06 7.847032e+05 3.275995e+05 5.041680e+06 7.541670e+06 3.771062e+06 1.852693e+06 5.031446e+05 C22 H33 N5_4.069 7.615188e+06 3.582535e+06 4.034672e+06 4.729275e+06 1.331760e+05 2.965626e+06 3.838869e+06 4.642879e+06 141620.54 3.720610e+06 4.050317e+06 3.790465e+06 163075.79 3.864875e+06 3.430216e+06 4.084321e+06 1.380217e+05 3.712601e+06 3.849481e+06 3.891290e+06 1.329433e+05 3.595969e+06 4.544714e+06 5.269972e+06 69884.106 2.851832e+06 3.876823e+06 3.285210e+06 8.061017e+04 3.463256e+06 4.341333e+06 4.339150e+06 106907.27 3.105720e+06 4.039552e+06 4.446599e+06 1.542891e+05 4.063023e+06 4.108532e+06 3.832167e+06 1.135083e+05 3.278258e+06 3.505226e+06 3.825316e+06 8.953368e+04 4.537049e+06 3.339192e+06 4.292185e+06 3.802898e+06 7.369922e+06 6.656688e+06 1.193284e+06 3.399346e+06 4.991604e+05 3.140050e+06 1.293105e+06 2.197574e+06 2.635971e+06 3.519425e+06 5.128397e+06 3.848229e+06 7.936056e+06 5.620051e+06 1.339165e+07 1.278868e+06 1.389097e+07 2.523551e+06 4.660625e+05 4.052642e+05 1.767767e+06 6.673160e+05 1.114406e+06 3.107231e+06 7.958753e+06 2.939342e+06 6.758294e+05 7.148994e+06 4.476551e+05 3.604215e+06 4.490654e+06 3.331254e+06 2.055848e+06 8.722967e+06 1.155153e+07 1.556933e+06 6.026616e+06 6.378201e+05 5.591531e+06 6.135964e+06 5.308419e+06 7.415875e+06 4.371082e+06 1.401280e+06 1.845144e+06 1.429678e+07 4.330090e+06 1.368077e+06 1.461089e+06 4.766391e+05 9.418106e+06 8.128227e+05 8.998621e+05 2.362050e+06 1.608568e+06 3.661778e+06 8.822511e+06 3.535859e+06 4.164110e+06 4.514567e+06 7.320866e+06 3.644841e+06 1.017608e+06 1.038707e+06 1.827108e+05 1.630674e+06 2.410774e+06 8.027592e+06 7.087741e+06 1.398034e+06 3.742054e+06 2.753433e+06 5.094413e+06 1.037566e+06 9.938911e+05 1.447826e+06 4.126118e+06 5.027939e+06 7.941601e+06 1.912429e+06 3.345027e+06 5.227845e+06 2.289633e+06 1.119109e+06 1.349308e+06 3.352855e+06 1.054181e+07 2.475318e+06 7.052026e+05 1.132089e+06 5.145311e+06 4.572448e+06 7.771452e+05 4.800546e+06 5.885033e+05 2.971175e+06 3.115955e+06 1.646328e+06 3.733328e+05 1.284795e+06 1.877005e+06 1.787218e+06 4.680214e+06 1.778227e+06 1.705514e+06 2.772731e+06 2.349733e+06 3.067267e+06 7.512261e+06 7.226049e+06 2.263184e+06 5.351651e+06 4.272452e+06 8.251966e+05 6.294983e+05 1.399510e+06 5.231707e+06 1.252118e+07 3.259111e+05 4.521665e+06 8.892228e+06 9.961339e+05 8.260833e+05 1.345326e+06 2.862197e+06 1.315600e+06 4.249362e+06 6.121305e+06 1.505705e+07 3.067415e+06 2.309464e+05 1.783524e+05 6.545147e+05 1.755633e+06 2.382122e+06 6.533845e+05 3.162634e+06 4.182207e+06 2.604748e+06 6.651130e+06 3.221503e+06 3.494649e+06 2.941555e+05 3.866313e+06 1.062237e+06 1.381264e+06 2.552796e+06 3.822113e+05 6.067685e+06 2.671998e+06 7.834525e+06 3.410917e+06 7.051892e+05 1.135535e+06 3.087437e+06 1.027729e+06 5.088743e+06 6.617125e+06 2.558586e+06 1.436003e+07 1.599232e+06 6.805227e+06 2.285232e+06 4.076902e+06 1.075674e+06 1.092756e+06 2.959629e+05 1.360669e+06 4.901426e+06 1.631361e+05 2.437603e+06 1.849658e+06 3.907202e+06 2.828103e+06 9.191672e+06 4.713631e+06 1.334252e+07 8.744241e+05 1.688819e+05 2.109128e+06 9.345308e+05 7.342162e+06 4.525620e+06 4.071944e+06 1.726503e+06 7.347075e+06 1.913246e+07 1.640004e+06 1.917157e+06 8.300156e+06 3.061815e+06 3.382645e+06 3.416037e+06 1.947877e+06 2.446350e+06 1.576155e+06 1.214406e+07 2.636183e+06 1.767446e+07 5.554170e+06 1.719773e+06 2.212225e+06 1.584550e+07 2.879365e+06 4.374173e+06 4.919853e+06 1.309510e+07 8.426959e+06 3.323819e+06 2.722624e+06 1.733849e+05 8.740517e+06 3.139290e+06 C21 H23 N O2_4.075 2.119320e+05 5.186288e+05 4.684186e+05 6.519973e+05 2.038870e+05 3.156775e+05 5.017931e+05 5.930897e+05 195749.31 4.667830e+05 5.699735e+05 5.219859e+05 222984.95 5.139462e+05 4.160678e+05 5.281483e+05 2.085567e+05 5.151444e+05 4.526250e+05 5.239852e+05 2.183706e+05 3.273783e+05 5.769127e+05 6.801510e+05 98342.405 5.472885e+05 5.015871e+05 3.504447e+05 1.194973e+05 4.503989e+05 4.943660e+05 4.796288e+05 183179.25 6.648309e+05 5.577348e+05 5.609399e+05 2.626366e+05 3.071545e+05 3.083043e+05 6.119676e+05 1.448692e+05 3.894872e+05 8.478519e+05 6.255375e+05 1.188944e+05 2.628868e+05 4.598091e+05 4.988616e+05 2.410953e+05 2.144072e+05 2.443122e+05 2.552105e+05 2.793188e+05 2.881515e+05 2.203831e+05 2.822008e+05 2.170526e+05 2.183374e+05 2.851571e+05 2.210458e+05 2.962927e+05 2.324834e+05 2.176977e+05 2.747172e+05 2.560686e+05 2.889924e+05 2.183193e+05 2.821827e+05 2.371887e+05 2.084287e+05 2.340270e+05 2.321157e+05 2.593103e+05 2.004475e+05 2.581415e+05 2.418749e+05 2.305530e+05 2.146146e+05 2.024527e+05 2.738192e+05 1.952810e+05 2.273443e+05 2.395034e+08 2.080671e+05 2.066902e+05 2.244645e+05 2.435470e+05 2.246764e+05 2.095626e+05 1.893100e+05 2.512158e+05 1.885131e+05 2.301782e+05 2.053290e+05 2.157049e+05 2.260026e+05 2.514549e+05 2.160639e+05 2.177427e+05 2.127805e+05 2.184894e+05 2.346037e+05 1.948127e+05 2.820469e+05 2.919936e+05 2.715925e+05 2.532647e+05 3.068117e+05 2.212671e+05 3.003744e+05 2.548233e+05 2.004321e+05 2.249995e+05 2.240654e+05 1.845693e+05 1.992999e+05 2.368006e+05 2.638459e+05 2.553325e+05 2.853918e+05 2.172803e+05 2.060608e+05 2.095054e+05 2.453695e+05 2.142648e+05 2.827473e+05 1.864361e+05 2.607286e+05 1.956522e+05 1.962584e+05 2.017299e+05 2.796440e+05 2.306883e+05 2.710800e+05 2.021576e+05 2.294596e+05 2.386393e+05 1.973921e+05 2.091796e+05 1.985983e+05 2.037423e+05 2.106984e+05 2.302343e+05 2.635266e+05 1.941763e+05 2.612120e+05 2.213997e+05 2.620516e+05 1.871287e+05 2.927398e+05 2.939712e+05 2.506342e+05 1.994647e+05 3.004485e+05 2.009690e+05 1.953057e+05 4.637105e+05 1.917333e+05 1.945801e+05 1.930031e+05 4.029158e+05 3.230541e+05 2.135111e+05 2.318880e+05 2.875573e+05 2.140042e+05 2.833685e+05 2.113199e+05 2.122483e+05 2.913670e+05 1.752596e+05 2.173287e+05 4.433554e+05 2.175759e+05 2.686277e+05 1.818584e+05 2.924732e+05 2.741447e+05 2.090505e+05 2.404438e+05 2.534652e+05 2.423427e+05 2.192580e+05 1.908663e+05 1.981719e+05 3.119818e+05 1.905447e+05 2.519985e+05 1.895369e+05 3.921688e+05 2.652521e+05 1.846582e+05 2.727692e+05 4.010905e+05 2.253943e+05 1.816868e+05 2.188092e+05 3.227066e+05 2.505754e+05 2.291447e+05 1.797296e+05 2.030284e+05 3.319077e+05 2.259244e+05 2.243255e+05 2.172175e+05 2.317378e+05 2.174315e+05 1.906919e+05 1.921579e+05 3.006091e+05 2.081207e+05 2.070092e+05 2.772116e+05 4.665329e+05 2.141580e+05 2.266436e+05 2.167531e+05 2.150464e+05 2.014392e+05 1.784801e+05 1.776384e+05 2.267975e+05 2.215855e+05 2.103801e+05 1.943456e+05 3.867538e+05 2.028886e+05 2.343079e+05 1.932561e+05 1.912598e+05 2.119307e+05 2.724401e+05 2.494999e+05 2.418058e+05 2.821485e+05 2.102709e+05 2.935026e+05 1.951311e+05 1.909668e+05 1.951832e+05 1.878837e+05 2.139094e+05 1.985801e+05 2.253599e+05 2.516333e+05 2.408864e+05 2.588404e+05 2.287502e+05 2.132805e+05 1.839119e+05 2.575239e+05 1.825788e+05 1.896004e+05 1.982164e+05 2.106180e+05 1.926938e+05 3.830337e+05 2.067425e+05 2.680787e+05 2.517816e+05 2.159605e+05 C20 H43 N O2_4.076 6.683628e+04 3.890629e+05 4.077932e+05 3.723990e+05 7.138347e+04 6.851359e+04 2.810316e+05 3.427028e+05 122909.27 3.399979e+05 3.183819e+05 4.709254e+05 180125.66 3.957121e+05 4.275186e+05 4.312337e+05 1.737869e+05 2.663235e+05 3.366408e+05 3.981420e+05 1.483571e+05 2.169748e+05 3.142900e+05 1.863372e+05 47592.978 6.066673e+05 5.177969e+05 5.744180e+05 4.928850e+04 1.442371e+05 2.534214e+05 3.393981e+05 99649.49 2.832750e+05 4.532551e+05 2.360043e+05 1.514129e+05 3.726706e+05 5.228546e+05 4.084497e+05 9.104309e+04 1.711096e+05 5.161529e+05 4.484856e+05 7.868150e+04 3.359714e+05 2.133002e+05 4.260227e+05 1.659525e+05 1.889816e+06 7.423167e+07 1.539909e+05 2.894675e+05 1.677257e+05 1.803071e+05 1.960882e+05 1.341844e+05 1.656049e+05 1.673845e+05 6.405856e+05 1.354921e+05 1.523128e+05 1.800150e+05 3.119362e+05 2.900671e+05 3.341204e+05 1.684556e+05 1.723480e+05 1.872310e+05 1.605665e+05 9.757095e+04 1.728106e+05 2.512222e+05 1.786098e+05 7.509111e+05 1.112229e+06 3.244722e+05 1.461827e+05 1.668936e+05 1.996168e+05 2.221746e+05 1.876789e+05 1.675469e+05 1.729588e+05 1.553461e+05 1.916995e+05 7.618692e+05 1.840191e+05 1.330298e+05 1.057378e+05 1.294971e+06 1.488342e+06 2.696165e+05 4.534871e+07 2.190581e+05 1.763382e+05 1.529006e+05 1.833784e+05 1.761215e+05 3.285141e+06 1.811812e+05 1.056396e+05 9.618058e+04 1.667146e+05 1.750594e+05 1.796246e+06 3.090073e+06 1.461564e+05 8.787348e+04 2.043092e+05 1.324609e+05 1.581811e+05 1.115370e+05 2.337382e+05 2.951705e+05 8.676676e+04 1.419550e+05 1.579890e+05 1.431856e+05 4.297667e+05 3.019066e+05 2.029340e+05 4.138359e+05 1.521516e+05 1.827504e+05 1.606355e+05 1.044582e+05 1.782033e+05 1.789384e+05 2.374392e+05 8.964316e+06 1.634587e+05 3.757246e+05 1.315835e+05 1.596003e+05 1.823571e+05 3.363488e+05 9.022962e+04 9.571882e+04 1.714523e+05 1.352283e+05 9.084395e+04 3.724003e+05 5.290528e+05 9.171416e+04 1.394402e+05 2.236381e+05 1.405258e+05 5.139000e+05 1.741135e+05 3.614234e+05 1.211496e+06 2.275915e+05 1.832419e+05 1.362084e+05 1.044332e+05 1.698844e+05 4.571885e+05 1.107373e+05 1.562375e+05 1.611223e+05 2.333743e+05 1.574065e+05 2.581915e+05 1.703026e+05 1.688413e+05 1.716959e+05 2.418406e+05 1.351108e+05 1.597508e+05 3.260229e+05 1.508222e+05 1.010498e+06 1.006475e+05 2.814088e+06 5.858742e+05 2.396387e+05 2.239155e+05 4.181761e+05 1.753948e+05 1.490201e+05 1.341439e+06 2.022073e+05 4.208412e+05 1.426059e+05 1.905811e+05 9.989814e+04 1.804960e+06 1.939727e+05 1.399958e+05 4.773292e+05 2.622600e+06 1.838711e+05 3.426086e+05 1.244709e+05 1.800222e+07 9.744233e+06 4.908290e+05 4.441400e+05 1.878914e+05 1.426955e+05 1.359372e+05 2.024720e+05 1.526838e+05 1.014161e+05 1.793536e+05 9.790858e+04 7.870645e+04 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4.276119e+06 5.867222e+05 9.737832e+06 7.590366e+06 1.435953e+06 4.527016e+06 4.660245e+06 2.450360e+05 1.429225e+05 4.311164e+06 2.210180e+06 1.291504e+05 9.264622e+06 1.457457e+06 9.207503e+05 1.267544e+06 1.730682e+07 2.809677e+06 1.951807e+06 7.881216e+05 4.676339e+06 2.259427e+07 1.280042e+05 6.715043e+05 1.286041e+06 7.048267e+05 8.259947e+05 6.162092e+05 5.223213e+05 2.878132e+06 2.436022e+05 5.143083e+06 9.635309e+05 2.456487e+06 8.440436e+06 1.906893e+06 1.464695e+07 7.617957e+05 6.886347e+05 6.122116e+05 1.074601e+07 4.982231e+06 1.414553e+06 4.055078e+06 1.520100e+06 4.286243e+05 4.312734e+05 5.535166e+05 4.265523e+06 3.174147e+06 2.659549e+05 1.167248e+06 3.056378e+06 4.099818e+06 5.069805e+06 5.098786e+06 2.766322e+06 1.205653e+06 1.217655e+06 2.367464e+06 3.215832e+06 1.269552e+06 9.342521e+06 7.291651e+06 1.021548e+06 2.011900e+06 3.294214e+06 2.973386e+05 2.843274e+05 1.081749e+07 8.697396e+05 1.144678e+05 2.428131e+06 1.301823e+06 8.655190e+05 3.223034e+06 4.686335e+05 4.632754e+06 2.552155e+06 9.828059e+06 2.632927e+06 4.240788e+05 6.625173e+06 3.276444e+06 1.302029e+05 3.867050e+05 1.753956e+06 2.577095e+05 3.160022e+06 3.275322e+06 1.956548e+07 2.377479e+07 1.123843e+06 9.747920e+05 6.694434e+05 2.550501e+06 4.066204e+05 2.278695e+06 1.625682e+06 2.128890e+06 3.215580e+06 6.559461e+06 1.544540e+06 1.072377e+05 7.757803e+05 3.608172e+06 7.339483e+05 1.272032e+05 1.626106e+06 1.365006e+05 3.401288e+06 5.271332e+06 1.861766e+06 1.320220e+05 8.783961e+05 3.649528e+05 5.325392e+06 6.465590e+05 1.128079e+05 1.351482e+05 5.514141e+06 3.375722e+06 1.441303e+06 1.980392e+05 870.76747_4.094 1.450010e+05 5.158421e+05 3.580041e+05 5.613726e+05 1.404542e+05 2.342365e+05 5.028405e+05 4.737115e+05 115295.26 4.232001e+05 4.773323e+05 5.786519e+05 140212.57 4.304575e+05 1.900880e+05 5.439468e+05 1.226206e+05 3.798644e+05 4.564349e+05 5.187772e+05 1.223293e+05 3.615650e+05 4.600954e+05 5.763904e+05 56891.809 3.609150e+05 3.819447e+05 4.570522e+05 5.792388e+04 4.295883e+05 4.971892e+05 4.802187e+05 79552.69 2.292606e+05 6.115513e+05 4.756645e+05 1.107605e+05 3.249560e+05 4.788705e+05 6.512301e+05 7.385608e+04 2.815230e+05 3.010809e+05 6.447361e+05 5.755487e+04 3.662105e+05 2.747791e+05 5.609596e+05 1.631114e+06 6.968933e+05 9.513429e+04 5.960696e+05 2.302597e+05 4.002692e+05 1.298106e+05 2.057744e+05 2.667349e+05 1.086733e+05 1.501244e+05 3.042904e+06 5.000531e+05 1.565826e+05 1.868723e+05 1.186045e+05 4.052811e+05 2.276644e+05 8.299238e+05 2.131523e+05 2.678604e+05 5.602615e+05 4.147706e+06 1.755119e+05 1.553842e+05 1.258894e+05 1.193744e+05 1.295814e+06 1.283122e+05 3.305491e+06 1.233991e+05 2.980354e+05 1.660953e+06 2.188559e+05 4.341031e+05 1.252102e+05 6.203810e+05 1.207692e+05 1.096994e+05 1.283696e+05 1.917762e+05 1.125537e+05 1.539593e+05 1.211888e+05 1.853631e+05 6.260764e+05 5.888544e+05 6.788432e+05 1.227031e+05 4.465283e+05 4.687897e+05 1.347445e+05 2.976017e+05 4.492497e+05 5.732703e+05 1.454027e+05 5.350129e+05 6.385564e+05 2.232620e+05 1.234510e+05 2.235128e+05 1.771569e+05 2.390246e+05 1.183796e+05 1.924265e+05 2.935166e+06 2.296894e+06 4.277471e+05 1.673604e+05 1.610023e+05 1.890472e+05 1.775128e+06 1.113895e+05 1.355819e+05 2.331669e+06 1.930885e+06 1.535266e+06 1.235362e+05 2.424628e+05 8.900437e+04 1.213725e+05 1.534093e+05 5.904601e+05 1.184630e+05 6.526364e+05 5.269669e+05 5.374513e+05 3.372894e+05 7.852860e+05 2.227906e+06 6.878861e+05 1.572725e+05 1.127620e+06 1.320203e+06 2.122879e+05 4.721553e+05 9.375736e+05 1.537593e+05 1.416997e+05 9.491189e+05 3.982253e+05 1.242257e+05 1.457508e+06 2.306637e+05 2.054007e+05 2.021196e+05 2.282400e+06 1.804560e+05 1.230872e+05 2.220537e+05 2.050811e+05 3.086243e+06 1.266106e+05 1.885342e+05 4.189643e+05 9.609953e+04 1.441674e+05 2.700570e+05 1.680688e+05 1.949904e+05 1.102604e+05 2.284448e+05 1.340436e+05 1.183577e+05 7.427845e+05 2.630085e+05 1.200257e+06 1.134037e+05 1.533941e+05 2.111981e+05 8.341332e+05 1.808061e+06 9.332275e+05 2.856706e+05 1.208793e+05 1.226958e+05 1.887229e+05 1.402881e+05 3.832397e+05 9.755947e+04 1.152406e+05 1.185824e+05 1.319711e+05 1.316678e+06 5.308001e+05 7.166602e+05 7.103908e+05 1.163350e+05 1.714383e+05 4.218514e+05 1.232376e+05 1.301216e+05 1.437370e+05 1.615425e+06 1.185333e+05 2.355064e+05 4.109282e+05 3.238692e+05 1.358187e+05 6.808317e+05 1.199166e+05 1.295625e+05 1.385016e+05 2.177826e+05 1.234756e+05 2.937474e+05 2.343214e+05 4.402642e+05 2.769246e+05 2.912504e+05 7.652647e+05 2.811618e+05 2.075176e+05 3.924259e+05 1.236641e+05 1.092631e+05 4.593628e+05 1.246664e+05 1.293643e+05 6.321119e+05 2.350976e+06 3.230579e+06 1.429531e+05 1.946275e+05 1.535484e+05 6.714011e+05 1.308750e+05 1.163964e+05 1.353054e+05 2.117361e+05 1.212905e+05 9.180205e+05 1.109540e+05 1.198979e+05 1.245888e+05 1.315473e+05 1.408657e+05 1.024225e+05 1.294243e+05 1.237386e+05 2.002849e+05 1.065833e+06 4.507468e+05 1.264814e+05 1.883637e+05 1.234408e+05 8.350832e+05 3.170988e+05 1.265258e+05 1.266938e+05 1.445709e+05 1.133658e+06 1.340674e+05 1.281717e+05 LAUROYLCARNITINE (Peak 1) 9.800934e+06 4.952064e+06 3.956289e+06 3.289968e+06 1.511017e+05 2.419611e+06 4.252381e+06 4.686275e+06 147142.33 4.055938e+06 3.453480e+06 3.545313e+06 178326.06 3.963581e+06 3.812112e+06 3.711555e+06 1.450375e+05 3.827047e+06 3.858998e+06 3.225943e+06 1.434087e+05 3.811619e+06 3.584526e+06 6.630995e+06 60303.874 2.704591e+06 3.508259e+06 3.596566e+06 6.887637e+04 3.468182e+06 3.701994e+06 4.677538e+06 100362.63 3.337590e+06 4.102025e+06 3.929900e+06 1.444215e+05 3.155939e+06 3.810221e+06 3.765525e+06 8.708811e+04 4.243965e+06 4.347234e+06 4.302035e+06 7.010276e+04 2.992413e+06 3.477598e+06 4.200809e+06 2.252834e+06 5.437130e+06 4.933647e+06 3.650781e+06 2.879952e+06 1.572856e+06 2.879396e+06 1.123709e+06 2.502436e+06 3.752325e+06 3.713690e+06 3.086513e+06 5.331773e+06 5.043126e+06 4.318858e+06 5.864138e+06 3.432370e+06 8.564185e+06 2.772956e+06 4.368966e+05 6.576751e+05 1.256489e+06 9.640513e+05 2.035120e+06 1.683182e+06 6.809548e+06 2.855880e+06 1.565477e+06 8.428781e+06 7.279290e+05 2.871016e+06 3.620017e+06 3.345610e+06 2.820473e+06 4.950767e+06 1.057065e+07 2.136367e+06 3.008541e+06 6.441903e+05 1.158048e+06 5.789506e+06 3.667114e+06 5.086518e+06 5.229091e+06 8.637772e+05 1.665452e+06 6.197082e+06 4.236661e+06 1.052923e+06 1.318081e+06 1.087023e+06 9.224078e+06 1.882152e+06 1.972219e+06 2.291229e+06 1.118637e+06 2.449181e+06 8.057160e+06 8.680543e+05 5.636856e+06 2.893512e+06 5.074471e+06 4.399697e+06 9.390783e+05 1.020183e+06 4.712074e+05 4.268083e+06 2.117854e+06 5.499603e+06 2.862695e+06 2.546758e+06 2.905418e+06 1.533374e+06 3.474801e+06 6.667944e+05 1.664117e+06 1.616668e+06 3.276371e+06 5.263421e+06 2.938733e+06 2.203989e+06 2.959896e+06 7.484374e+06 1.773870e+06 9.359931e+05 9.062524e+05 2.228893e+06 7.431104e+06 2.595123e+06 1.130315e+06 9.409271e+05 3.635788e+06 2.092974e+06 1.151534e+06 1.261816e+07 5.328478e+05 3.872429e+06 3.267682e+06 5.063783e+06 3.492089e+05 1.198651e+06 1.577044e+06 2.159819e+06 2.879674e+06 1.057074e+06 1.592561e+06 1.349320e+06 3.711437e+06 1.906032e+06 7.064246e+06 6.030218e+06 2.816384e+06 4.328561e+06 3.172163e+06 1.335953e+06 7.927833e+05 1.369361e+06 1.233589e+07 1.281629e+07 1.105627e+06 4.908088e+06 4.151648e+06 1.933865e+06 5.959944e+05 7.489701e+05 2.810222e+06 2.279761e+06 5.121988e+06 8.585027e+06 1.111913e+07 2.660885e+06 1.602013e+06 1.441720e+05 2.645472e+06 1.787241e+06 3.743448e+06 9.279175e+05 2.406709e+06 5.945870e+06 3.287691e+06 7.992332e+06 3.390914e+06 2.367327e+06 6.327061e+05 3.208468e+06 1.540106e+06 1.470809e+05 2.550640e+06 3.871844e+05 4.522139e+06 3.801009e+06 7.220850e+06 6.229077e+06 2.811778e+06 1.940926e+06 3.760517e+06 1.768349e+06 1.915482e+06 7.465961e+06 1.402590e+06 9.924028e+06 2.705732e+06 4.175105e+06 1.019209e+06 2.464776e+06 2.553339e+05 2.144242e+06 4.986661e+05 9.211025e+05 2.432123e+06 1.927518e+05 1.745533e+06 1.681954e+05 4.005729e+06 1.688960e+06 2.200330e+06 3.562951e+06 1.115164e+07 2.487021e+06 1.281207e+05 3.065098e+06 1.450751e+06 4.558772e+06 3.509647e+06 3.283598e+06 1.893245e+06 5.996744e+06 1.078337e+07 1.395358e+06 1.293857e+06 8.892186e+06 3.326372e+06 3.521450e+06 4.805236e+06 2.142302e+06 4.209301e+06 2.236868e+06 1.157452e+07 5.493813e+06 1.389856e+07 8.749413e+06 4.333510e+06 3.605712e+06 1.232244e+07 2.792686e+06 3.706656e+06 5.704266e+06 1.752438e+07 7.347632e+06 2.921086e+06 2.127350e+06 7.409366e+05 5.502031e+06 4.162602e+06 C19 H21 Cl N2 O2_4.134 1.513881e+07 2.727027e+06 2.921894e+06 2.792910e+06 1.266488e+05 1.723941e+06 2.929973e+06 2.872002e+06 113336.34 2.526019e+06 2.800724e+06 2.907326e+06 117980.33 2.322730e+06 2.712999e+06 2.483993e+06 1.166607e+05 2.698129e+06 2.583741e+06 2.610445e+06 1.232436e+05 2.568701e+06 2.399095e+06 3.113600e+06 53643.351 2.841658e+06 2.477562e+06 2.697540e+06 5.535485e+04 2.347086e+06 2.757022e+06 2.991205e+06 74935.98 2.305807e+06 2.734317e+06 2.565857e+06 9.977650e+04 2.594937e+06 2.544815e+06 2.766696e+06 5.797882e+04 2.334560e+06 2.670920e+06 3.217283e+06 5.876054e+04 2.806050e+06 2.536885e+06 2.279109e+06 1.156249e+05 1.186139e+05 1.019226e+06 1.352319e+05 5.831784e+06 1.276159e+05 2.450208e+06 1.266379e+05 1.326491e+05 1.118509e+05 1.112537e+05 1.130808e+05 1.228788e+05 1.038231e+05 1.162331e+05 1.189781e+05 1.143718e+05 1.049123e+05 1.152022e+05 1.192275e+05 1.205905e+05 1.142355e+05 1.171151e+05 1.228877e+05 3.439823e+06 1.209032e+05 1.119757e+05 1.179507e+05 1.250875e+05 1.150670e+05 1.102819e+05 1.254156e+06 1.117656e+05 1.450568e+05 1.272398e+05 1.110888e+05 1.201630e+05 6.387213e+05 1.029286e+05 1.150590e+05 1.216932e+05 1.076905e+05 1.891527e+06 1.136125e+05 1.166039e+05 1.047219e+05 1.040677e+05 1.160853e+05 1.095377e+05 1.018830e+05 1.107938e+05 1.136013e+05 1.111886e+05 1.140490e+05 1.090337e+05 1.229728e+05 1.234275e+05 1.167715e+05 1.263550e+05 1.176886e+05 1.371075e+05 1.132432e+05 1.129246e+05 1.039444e+05 1.095407e+05 9.911528e+04 1.056272e+05 1.217990e+05 1.027915e+05 1.149084e+05 8.503543e+06 1.186754e+05 1.035095e+05 1.047145e+05 1.047659e+05 1.183243e+05 1.048382e+05 1.191788e+05 1.118027e+05 1.215170e+05 1.041790e+05 2.866826e+06 1.106752e+05 1.197106e+05 1.116695e+05 1.131085e+05 1.870844e+05 1.100594e+05 1.105304e+05 1.175872e+05 1.176682e+05 1.155439e+05 6.539789e+07 1.149206e+05 1.183918e+05 1.077050e+05 1.194614e+05 1.156377e+05 1.047929e+05 1.220142e+05 9.877373e+04 1.806722e+05 1.083296e+05 1.180220e+05 1.212266e+05 1.166710e+05 1.130217e+05 1.153581e+05 1.205153e+05 1.052340e+05 1.104025e+05 1.093640e+05 1.239536e+05 7.531457e+05 1.150637e+05 1.117030e+05 1.184008e+05 1.132507e+05 1.136337e+05 1.038782e+05 6.056661e+05 1.141733e+05 1.045493e+05 1.137656e+05 1.206559e+05 1.126636e+05 2.950217e+06 1.026592e+05 1.192757e+05 1.496537e+05 1.122975e+05 1.231821e+05 1.116850e+05 1.212860e+05 1.102543e+05 1.152396e+05 1.133022e+05 4.616561e+06 1.152809e+05 1.169180e+05 1.167977e+05 1.451870e+05 1.185127e+05 1.104718e+05 1.177646e+05 1.207746e+05 1.169566e+05 1.060917e+05 1.470597e+05 1.630414e+05 1.220332e+05 1.157603e+05 1.008649e+05 1.139694e+05 1.181182e+05 1.269352e+05 1.237513e+05 1.169364e+05 1.227160e+05 1.647393e+08 1.103856e+05 1.233226e+05 1.253135e+05 2.641787e+05 1.152056e+05 1.140095e+05 6.173499e+06 1.152266e+05 1.064725e+05 1.063797e+05 3.414742e+05 1.083211e+05 1.075860e+05 1.060262e+05 1.166770e+05 1.008160e+05 1.227502e+05 1.044508e+05 3.214010e+08 1.041515e+05 6.149783e+06 1.131154e+05 1.109072e+05 1.026217e+05 1.171540e+05 1.363298e+05 1.246764e+05 1.246834e+05 1.220094e+05 1.158750e+05 1.177383e+05 1.631818e+05 1.065908e+05 1.132147e+05 1.132520e+05 1.220540e+05 1.210097e+05 1.210544e+05 1.227867e+05 1.116225e+05 1.494244e+05 1.084447e+05 1.016172e+05 1.161531e+05 1.095065e+05 1.120281e+05 1.137681e+05 1.108146e+05 1.075367e+05 1.689514e+05 2.698235e+05 1.190477e+05 1.095266e+05 1.111915e+05 C5 H5 N O_4.138 1.278560e+07 4.014406e+05 4.334432e+05 4.956852e+05 1.833180e+05 3.309804e+05 5.295488e+05 4.439354e+05 155347.23 1.552405e+05 4.288269e+05 5.513447e+05 170630.60 4.810683e+05 3.024271e+05 4.304891e+05 1.851597e+05 4.233080e+05 3.619165e+05 3.970823e+05 1.861145e+05 5.074056e+05 4.431980e+05 5.989605e+05 147602.408 3.980219e+05 4.330573e+05 3.775526e+05 9.551387e+04 5.098284e+05 3.486384e+05 3.803748e+05 176409.46 4.831815e+05 4.380148e+05 4.340971e+05 2.058713e+05 4.109185e+05 5.159707e+05 4.552770e+05 1.276504e+05 4.197940e+05 4.335018e+05 5.733773e+05 1.400723e+05 2.902034e+05 4.604295e+05 4.392666e+05 1.862959e+05 1.766973e+05 1.296252e+06 3.384902e+05 2.323255e+05 3.144156e+05 3.272400e+05 4.021051e+05 1.583723e+05 1.688027e+05 2.118585e+06 2.947327e+05 2.374522e+05 7.374424e+06 1.854809e+05 4.192813e+05 3.508314e+05 1.701914e+05 2.663365e+05 4.200065e+05 2.292819e+05 2.267073e+05 3.616739e+05 4.842933e+05 6.334423e+05 1.762646e+05 1.864975e+05 1.950369e+05 2.717612e+05 2.606412e+05 1.993687e+05 2.063346e+05 1.571278e+05 2.130366e+05 2.882215e+05 1.778731e+05 1.805566e+05 2.605856e+05 4.697950e+05 1.741378e+05 2.948621e+05 1.593045e+05 2.687785e+05 3.261786e+05 4.065933e+05 1.504489e+05 1.796911e+05 1.824388e+05 2.003731e+05 3.778400e+05 3.472377e+05 4.986049e+05 6.056677e+05 2.026976e+05 2.699077e+05 3.453052e+05 2.701918e+07 2.413464e+05 5.907460e+05 2.328656e+05 2.768628e+06 3.541792e+05 3.131820e+05 6.646169e+05 5.256848e+05 2.782692e+05 1.530955e+05 1.680242e+05 1.580188e+05 2.055251e+05 5.779455e+05 3.702520e+05 2.339373e+05 1.785988e+05 1.807685e+05 3.475318e+05 2.482642e+05 2.142845e+05 2.148535e+05 2.087501e+05 3.323474e+05 2.599743e+05 2.176482e+07 7.409126e+05 1.798942e+05 4.280676e+05 7.479297e+05 2.908349e+05 2.689851e+05 1.771861e+05 2.960356e+05 7.780458e+05 3.902864e+05 2.945028e+05 1.809978e+05 1.770714e+05 2.818775e+05 2.330917e+05 2.099974e+05 2.346417e+05 2.110650e+05 2.183201e+05 1.588897e+05 2.979285e+05 1.632204e+05 2.256420e+05 2.221400e+05 2.141246e+05 3.106348e+05 1.653041e+05 1.761866e+05 1.612224e+05 3.477552e+05 2.688795e+05 2.625752e+05 2.909291e+05 3.218932e+05 8.343642e+05 2.185970e+05 2.305891e+05 2.715062e+05 2.046742e+05 1.455267e+05 1.724017e+05 2.274023e+05 2.419825e+05 2.270655e+05 1.454013e+05 2.365546e+05 3.637838e+05 2.384407e+05 1.944381e+05 4.871345e+05 2.899980e+05 2.984744e+06 2.259814e+05 1.624629e+05 2.977657e+05 1.597809e+05 2.354036e+05 1.472166e+05 1.950609e+05 2.309005e+05 2.457824e+05 3.732375e+05 2.410323e+05 2.265968e+05 3.237717e+05 2.911032e+05 2.877375e+05 3.185109e+05 1.939599e+05 3.348233e+05 1.677007e+05 2.061940e+05 1.602302e+05 1.802234e+05 2.739556e+05 2.777225e+05 2.421232e+05 1.864550e+05 2.675790e+05 3.115529e+05 1.947355e+07 2.129163e+05 3.463646e+05 3.372620e+05 5.776814e+05 1.856570e+05 4.130220e+05 4.410046e+05 1.949323e+05 1.703692e+05 1.996989e+05 3.698173e+05 2.782443e+05 2.337837e+05 1.926544e+05 7.745392e+05 3.715302e+05 4.325669e+05 2.264340e+05 2.250586e+05 1.914404e+05 3.872545e+05 2.980955e+05 3.001863e+05 2.172835e+05 1.698768e+05 2.210135e+05 1.609250e+05 2.834414e+05 1.033027e+06 2.326035e+05 1.740269e+05 3.276112e+05 2.270435e+05 7.101719e+05 2.618183e+05 3.995293e+05 1.496803e+06 2.176241e+05 1.982173e+05 2.187324e+05 1.513541e+05 2.087252e+05 3.227390e+05 2.471333e+05 2.329062e+05 4.307032e+05 1.768134e+05 2.018294e+05 2.035296e+05 4.711131e+05 C20 H31 N5_4.143 1.514929e+07 4.619302e+06 5.255831e+06 7.727297e+06 1.543399e+05 3.458121e+06 4.912002e+06 5.858914e+06 145429.93 5.409665e+06 5.648525e+06 5.828750e+06 157148.78 5.180435e+06 4.978382e+06 4.399565e+06 1.565416e+05 5.494855e+06 5.081007e+06 5.438721e+06 1.587287e+05 5.130263e+06 6.137950e+06 6.740944e+06 71552.062 4.410719e+06 5.188061e+06 4.006163e+06 8.058415e+04 5.298485e+06 6.052984e+06 6.005916e+06 109491.63 4.860810e+06 5.407844e+06 5.080944e+06 1.514795e+05 4.588586e+06 5.556298e+06 6.346827e+06 9.708763e+04 4.466637e+06 5.757964e+06 5.974619e+06 8.191995e+04 4.638199e+06 5.220684e+06 5.288819e+06 3.546992e+06 5.792648e+06 1.064858e+07 3.878232e+06 4.015184e+06 1.167563e+06 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3.523301e+06 1.787384e+06 1.626924e+06 2.452033e+06 1.299249e+07 3.625479e+06 1.678860e+06 1.509755e+06 4.196151e+06 3.697295e+06 1.394391e+06 8.932088e+06 1.210633e+06 6.007590e+06 5.165126e+06 4.327078e+06 1.050807e+06 1.954337e+06 2.551826e+06 2.088948e+06 5.655271e+06 1.463078e+06 2.606454e+06 2.728009e+06 4.218682e+06 4.286158e+06 1.007034e+07 6.902404e+06 3.484940e+06 5.652009e+06 5.319058e+06 1.506954e+06 1.627836e+06 2.306792e+06 9.304372e+06 1.470824e+07 2.734265e+06 4.182555e+06 8.267847e+06 1.663205e+06 1.221291e+06 1.631902e+06 4.392121e+06 3.060011e+06 6.992725e+06 1.619625e+07 2.053859e+07 5.169063e+06 1.684231e+06 1.590453e+05 2.884040e+06 2.266173e+06 3.960456e+06 1.262269e+06 2.821262e+06 5.161408e+06 7.034779e+06 1.089935e+07 6.504308e+06 4.191221e+06 8.323390e+05 6.199420e+06 2.127772e+06 1.654764e+05 3.353435e+06 1.120628e+06 3.697378e+06 5.868213e+06 8.652247e+06 6.191346e+06 5.136295e+06 3.662847e+06 4.492838e+06 2.225936e+06 1.971743e+06 3.628076e+06 3.356241e+06 1.145288e+07 1.103701e+06 8.646495e+06 2.707268e+06 7.000723e+06 2.555877e+05 4.003386e+06 1.814712e+06 6.073947e+05 3.530727e+06 1.438324e+05 1.927147e+06 3.450111e+06 4.104933e+06 5.052850e+06 5.572500e+06 8.238582e+06 1.473919e+07 1.481402e+06 6.335840e+05 3.804264e+06 2.147802e+06 4.148828e+06 5.417543e+06 4.113258e+06 3.501102e+06 1.007422e+07 1.178234e+07 8.254419e+05 2.226401e+06 1.123721e+07 6.499233e+06 4.334323e+06 4.964788e+06 2.112506e+06 5.014345e+06 3.341799e+06 1.639412e+07 7.906180e+06 1.805097e+07 9.496864e+06 4.267752e+06 4.132557e+06 1.990114e+07 4.094949e+06 6.795675e+06 6.713891e+06 6.237662e+06 8.700407e+06 2.696362e+06 2.832878e+06 1.221083e+06 7.649910e+06 4.760681e+06 C7 H10 N2 O4_4.158 1.008209e+06 3.314663e+05 1.433599e+05 2.179288e+05 1.565142e+05 1.288418e+05 1.159965e+05 3.279517e+05 108289.53 2.133245e+05 3.281674e+05 2.459174e+05 108694.26 2.680249e+05 2.287240e+05 3.051656e+05 1.142724e+05 2.077043e+05 1.229484e+05 2.900406e+05 1.275066e+05 1.679878e+05 2.521550e+05 3.507837e+05 41723.247 3.031859e+05 2.022610e+05 2.208889e+05 5.968840e+04 2.917644e+05 2.569235e+05 2.018696e+05 94968.05 1.558171e+05 2.353077e+05 3.065180e+05 1.262702e+05 1.662249e+05 2.985469e+05 1.353353e+05 7.619206e+04 2.850251e+05 3.157338e+05 2.447960e+05 6.427537e+04 1.779023e+05 2.941553e+05 1.741671e+05 1.158372e+05 3.549091e+05 1.817487e+05 5.096303e+05 3.276756e+05 1.511237e+05 4.462210e+05 2.229220e+05 1.613247e+05 1.849291e+05 1.367883e+05 1.337396e+05 6.197943e+05 5.687890e+05 4.621876e+05 2.480071e+05 1.288197e+05 3.097147e+05 2.744944e+05 1.514131e+05 1.131478e+05 1.408852e+05 2.063604e+05 4.679329e+05 3.832566e+05 1.220756e+05 3.231087e+05 1.293242e+05 1.259905e+05 4.175756e+05 2.186112e+06 1.378016e+05 1.163599e+05 2.375518e+05 2.099362e+05 2.443111e+05 1.250578e+05 2.799519e+05 1.455031e+05 1.840579e+05 2.803861e+05 3.164323e+05 2.618661e+05 1.270709e+05 1.405925e+05 1.000848e+05 1.567216e+05 1.130863e+05 1.489034e+05 3.350970e+05 1.183087e+05 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4.401445e+05 3.028711e+05 2.599993e+05 1.224168e+05 1.441975e+05 1.234881e+05 4.279086e+05 2.270503e+05 1.134881e+05 1.644079e+05 1.504512e+05 1.813641e+05 3.243435e+05 2.869587e+05 2.622639e+05 9.378897e+04 1.484458e+05 3.265192e+05 1.313700e+05 2.584192e+05 1.702648e+05 1.294380e+05 1.383634e+05 1.790869e+05 9.230688e+04 1.887562e+05 2.823748e+05 9.513788e+04 1.704412e+05 1.117584e+05 1.898169e+05 1.892646e+05 2.968461e+05 1.428683e+05 3.936763e+05 1.096936e+05 1.127261e+05 2.164394e+05 2.173598e+05 1.833486e+05 1.518513e+05 4.245527e+05 3.088172e+05 1.437937e+05 3.106600e+05 9.870826e+04 4.211629e+05 2.130972e+05 1.651094e+05 3.085525e+05 3.945311e+05 1.159256e+05 4.303009e+05 4.952904e+05 3.398232e+05 1.251420e+05 1.693855e+05 1.169573e+05 3.193065e+05 1.726547e+05 1.388863e+05 2.365497e+05 3.623829e+05 1.770043e+05 5.695699e+05 2.984663e+05 2.028696e+05 1.261806e+05 1.779305e+05 1.128600e+05 2.321901e+05 4.962753e+05 1.500907e+05 1.379734e+05 8.952191e+04 4.264904e+05 3.024618e+05 5.479996e+05 5.174558e+05 3.108706e+05 1.084484e+05 3.433566e+05 9.533225e+04 1.364152e+05 2.769910e+05 3.947054e+05 C19 H33 N O4_4.171 2.888545e+06 1.113717e+06 1.164202e+06 1.214750e+06 1.416281e+05 7.251335e+05 1.110137e+06 1.232032e+06 131095.45 9.666800e+05 1.122546e+06 1.245609e+06 129395.62 9.247237e+05 1.126080e+06 1.070201e+06 1.273338e+05 9.959599e+05 1.002830e+06 1.028465e+06 1.307509e+05 1.035173e+06 1.253364e+06 1.372448e+06 38556.173 8.994852e+05 1.023009e+06 1.032187e+06 6.161056e+04 9.273464e+05 1.129286e+06 1.295537e+06 89873.68 1.068518e+06 9.119043e+05 1.016797e+06 1.388905e+05 1.138995e+06 1.179144e+06 1.253136e+06 9.498470e+04 6.912265e+05 1.228254e+06 1.345824e+06 7.326992e+04 7.833756e+05 9.907097e+05 1.184604e+06 7.209326e+05 1.837077e+06 2.478162e+06 6.189784e+05 1.622063e+06 3.529605e+05 1.225626e+06 2.902420e+05 4.903546e+05 5.620621e+05 1.404612e+06 1.820562e+06 1.618630e+06 2.827388e+06 1.850837e+06 3.111634e+06 6.313339e+05 2.466174e+06 1.238089e+06 2.548842e+05 1.324704e+05 5.284894e+05 1.444395e+05 4.252048e+05 1.306952e+06 1.651133e+06 9.979116e+05 2.383951e+05 2.724373e+06 1.229886e+05 1.022105e+06 1.773527e+06 1.679391e+06 1.327913e+06 1.057641e+06 2.482620e+06 3.112794e+05 1.699937e+06 1.191405e+05 1.612128e+06 2.352665e+06 1.020583e+06 1.900866e+06 2.752826e+06 4.698406e+05 3.557601e+05 3.017842e+06 1.116957e+06 6.361871e+05 3.175296e+05 3.548020e+05 2.243814e+06 2.878517e+05 4.605906e+05 5.218797e+05 9.661054e+05 7.833234e+05 1.618108e+06 1.011969e+06 1.460237e+06 4.989588e+05 2.422623e+06 1.129167e+06 2.777857e+05 3.387777e+05 1.691295e+05 6.005656e+05 9.584745e+05 2.354005e+06 1.651850e+06 6.103518e+05 8.212192e+05 7.890293e+05 1.152705e+06 2.934704e+05 1.307650e+05 5.145331e+05 1.453432e+06 1.463668e+06 1.438426e+06 5.598827e+05 9.727111e+05 2.737019e+06 1.092883e+06 1.305653e+05 2.166392e+05 5.391670e+05 2.096681e+06 6.620714e+05 2.578937e+05 3.175117e+05 2.632453e+06 1.043566e+06 3.380202e+05 7.217457e+05 2.432424e+05 7.093042e+05 9.980899e+05 4.709097e+05 2.323389e+05 3.730267e+05 5.915909e+05 3.842052e+05 1.497170e+06 5.346031e+05 5.828524e+05 6.512493e+05 8.958397e+05 1.259928e+06 1.798804e+06 8.403528e+05 8.317250e+05 1.673499e+06 1.213198e+06 1.148709e+05 1.796720e+05 6.479277e+05 1.488986e+06 3.388984e+06 1.961952e+05 1.226692e+06 1.750547e+06 3.177299e+05 1.414914e+05 2.286626e+05 7.842872e+05 9.022923e+05 1.412646e+06 2.798842e+06 3.360997e+06 1.472208e+06 1.369280e+05 1.551029e+05 9.002259e+05 2.076339e+05 6.817112e+05 2.915002e+05 3.518177e+05 8.343974e+05 1.004936e+06 2.275315e+06 1.662089e+06 1.744596e+06 3.305823e+05 1.671144e+06 3.634644e+05 1.594729e+05 8.843521e+05 3.809399e+05 8.109393e+05 1.094331e+06 1.741363e+06 1.363941e+06 9.306915e+05 7.096988e+05 7.463859e+05 1.313288e+05 8.428426e+05 6.727298e+05 9.067103e+05 1.677984e+06 2.616245e+05 1.415910e+06 5.602875e+05 1.564813e+06 1.352545e+05 1.042823e+06 4.471594e+05 2.968855e+05 1.578592e+06 2.488657e+05 5.946690e+05 1.795054e+05 1.533437e+05 9.536131e+05 3.294688e+06 1.608842e+06 9.009048e+05 3.475076e+05 1.873182e+05 8.271294e+05 4.117869e+05 1.227823e+06 1.834727e+05 9.238651e+05 6.744499e+05 1.315883e+06 2.030790e+06 5.899073e+05 6.857705e+05 1.308030e+06 1.519852e+06 1.036743e+06 6.117643e+05 1.424565e+06 9.266308e+05 4.536194e+05 3.855740e+06 1.476726e+06 2.236752e+06 2.112306e+06 5.514591e+05 7.826553e+05 3.266513e+06 1.040287e+06 1.316674e+06 1.528396e+06 3.096160e+06 1.213222e+06 6.383792e+05 1.013828e+06 6.178258e+05 2.322855e+06 1.402186e+06 C15 H33 N O_4.18 2.411758e+05 5.956176e+05 7.557390e+05 7.287811e+05 2.381940e+05 5.078068e+05 7.195718e+05 6.710744e+05 198191.61 6.457597e+05 7.032801e+05 8.502587e+05 201036.62 6.302506e+05 6.312043e+05 6.879104e+05 2.131286e+05 5.479954e+05 5.447423e+05 7.464650e+05 2.231979e+05 5.760953e+05 7.801476e+05 8.557711e+05 73781.104 6.369615e+05 5.633661e+05 7.212253e+05 1.001492e+05 5.679453e+05 6.328435e+05 6.589909e+05 134248.39 5.577246e+05 9.442583e+05 6.590151e+05 1.915409e+05 5.300918e+05 6.199758e+05 8.754911e+05 1.294629e+05 5.915730e+05 6.565859e+05 6.964148e+05 1.046780e+05 6.180156e+05 5.961939e+05 7.349269e+05 2.321023e+06 8.743542e+05 1.792897e+05 1.912127e+05 2.025890e+05 2.009440e+05 1.926770e+05 1.996422e+05 1.910709e+05 2.014931e+06 1.846449e+05 1.933340e+05 2.164396e+05 1.851394e+05 1.946146e+05 1.979667e+05 1.802583e+05 2.267997e+06 2.078750e+05 2.029097e+05 2.276211e+05 1.966677e+05 1.897162e+05 2.183804e+05 1.862365e+05 2.097351e+05 2.139685e+05 2.236596e+05 2.126124e+05 2.090250e+05 1.956445e+05 1.930459e+05 1.962274e+05 2.215563e+05 1.950979e+05 1.964449e+05 2.150544e+05 1.826180e+05 1.877604e+05 2.238781e+05 2.348183e+05 2.395135e+05 2.229800e+05 1.947240e+05 2.141985e+05 1.846349e+05 1.878577e+05 2.179250e+05 1.933549e+05 1.879847e+05 2.171272e+05 2.019698e+05 1.819830e+05 2.193197e+05 1.884588e+05 2.104180e+05 2.056656e+05 2.240989e+05 2.215301e+05 2.204413e+05 2.281944e+05 2.167863e+05 2.174564e+05 1.838119e+05 2.078027e+05 1.717649e+05 1.869385e+05 2.335056e+05 1.784926e+05 1.900172e+05 2.126949e+05 1.967194e+05 1.776211e+05 1.794491e+05 1.957383e+05 2.105231e+05 1.958683e+05 1.930890e+05 2.011815e+05 1.821151e+05 1.786916e+05 1.728698e+05 2.011117e+05 1.981464e+05 1.752305e+05 2.286909e+05 1.927908e+05 2.111707e+05 1.786696e+05 2.149673e+05 1.985980e+05 1.940259e+05 1.911189e+05 2.109903e+05 1.989850e+05 1.996096e+05 2.163404e+05 2.215253e+05 1.758544e+05 2.123119e+05 1.746554e+05 1.943395e+05 1.815659e+05 2.157743e+05 1.968979e+05 6.869566e+06 3.756159e+06 2.342326e+06 2.232850e+06 1.787788e+06 3.308448e+06 3.954636e+06 6.910664e+06 1.823720e+06 6.580815e+05 1.294557e+06 1.823113e+06 3.726351e+06 3.987201e+06 1.514201e+06 6.083082e+06 7.760530e+06 1.633043e+06 4.802796e+06 5.326768e+06 6.044187e+06 1.749803e+05 1.753357e+05 2.187678e+05 1.987466e+05 1.946748e+05 2.193647e+05 1.901370e+05 5.005939e+05 2.023756e+05 1.854201e+05 1.966617e+05 1.119330e+06 2.038506e+06 1.815785e+05 1.815807e+05 1.192864e+06 2.271934e+05 2.333955e+05 2.472432e+05 2.006756e+05 1.965219e+05 1.778942e+05 1.753190e+05 2.160443e+05 2.167900e+05 2.164419e+05 1.708637e+05 1.989406e+05 1.961929e+05 8.171988e+05 1.662840e+06 2.546433e+05 2.315804e+05 1.316628e+06 3.223035e+05 2.235476e+05 2.431384e+05 1.149356e+06 1.959517e+05 2.138929e+05 1.865182e+05 2.063309e+05 8.812961e+05 1.859674e+05 1.940322e+05 1.891203e+05 2.150836e+05 1.827638e+05 2.291695e+05 1.765824e+05 1.895213e+05 1.778585e+05 2.046679e+05 2.674501e+05 3.461166e+05 2.032191e+05 2.172483e+05 2.013758e+05 3.506379e+05 2.109845e+05 2.373082e+05 2.074666e+05 2.192986e+05 1.905332e+05 2.041221e+05 1.853938e+06 1.265984e+06 3.927003e+06 1.026077e+06 7.979290e+06 1.741563e+06 8.101626e+06 1.133480e+06 7.997378e+06 5.505893e+06 3.050985e+06 1.285442e+07 2.215554e+06 2.577183e+06 1.774745e+06 2.706521e+06 1.888288e+06 1.280329e+06 3.133141e+05 1.685553e+06 4.447173e+05 2.806103e+06 4.177035e+06 C18 H33 N O4_4.207 3.182688e+06 1.968918e+06 1.994896e+06 1.850711e+06 1.316590e+05 1.659925e+06 1.946349e+06 2.066513e+06 128613.58 1.691963e+06 1.878982e+06 2.213685e+06 127565.95 1.849604e+06 1.704060e+06 1.947954e+06 1.235205e+05 1.786850e+06 1.859826e+06 1.999803e+06 1.296301e+05 1.678222e+06 1.882015e+06 2.566380e+06 41301.315 1.558725e+06 1.790044e+06 2.011622e+06 6.441424e+04 1.696596e+06 1.979326e+06 2.026531e+06 113150.71 1.527228e+06 2.110004e+06 1.699734e+06 1.415957e+05 1.707954e+06 1.711575e+06 2.947763e+06 8.718979e+04 1.452312e+06 1.883585e+06 2.162210e+06 7.205216e+04 1.464889e+06 1.638167e+06 2.126603e+06 2.827852e+06 1.994940e+06 2.229618e+06 1.651728e+06 2.650465e+06 1.358577e+06 2.352415e+06 8.990287e+05 5.631694e+05 9.535559e+05 4.060507e+06 2.180974e+06 5.748843e+06 2.937783e+06 2.954713e+06 3.762672e+06 2.923358e+06 2.431358e+06 2.038217e+06 1.555160e+06 4.544994e+05 5.203430e+05 5.343372e+05 1.933885e+06 2.456498e+06 9.793686e+05 1.097333e+06 1.312274e+06 5.614264e+06 3.601031e+05 1.535912e+06 1.639911e+06 1.728461e+06 1.157996e+06 1.345830e+06 4.368911e+06 1.522221e+06 2.731294e+06 1.718188e+06 8.867514e+05 4.987921e+06 1.023211e+06 1.452357e+06 2.109652e+06 1.066965e+06 7.294492e+05 1.482597e+06 2.681668e+06 1.250297e+05 7.174780e+05 9.672945e+05 3.257132e+06 3.167990e+06 9.092650e+05 5.916972e+05 2.414468e+06 1.293514e+06 1.550638e+06 7.137018e+05 1.592982e+06 1.049391e+06 1.468107e+06 1.657019e+06 9.831024e+05 1.611926e+06 1.370559e+05 7.129080e+05 3.847116e+06 1.740720e+06 8.418782e+05 2.032314e+06 1.404893e+06 6.133173e+05 1.992727e+06 3.938617e+05 7.068643e+05 6.884639e+05 8.710458e+05 3.326446e+06 1.725505e+06 7.371050e+05 4.098614e+06 4.236273e+06 2.309907e+06 1.797752e+05 6.017612e+05 8.125797e+05 2.441002e+06 2.188662e+06 6.738712e+05 8.354981e+05 1.818010e+06 8.932882e+05 1.073395e+06 1.784129e+06 8.920276e+05 2.310749e+06 1.753017e+06 8.013161e+05 9.068255e+05 2.468894e+06 6.845664e+05 4.968860e+05 1.643659e+06 6.513774e+05 1.095732e+06 7.343775e+05 1.825154e+06 2.511731e+06 1.765530e+06 1.794421e+06 1.352865e+06 2.783652e+06 1.220853e+06 1.950323e+05 9.591398e+05 7.188200e+05 2.733723e+06 3.001913e+06 1.050170e+06 7.694681e+05 1.371429e+06 7.506946e+05 5.271461e+05 1.015142e+06 2.559361e+06 2.023839e+06 3.167661e+06 3.602028e+06 2.215512e+06 1.547402e+06 4.711232e+06 1.303555e+05 1.909336e+06 6.257486e+05 1.885095e+06 7.140771e+05 1.075587e+06 3.641123e+06 2.834157e+06 3.166670e+06 2.941778e+06 1.954830e+06 9.665461e+05 1.713591e+06 2.455183e+05 1.342612e+05 2.651116e+06 1.645309e+06 3.191047e+06 4.290491e+06 3.983211e+06 2.950580e+06 2.379077e+06 1.858803e+06 2.239834e+06 1.073628e+06 3.053347e+06 2.156100e+06 8.031596e+05 2.750799e+06 7.119267e+05 2.534199e+06 1.318058e+06 3.042031e+06 2.756965e+05 1.239879e+06 8.973424e+05 3.534375e+05 8.541888e+05 2.111452e+06 4.063324e+06 1.257673e+06 1.183058e+05 2.375973e+06 2.063855e+06 1.426316e+06 6.345921e+05 7.901500e+05 3.759413e+05 1.566216e+06 1.142916e+06 1.488544e+06 2.337820e+05 9.809019e+05 9.672503e+05 2.071333e+06 2.839445e+06 9.276855e+05 2.190089e+06 2.001041e+06 3.412225e+06 2.929890e+06 7.809666e+05 2.538665e+06 4.486646e+06 1.770467e+06 6.375216e+06 3.688049e+06 2.708036e+06 5.856086e+06 1.512803e+06 2.519658e+06 3.433941e+06 1.189196e+06 2.343331e+06 2.768412e+06 3.607400e+06 9.333536e+05 1.466103e+06 2.323238e+06 1.632267e+06 2.409065e+06 2.959727e+06 C17 H37 N O2_4.213 1.272872e+05 1.353990e+06 7.835621e+05 9.730106e+05 1.280596e+05 1.072717e+06 1.029931e+06 1.386174e+06 117803.52 9.412387e+05 1.436812e+06 1.192877e+06 133688.31 7.171250e+05 9.410398e+05 9.824751e+05 1.432123e+05 1.108691e+06 9.963430e+05 1.214702e+06 1.437029e+05 1.070035e+06 1.127939e+06 1.445152e+06 44284.069 8.323398e+05 1.075024e+06 9.836697e+05 6.075164e+04 9.270543e+05 9.478266e+05 1.017730e+06 85931.55 1.532402e+06 1.136227e+06 1.133387e+06 1.192592e+05 8.360186e+05 1.125549e+06 1.053642e+06 8.442623e+04 1.038757e+06 1.150501e+06 9.367816e+05 6.004178e+04 9.619196e+05 1.543250e+06 8.487643e+05 2.256278e+06 5.701975e+05 9.579312e+04 1.965619e+05 1.268055e+05 1.177246e+05 1.419133e+05 1.096754e+05 1.693497e+05 3.139706e+05 1.329131e+05 1.910823e+05 1.335645e+05 1.094359e+05 2.719047e+06 1.420696e+05 1.239715e+05 1.986062e+06 1.372851e+05 1.172854e+05 1.561062e+05 2.829656e+05 1.749702e+05 1.496714e+05 9.651358e+04 1.370126e+05 1.247670e+05 1.406584e+05 1.518889e+05 1.483274e+05 1.458392e+05 1.259147e+05 1.105489e+05 1.514767e+05 1.260151e+05 1.389261e+05 1.447234e+05 1.093385e+05 1.028889e+05 1.623984e+05 1.655791e+05 1.639855e+05 1.145877e+05 1.121441e+05 1.451388e+05 1.044043e+05 1.056795e+05 1.505737e+05 1.206095e+05 1.119090e+05 1.497729e+05 1.443897e+05 1.167989e+05 1.242286e+05 1.300002e+05 1.220271e+05 1.219589e+05 1.301423e+05 1.130888e+05 1.295587e+05 1.459661e+05 1.099198e+05 1.291040e+05 1.336198e+05 1.382959e+05 1.088558e+05 1.253471e+05 1.579876e+05 1.363650e+05 1.196445e+05 1.134239e+05 1.183850e+05 1.155513e+05 1.198215e+05 1.179404e+05 1.278174e+05 1.249558e+05 1.225951e+05 1.164779e+05 9.756721e+04 1.214265e+05 1.230433e+05 1.296206e+05 6.185362e+05 1.041216e+05 1.331485e+05 1.442143e+05 1.449381e+05 9.558933e+04 1.395477e+05 1.266903e+05 1.435998e+05 1.201968e+05 1.320902e+05 1.438624e+05 1.326503e+05 1.215628e+05 1.196787e+05 1.067147e+05 1.184003e+05 1.150889e+05 1.285163e+05 1.274092e+05 1.459150e+05 1.368555e+05 8.367536e+06 1.673048e+06 2.638228e+06 2.920605e+05 1.312293e+05 6.684609e+05 4.504465e+05 1.438316e+06 1.612228e+05 1.730733e+05 1.439175e+06 2.175754e+06 4.982362e+06 1.969558e+06 1.511908e+05 5.048564e+06 6.481300e+06 4.548373e+06 3.859470e+06 1.890243e+06 2.682231e+06 9.175694e+04 1.147949e+05 1.411190e+05 1.307413e+05 1.580857e+05 1.420566e+05 1.248232e+05 4.935550e+06 7.861734e+05 1.155379e+05 1.274137e+05 8.187685e+06 9.978484e+06 8.887239e+04 9.902297e+04 8.455496e+06 1.245381e+05 4.109355e+05 1.193037e+05 1.996639e+06 1.280465e+05 1.325073e+05 9.699307e+04 1.322912e+05 1.333031e+05 1.498191e+05 1.120369e+05 1.349928e+05 1.237552e+05 9.438045e+06 6.291567e+06 1.573605e+05 1.359577e+05 1.824037e+07 1.297474e+06 4.450979e+05 5.695278e+05 9.394201e+06 1.277449e+05 1.200610e+05 9.622321e+04 1.413598e+05 5.121057e+06 1.098285e+05 1.383822e+05 1.319783e+05 1.090209e+05 5.254376e+05 1.476838e+05 1.443901e+06 1.460710e+06 7.896323e+05 1.400408e+06 1.602941e+06 1.216148e+06 1.186147e+05 4.964600e+05 1.086546e+05 7.831173e+05 1.904485e+05 1.345025e+05 1.302552e+05 1.642365e+05 1.463691e+05 1.144587e+05 8.307765e+05 5.092519e+05 5.215848e+06 1.505527e+06 1.065276e+07 1.490690e+06 2.129177e+06 5.662796e+06 8.821413e+06 3.959791e+06 7.549657e+06 1.583234e+07 6.114329e+05 1.785924e+06 7.958298e+05 2.193012e+06 6.416640e+05 3.268681e+05 1.212977e+05 1.504648e+06 4.255485e+05 6.826227e+05 5.851009e+06 Decanoylcarnitine_4.226 2.469802e+07 1.195508e+07 1.294990e+07 1.324750e+07 1.472875e+05 1.064389e+07 1.381387e+07 1.444729e+07 138574.03 1.189423e+07 1.324038e+07 1.352009e+07 143295.73 1.033486e+07 1.273277e+07 1.290161e+07 1.380106e+05 1.193070e+07 1.324715e+07 1.368991e+07 1.431726e+05 9.418144e+06 1.353955e+07 1.604773e+07 44850.515 1.105425e+07 1.365665e+07 1.185159e+07 6.846871e+04 1.067190e+07 1.175550e+07 1.382843e+07 114887.31 1.356999e+07 1.232928e+07 1.208352e+07 1.543138e+05 1.254723e+07 1.251680e+07 1.351978e+07 1.034047e+05 1.171192e+07 1.372976e+07 1.426438e+07 8.320575e+04 1.069168e+07 1.072366e+07 1.416150e+07 4.002857e+06 1.603195e+07 1.887224e+07 1.452062e+07 6.242289e+06 2.611738e+06 5.358240e+06 3.644025e+06 8.142986e+06 6.697849e+06 9.483778e+06 8.131636e+06 1.709201e+07 2.212841e+07 1.098762e+07 3.041579e+07 7.294290e+06 2.676179e+07 1.177930e+07 1.700630e+06 2.662600e+06 5.346239e+06 1.840266e+06 6.823197e+06 7.906599e+06 6.122239e+07 4.497643e+06 3.638871e+06 3.264553e+07 2.224733e+06 9.325627e+06 1.478109e+07 9.064316e+06 1.450892e+07 1.087621e+07 4.273496e+07 6.188014e+06 9.882745e+06 2.310935e+06 1.666340e+07 2.871982e+07 1.029757e+07 2.015033e+07 1.606365e+07 3.247032e+06 5.153724e+06 1.931840e+07 1.670013e+07 5.650513e+06 4.520930e+06 5.191745e+06 2.369371e+07 6.064985e+06 8.767589e+06 7.339728e+06 5.345211e+06 8.486808e+06 3.930772e+07 3.328425e+06 1.483805e+07 5.674950e+06 2.381844e+07 1.671575e+07 2.523242e+06 3.154046e+06 2.000933e+06 1.524065e+07 7.741246e+06 2.957520e+07 1.725372e+07 8.197032e+06 8.244161e+06 6.164636e+06 9.875154e+06 2.094561e+06 4.307806e+06 4.828597e+06 1.054133e+07 1.150296e+07 1.148800e+07 6.007479e+06 1.257507e+07 1.935181e+07 7.185402e+06 2.980702e+06 5.247980e+06 5.939903e+06 2.063474e+07 6.380776e+06 3.880188e+06 3.258219e+06 8.435250e+06 5.678097e+06 3.206967e+06 5.040277e+07 1.238229e+06 1.175664e+07 1.348165e+07 2.340211e+07 2.571331e+06 4.485915e+06 7.529772e+06 7.007520e+06 1.308587e+07 3.500712e+06 4.739904e+06 5.425396e+06 1.701081e+07 7.257222e+06 5.333392e+07 1.380830e+07 5.678885e+06 1.233360e+07 1.079991e+07 3.550574e+06 1.919801e+06 8.844886e+06 2.348338e+07 4.028309e+07 4.274935e+06 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1.238732e+06 9.548105e+05 3.393311e+05 1.415081e+06 2.764631e+06 C22 H41 N8 O5 P S_4.254 1.552225e+06 1.397406e+06 1.708559e+06 1.828999e+06 1.597200e+05 2.024809e+06 1.785315e+06 2.211589e+06 145782.94 1.618593e+06 1.372294e+06 1.988992e+06 125388.59 1.539721e+06 1.892486e+06 1.906256e+06 1.009972e+05 1.458804e+06 1.510703e+06 2.477490e+06 1.021532e+05 1.550983e+06 1.765796e+06 2.113851e+06 35460.085 1.135723e+06 1.999362e+06 1.782973e+06 5.255206e+04 1.337079e+06 1.704021e+06 2.115757e+06 83233.89 1.798800e+06 1.736934e+06 1.983924e+06 1.077158e+05 1.331271e+06 1.913010e+06 1.944665e+06 7.499508e+04 1.351383e+06 1.918406e+06 2.022737e+06 6.390620e+04 1.562865e+06 1.612141e+06 1.855071e+06 1.130542e+06 1.256633e+06 7.326828e+05 6.214641e+06 1.311641e+06 1.803194e+06 1.393121e+06 3.022574e+06 2.193748e+06 2.495353e+06 1.999792e+06 2.071293e+06 1.443534e+06 3.190986e+06 2.282518e+06 2.498029e+06 2.950773e+06 1.704084e+06 1.062064e+06 1.087678e+06 1.727770e+06 2.101489e+06 4.083344e+06 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1.215555e+06 1.523416e+06 1.034338e+06 3.050751e+06 1.822294e+06 2.031253e+06 1.750775e+06 9.579778e+05 1.494685e+06 1.983504e+06 9.750537e+05 2.145213e+06 1.083448e+06 1.108105e+06 1.625502e+06 1.799896e+06 1.705268e+06 1.135184e+06 1.817503e+06 1.796318e+06 2.128525e+06 1.110158e+06 1.892634e+06 1.046864e+06 1.381054e+06 1.178325e+06 1.146364e+06 2.374269e+06 2.749026e+06 2.608835e+06 4.917697e+06 2.528028e+06 1.238734e+06 9.542709e+05 3.393317e+05 1.415027e+06 2.763529e+06 C22 H47 N3 O5 S_4.255 4.370243e+06 3.941118e+06 3.908851e+06 4.632459e+06 1.326624e+05 3.215434e+06 4.574572e+06 4.663846e+06 128057.24 2.960780e+06 4.438692e+06 4.591584e+06 119723.91 3.934146e+06 3.756943e+06 4.503794e+06 1.124670e+05 3.092269e+06 3.809780e+06 4.532103e+06 1.160694e+05 3.538690e+06 4.724064e+06 4.370984e+06 36056.696 3.697280e+06 3.930758e+06 4.233371e+06 5.203605e+04 3.393111e+06 4.429356e+06 3.953368e+06 86879.74 4.095065e+06 4.355891e+06 3.953623e+06 1.090759e+05 3.399675e+06 4.021654e+06 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1.547086e+06 1.373285e+06 135315.31 1.162623e+06 1.218060e+06 1.254494e+06 115130.37 1.213068e+06 1.747596e+06 1.405229e+06 1.008929e+05 9.483929e+05 1.245824e+06 1.429189e+06 1.130414e+05 1.178990e+06 1.498398e+06 1.399313e+06 37902.125 9.815514e+05 1.530385e+06 1.325256e+06 5.166725e+04 1.026438e+06 1.240521e+06 1.406933e+06 83581.18 1.369459e+06 1.459152e+06 1.277061e+06 1.063175e+05 1.128625e+06 1.386347e+06 1.335716e+06 7.437031e+04 1.091829e+06 1.501836e+06 1.399420e+06 6.446574e+04 1.154122e+06 1.262690e+06 1.340811e+06 9.206173e+05 1.091353e+06 6.328734e+05 3.800689e+06 1.076686e+06 1.240511e+06 1.040121e+06 2.618974e+06 1.554534e+06 2.183964e+06 1.847320e+06 1.791382e+06 1.174795e+06 2.285609e+06 1.741302e+06 2.455905e+06 2.078584e+06 1.325456e+06 7.169315e+05 7.997701e+05 1.410146e+06 1.926640e+06 3.319290e+06 1.332567e+06 1.910968e+06 2.055719e+06 1.368645e+06 1.743567e+06 1.053346e+06 2.431724e+06 1.859717e+06 1.997340e+06 5.837467e+05 1.418730e+06 4.537501e+05 1.727529e+06 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1.024063e+06 1.857417e+06 5.931355e+05 1.844498e+06 1.191039e+06 1.507125e+06 9.547696e+05 8.201345e+05 6.382583e+05 1.682264e+06 1.052437e+06 7.388151e+05 6.262612e+05 5.371517e+05 1.395313e+06 2.791313e+06 1.761048e+06 6.474977e+05 1.204840e+06 1.210661e+06 7.011958e+05 1.108675e+06 1.264813e+06 2.720901e+06 9.383963e+05 1.210184e+06 8.126975e+05 1.960551e+06 1.049000e+06 6.240874e+05 2.119677e+06 7.864986e+05 1.679968e+06 2.717979e+05 8.427956e+05 7.132079e+05 7.298863e+05 5.292123e+05 1.630877e+06 7.342926e+05 9.173643e+05 7.107673e+05 1.270847e+06 1.111806e+06 2.406391e+06 6.946790e+05 6.315581e+05 9.521341e+05 2.203012e+06 1.379757e+06 8.588869e+05 6.278804e+05 9.236537e+05 2.793091e+06 1.518865e+06 6.915088e+05 1.189811e+06 5.712799e+06 1.118704e+06 9.452480e+05 1.102435e+06 1.642384e+06 1.282096e+06 1.296786e+06 7.953305e+05 1.233631e+06 6.830496e+05 2.120184e+06 1.694359e+06 1.758843e+06 1.142689e+06 6.814275e+05 1.386378e+06 1.573266e+06 6.686505e+05 1.682460e+06 8.115833e+05 8.342390e+05 1.561714e+06 1.435016e+06 1.315902e+06 1.005517e+06 1.245651e+06 1.259726e+06 1.510432e+06 8.993374e+05 1.141469e+06 7.196029e+05 1.107014e+06 9.268361e+05 9.385775e+05 1.517980e+06 1.828624e+06 2.152368e+06 3.661776e+06 2.112847e+06 8.410685e+05 4.788174e+05 2.675399e+05 1.332220e+06 1.913747e+06 "NAE 15:2;O2 (60, 85, M+H-59 m/z)_4.264" 2.446270e+07 1.362639e+07 1.431586e+07 1.430164e+07 1.687039e+05 1.183682e+07 1.496877e+07 1.643217e+07 161898.86 1.382229e+07 1.453145e+07 1.517219e+07 164681.12 1.301601e+07 1.205741e+07 1.481663e+07 1.622488e+05 1.243048e+07 1.320105e+07 1.862754e+07 1.731150e+05 1.010614e+07 1.615000e+07 1.683204e+07 69640.675 1.207562e+07 1.409143e+07 1.407932e+07 9.047936e+04 1.008511e+07 1.592639e+07 1.321523e+07 140838.20 1.538657e+07 1.401028e+07 1.297707e+07 1.622219e+05 1.360560e+07 1.666712e+07 1.343043e+07 1.040696e+05 1.280138e+07 1.427133e+07 1.838236e+07 8.978298e+04 1.088887e+07 1.251563e+07 1.501688e+07 7.596371e+06 1.990502e+07 2.168074e+07 1.764976e+07 1.862146e+07 4.041882e+06 1.091022e+07 6.785442e+06 9.296915e+06 9.203480e+06 1.578619e+07 1.841333e+07 1.927271e+07 3.105173e+07 1.835321e+07 3.667534e+07 6.863054e+06 3.540593e+07 1.332754e+07 2.939452e+06 3.280153e+06 8.644586e+06 6.062975e+06 6.432474e+06 1.128242e+07 5.473643e+07 7.166164e+06 6.547701e+06 2.955805e+07 2.331704e+06 1.492558e+07 2.217929e+07 1.056045e+07 2.010034e+07 1.609508e+07 4.270919e+07 6.525710e+06 1.412056e+07 3.294068e+06 2.049715e+07 2.352660e+07 1.880583e+07 2.856865e+07 1.954998e+07 8.622901e+06 6.626898e+06 3.107313e+07 1.501751e+07 8.386574e+06 3.926359e+06 5.099137e+06 2.279660e+07 5.541042e+06 8.647662e+06 7.941853e+06 9.589451e+06 8.102746e+06 2.541192e+07 1.399529e+07 1.314467e+07 8.220824e+06 2.870341e+07 1.226467e+07 5.999992e+06 5.375758e+06 4.538948e+06 1.035335e+07 1.133602e+07 2.925290e+07 2.011742e+07 8.785563e+06 1.331045e+07 7.871425e+06 1.240672e+07 2.514688e+06 5.876224e+06 5.915379e+06 1.720789e+07 1.126652e+07 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5.239030e+06 2.564108e+07 2.832691e+07 1.052534e+07 3.270345e+07 5.210624e+06 1.971676e+07 1.287033e+07 1.486416e+07 3.896574e+06 1.184157e+07 9.351548e+06 4.060201e+06 8.089902e+06 4.745414e+06 1.356448e+07 1.292417e+07 1.244183e+07 1.541444e+07 3.487281e+07 3.121845e+07 3.184007e+07 5.533824e+06 3.441891e+06 8.710350e+06 5.802217e+06 2.683475e+07 9.362074e+06 1.442014e+07 1.009852e+07 2.283583e+07 3.692775e+07 9.249382e+06 8.730246e+06 1.686043e+07 1.426788e+07 1.212567e+07 1.360424e+07 2.126263e+07 1.261649e+07 7.605054e+06 3.817630e+07 1.430394e+07 3.605011e+07 2.281768e+07 5.933736e+06 1.157607e+07 5.003324e+07 1.382015e+07 1.271950e+07 1.290562e+07 3.528094e+07 3.190189e+07 7.408134e+06 1.273329e+07 1.474553e+07 3.902965e+07 1.846477e+07 C22 H45 N3 O5 S_4.272 2.247301e+06 2.200217e+06 1.978538e+06 2.159413e+06 1.516344e+05 1.482252e+06 2.348450e+06 2.426250e+06 127335.72 1.780571e+06 2.127330e+06 2.365470e+06 115721.60 1.910700e+06 1.977240e+06 2.279432e+06 1.106661e+05 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2.466125e+06 C14 H32 N9 P_4.281 5.693009e+05 5.435402e+05 3.754868e+05 3.193938e+05 1.222658e+05 2.679698e+05 3.304806e+05 4.145471e+05 119595.47 4.349904e+05 4.372050e+05 6.464159e+05 126414.51 1.831790e+05 3.080204e+05 4.610988e+05 1.362804e+05 2.102452e+05 4.156978e+05 3.116642e+05 1.260788e+05 3.009333e+05 4.124194e+05 7.207270e+05 41044.760 3.117368e+05 4.047581e+05 2.425348e+05 6.470734e+04 2.160695e+05 3.445849e+05 6.121221e+05 120401.95 3.891118e+05 3.551513e+05 4.545336e+05 1.543910e+05 3.324210e+05 2.473426e+05 3.437680e+05 1.095929e+05 3.156815e+05 6.689392e+05 4.122621e+05 8.545083e+04 2.716234e+05 2.765158e+05 4.656771e+05 7.957856e+05 3.914219e+05 4.306067e+05 2.562228e+05 1.409880e+06 2.038195e+05 2.533487e+05 1.348911e+05 1.064573e+05 1.436073e+05 9.972768e+05 4.808130e+05 2.267115e+05 9.085382e+05 1.047515e+06 2.040778e+05 4.250353e+05 1.576676e+05 3.811174e+05 1.769904e+05 1.308732e+05 1.913103e+05 1.122274e+05 1.185612e+05 2.855731e+05 1.211051e+05 1.321315e+05 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1.332001e+05 8.640479e+05 1.445913e+05 6.632193e+05 1.481265e+05 3.334823e+05 1.062887e+06 1.365466e+05 7.126328e+05 1.113540e+05 1.154437e+05 4.710474e+05 1.146529e+05 6.653680e+05 1.120958e+05 1.529871e+05 3.317887e+06 1.007477e+06 1.687652e+05 5.696015e+05 2.632456e+05 2.114421e+05 4.062256e+05 1.820489e+05 5.232300e+05 2.378144e+05 1.918273e+05 1.160735e+05 2.009527e+05 4.853473e+05 2.022067e+05 5.564386e+05 1.639829e+05 C16 H31 N O4_4.286 2.278860e+06 9.580200e+05 1.311808e+06 1.661703e+06 1.654797e+05 9.410882e+05 1.348822e+06 1.449992e+06 152319.31 1.207994e+06 1.269055e+06 1.453673e+06 157889.43 1.181216e+06 1.103853e+06 1.324831e+06 1.471074e+05 1.081264e+06 1.222341e+06 1.286419e+06 1.518735e+05 1.179706e+06 1.448866e+06 1.429548e+06 56824.043 1.217817e+06 1.276873e+06 1.185000e+06 9.845137e+04 1.090348e+06 1.284493e+06 1.339101e+06 125498.07 1.185823e+06 1.391908e+06 1.323452e+06 1.457103e+05 1.216764e+06 1.037703e+06 1.496976e+06 1.070333e+05 1.046906e+06 1.428011e+06 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1.806478e+06 1.776489e+06 2.538041e+06 1.455583e+06 1.447414e+06 1.287771e+06 4.112318e+06 1.916062e+06 2.829897e+06 2.961974e+06 1.661330e+05 1.664310e+06 7.272619e+05 1.574986e+06 1.282295e+06 1.615396e+06 1.042302e+06 1.039513e+06 3.115128e+06 5.667778e+05 6.654460e+05 1.498754e+05 3.581992e+06 1.833022e+06 6.767852e+05 1.318283e+06 1.998457e+06 2.296154e+06 1.638771e+06 4.929270e+05 6.326441e+05 1.131126e+06 1.098229e+06 8.988246e+05 5.720131e+05 5.160412e+05 1.353729e+06 1.093910e+06 2.513870e+06 9.624310e+05 5.289955e+05 1.013234e+06 2.218110e+06 1.742476e+06 1.952230e+06 2.916417e+06 4.661540e+06 6.092172e+05 3.367677e+06 1.362091e+06 1.083694e+06 2.062375e+06 1.174723e+06 1.026531e+06 1.432099e+06 8.997171e+05 1.712566e+06 1.501427e+06 1.135787e+06 8.851653e+05 6.912840e+05 1.954844e+06 1.120566e+06 2.591489e+06 1.736273e+06 C13 H20 Cl N O_4.3 6.206893e+05 2.732980e+06 1.861449e+06 1.990936e+06 1.790779e+05 1.724237e+06 2.463616e+06 2.289237e+06 143610.58 2.390477e+06 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2.854511e+06 C10 H13 P S2_4.312 8.143579e+07 7.841909e+07 7.262709e+07 7.516536e+07 4.950598e+05 6.275736e+07 8.128782e+07 7.154559e+07 274315.64 6.303113e+07 8.208477e+07 8.533913e+07 1030530.78 7.796961e+07 5.642438e+07 5.990730e+07 4.650571e+05 8.016610e+07 7.599929e+07 8.086866e+07 3.649046e+05 6.394652e+07 8.327295e+07 8.136997e+07 54463.423 6.337356e+07 8.286004e+07 7.929182e+07 9.322551e+04 5.563105e+07 5.695879e+07 8.510629e+07 124068.49 7.972597e+07 7.779715e+07 7.931718e+07 4.264510e+05 5.311965e+07 7.905531e+07 7.867935e+07 8.022146e+04 6.956907e+07 7.592756e+07 8.271117e+07 4.164548e+05 6.417930e+07 7.219453e+07 7.365600e+07 4.716951e+07 1.548678e+08 5.472116e+07 4.621067e+07 8.409123e+07 5.273058e+07 7.628452e+07 6.151967e+07 1.557809e+08 6.622225e+07 7.308195e+07 6.094372e+07 6.245490e+07 5.105630e+07 5.989662e+07 1.629165e+08 1.061257e+08 1.038881e+08 8.466575e+07 7.002150e+07 3.736274e+07 5.234885e+07 1.065136e+08 1.435477e+08 8.187977e+07 6.403324e+07 1.084155e+08 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1.063068e+08 8.700195e+07 8.605734e+07 1.437818e+08 9.899440e+07 1.494734e+08 9.405389e+07 7.689448e+07 6.211286e+07 7.385436e+07 1.171430e+08 7.275319e+07 2.962999e+07 1.230426e+08 1.215989e+08 9.056632e+07 6.715367e+07 1.004733e+08 7.974943e+07 5.216406e+07 1.015825e+08 5.869236e+07 4.981142e+07 6.465087e+07 5.049979e+07 7.327962e+07 8.004160e+07 1.281889e+08 1.207024e+08 9.928401e+07 1.025133e+08 8.220146e+07 5.447776e+07 1.616412e+08 6.130640e+07 7.963259e+07 9.431524e+07 1.357749e+08 1.205023e+08 6.576093e+07 6.130511e+07 8.336295e+07 7.464108e+07 5.166316e+07 5.644817e+07 7.194956e+07 8.371353e+07 1.121535e+08 7.448576e+07 7.923913e+07 1.265302e+08 1.117460e+08 7.185403e+07 6.690116e+07 1.291532e+08 8.515301e+07 6.278591e+07 6.682675e+07 1.038786e+08 8.906348e+07 5.599133e+07 8.048519e+07 4.799299e+07 6.294877e+07 8.128561e+07 C10 H11 N3 O4 S_4.313 4.375589e+07 3.560656e+07 3.524290e+07 3.809034e+07 1.524111e+05 2.475110e+07 3.819083e+07 3.370376e+07 146653.71 2.782203e+07 3.881217e+07 3.600693e+07 143993.06 3.482130e+07 3.525396e+07 2.463492e+07 1.904658e+05 3.555777e+07 3.539048e+07 3.668747e+07 1.369464e+05 3.199326e+07 3.713567e+07 3.586606e+07 56584.144 3.055715e+07 3.702385e+07 3.983825e+07 2.002354e+05 2.648288e+07 2.817092e+07 3.763414e+07 108426.95 3.416539e+07 3.677076e+07 2.995355e+07 1.292335e+05 2.994606e+07 3.457991e+07 4.260592e+07 7.963067e+04 2.972204e+07 3.530403e+07 3.958403e+07 8.608885e+04 3.188322e+07 2.764389e+07 3.559151e+07 2.336056e+07 6.341091e+07 2.906513e+07 1.697960e+07 4.324315e+07 2.502624e+07 3.645924e+07 5.385512e+07 7.830764e+07 3.625273e+07 3.334513e+07 2.167416e+07 2.238419e+07 3.010153e+07 2.393687e+07 7.196945e+07 4.776137e+07 4.849392e+07 3.570889e+07 3.079350e+07 1.598894e+07 1.740662e+07 4.254577e+07 5.517187e+07 5.664511e+07 2.511410e+07 4.668024e+07 3.257263e+07 4.176654e+07 1.364892e+07 2.405932e+07 2.364933e+07 4.053750e+07 3.246927e+07 4.857270e+07 6.103877e+07 2.121683e+07 3.488872e+07 2.149201e+07 4.923331e+07 4.181737e+07 2.358734e+07 4.329349e+07 3.828568e+07 4.452629e+07 4.435557e+07 4.854217e+07 3.632297e+07 2.270472e+07 1.278948e+07 3.434848e+07 3.775469e+07 3.572786e+07 3.284851e+07 2.743942e+07 4.009474e+07 5.440346e+07 3.892303e+07 2.834918e+07 2.499467e+07 2.148044e+07 5.402095e+07 2.144087e+07 3.697789e+07 3.542523e+07 2.478995e+07 3.688585e+07 2.575776e+07 7.521095e+07 3.502339e+07 3.569608e+07 4.729676e+07 2.953981e+07 3.246636e+07 1.401495e+07 3.359183e+07 1.909524e+07 2.600494e+07 3.957833e+07 4.342176e+07 3.911062e+07 1.822697e+07 3.274812e+07 3.323589e+07 2.464421e+07 4.479842e+07 3.574297e+07 3.950275e+07 7.820736e+07 2.427620e+07 3.471967e+07 3.291484e+07 3.370390e+07 3.300474e+07 3.989170e+07 2.709387e+07 5.491236e+07 3.514580e+07 4.013977e+07 2.884923e+07 2.309447e+07 2.384984e+07 2.833904e+07 4.904386e+07 2.327276e+07 2.530046e+07 3.369140e+07 2.627179e+07 2.495911e+07 8.694934e+07 4.627559e+07 3.025981e+07 1.944264e+07 1.829408e+07 2.371246e+07 2.384240e+07 4.288463e+07 4.914065e+07 3.602603e+07 2.147086e+07 3.216055e+07 6.252619e+07 4.633408e+07 2.499580e+07 3.316164e+07 1.424208e+07 3.254724e+07 3.248556e+07 5.058305e+07 2.489258e+07 4.400685e+07 3.123680e+07 1.726549e+07 2.638125e+07 2.881985e+07 3.071176e+07 2.312735e+07 4.324081e+07 2.511776e+07 3.768142e+07 3.018270e+07 2.576006e+07 3.511588e+07 2.569722e+07 2.850620e+07 1.576894e+07 1.085064e+07 2.499731e+07 2.975842e+07 4.981152e+07 3.605706e+07 3.776831e+07 6.721169e+07 3.338923e+07 6.482408e+07 4.124837e+07 3.445515e+07 2.662198e+07 3.247140e+07 3.573500e+07 2.880328e+07 9.733616e+06 6.177210e+07 5.193462e+07 4.067947e+07 2.709370e+07 5.558976e+07 3.196165e+07 2.248376e+07 3.259207e+07 2.207234e+07 1.900680e+07 2.785705e+07 2.078154e+07 2.977426e+07 2.942386e+07 5.154628e+07 5.639926e+07 3.772785e+07 4.250768e+07 3.126458e+07 2.187160e+07 5.433740e+07 2.462773e+07 4.269700e+07 3.086197e+07 6.678779e+07 5.577609e+07 1.916159e+07 3.341376e+07 3.810214e+07 3.583533e+07 2.886777e+07 2.579508e+07 3.379788e+07 3.735949e+07 4.743424e+07 3.432521e+07 3.421384e+07 6.801712e+07 4.465662e+07 3.249891e+07 3.086985e+07 6.463947e+07 4.448103e+07 2.305584e+07 2.675899e+07 4.715860e+07 4.224544e+07 2.429253e+07 3.781479e+07 1.911974e+07 2.563950e+07 2.927430e+07 168.98246_4.313 9.653845e+06 9.825431e+06 9.176319e+06 9.238193e+06 3.259019e+05 8.689065e+06 1.070133e+07 1.076022e+07 289655.07 8.903458e+06 1.023568e+07 8.825268e+06 375735.28 9.562787e+06 1.044813e+07 9.472653e+06 2.676023e+05 8.016575e+06 9.898786e+06 9.512300e+06 2.829852e+05 8.869128e+06 1.076983e+07 1.118966e+07 106265.416 8.482821e+06 1.021759e+07 9.562109e+06 1.608774e+05 8.247149e+06 8.535867e+06 1.103066e+07 193265.67 8.489103e+06 1.102520e+07 8.729284e+06 2.435704e+05 1.026069e+07 9.871834e+06 8.579956e+06 1.700137e+05 9.275827e+06 8.752405e+06 1.299056e+07 1.681036e+05 8.299350e+06 9.218208e+06 9.346340e+06 7.112595e+06 1.471333e+07 6.896810e+06 6.652159e+06 9.899061e+06 5.895012e+06 9.651724e+06 1.193239e+07 1.872203e+07 9.387529e+06 1.010370e+07 7.762099e+06 7.224165e+06 7.933556e+06 7.498314e+06 1.910324e+07 1.468570e+07 1.748348e+07 1.135659e+07 8.083902e+06 4.730728e+06 5.006694e+06 1.372272e+07 1.224015e+07 1.048897e+07 7.973647e+06 1.165860e+07 7.118307e+06 1.218670e+07 4.182576e+06 6.269272e+06 7.058085e+06 1.094444e+07 1.245765e+07 1.655983e+07 1.569912e+07 6.767954e+06 8.518437e+06 5.766479e+06 1.690969e+07 1.240122e+07 8.065736e+06 1.457006e+07 8.346352e+06 1.079219e+07 1.132823e+07 1.363728e+07 1.002969e+07 7.251204e+06 4.965617e+06 1.203860e+07 9.996215e+06 1.321535e+07 7.399529e+06 7.373388e+06 1.092820e+07 2.112045e+07 9.411294e+06 7.474343e+06 9.588424e+06 6.293565e+06 1.201666e+07 5.621960e+06 9.604364e+06 1.061533e+07 9.031085e+06 1.042511e+07 6.626861e+06 1.629958e+07 8.511585e+06 7.463740e+06 1.251067e+07 6.747166e+06 9.632492e+06 5.518081e+06 7.015149e+06 7.621420e+06 7.880300e+06 8.477474e+06 1.086991e+07 1.162944e+07 6.611858e+06 7.989306e+06 6.595167e+06 6.677985e+06 9.510404e+06 1.003209e+07 9.809486e+06 1.416926e+07 7.579773e+06 1.014618e+07 9.397752e+06 1.002449e+07 8.709598e+06 1.303036e+07 8.090211e+06 1.420111e+07 9.382537e+06 1.363577e+07 7.698761e+06 6.227263e+06 7.381393e+06 9.106220e+06 7.978534e+06 7.264628e+06 6.381458e+06 1.043610e+07 8.135116e+06 7.218264e+06 2.112523e+07 8.579156e+06 7.205280e+06 5.263736e+06 5.125818e+06 8.654826e+06 8.337881e+06 8.988455e+06 1.707483e+07 8.536061e+06 8.994420e+06 1.299835e+07 1.550645e+07 1.228342e+07 8.484181e+06 9.405904e+06 5.065540e+06 8.202648e+06 9.838641e+06 1.200853e+07 1.026178e+07 1.278106e+07 7.573059e+06 5.959447e+06 7.110059e+06 9.746001e+06 1.231881e+07 6.971999e+06 9.627434e+06 7.747029e+06 1.146263e+07 8.386430e+06 7.863094e+06 1.084952e+07 6.515055e+06 7.101298e+06 6.649409e+06 4.772406e+06 7.246294e+06 7.678473e+06 1.251865e+07 1.097490e+07 1.082009e+07 1.788155e+07 1.304676e+07 1.061157e+07 1.140597e+07 1.004941e+07 7.222769e+06 8.375006e+06 1.515172e+07 8.692970e+06 4.524920e+06 1.321843e+07 1.433897e+07 1.137011e+07 9.536234e+06 1.557218e+07 1.024000e+07 7.489782e+06 1.071156e+07 6.348754e+06 5.840048e+06 7.163009e+06 5.115522e+06 9.065672e+06 9.066204e+06 1.535924e+07 1.630442e+07 1.110011e+07 1.232803e+07 9.738381e+06 7.096169e+06 2.126762e+07 7.185114e+06 9.957411e+06 1.086928e+07 1.997526e+07 1.651628e+07 8.184942e+06 7.711330e+06 1.038123e+07 9.935160e+06 7.027940e+06 7.140175e+06 8.016615e+06 1.042323e+07 1.391605e+07 1.058776e+07 9.081487e+06 1.739842e+07 1.102021e+07 9.287757e+06 8.256697e+06 1.892676e+07 9.527507e+06 7.259243e+06 6.914918e+06 1.322227e+07 1.131135e+07 6.559447e+06 9.788715e+06 5.373508e+06 7.138126e+06 1.102675e+07 C6 H7 N O5 S_4.313 3.694997e+06 3.734791e+06 3.215467e+06 2.803917e+06 1.540938e+05 2.556676e+06 2.768150e+06 5.327087e+06 127757.86 3.027368e+06 3.141452e+06 2.964217e+06 138854.68 2.556186e+06 3.010220e+06 4.109715e+06 1.215259e+05 2.616925e+06 3.043884e+06 3.274483e+06 1.261405e+05 3.356045e+06 3.567739e+06 3.503556e+06 48852.948 2.814366e+06 3.897637e+06 2.299107e+06 7.586008e+04 3.104138e+06 3.349728e+06 3.768811e+06 93033.82 3.410605e+06 2.523991e+06 3.165822e+06 1.161816e+05 3.565253e+06 3.320024e+06 3.348793e+06 7.410121e+04 2.973118e+06 2.914037e+06 3.493691e+06 6.841778e+04 3.779813e+06 2.874850e+06 3.232874e+06 1.832965e+06 6.070606e+06 1.643020e+06 1.596392e+06 3.246936e+06 2.285147e+06 3.290187e+06 4.699387e+06 5.763300e+06 2.596067e+06 3.476647e+06 2.171688e+06 2.657271e+06 1.646898e+06 2.314526e+06 1.250203e+07 4.777543e+06 5.095798e+06 3.470035e+06 2.818986e+06 1.289722e+06 2.190991e+06 4.033183e+06 5.056638e+06 3.835263e+06 2.734671e+06 5.466306e+06 2.552045e+06 3.754804e+06 1.162575e+06 2.314561e+06 2.862487e+06 3.121762e+06 3.762891e+06 4.875723e+06 3.964597e+06 2.034016e+06 3.359245e+06 1.570438e+06 5.087968e+06 2.752114e+06 2.743899e+06 8.503517e+06 3.551528e+06 4.240981e+06 3.629802e+06 4.296626e+06 3.697066e+06 2.442265e+06 1.374349e+06 4.264128e+06 3.501496e+06 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2.550906e+06 3.472573e+06 4.736208e+06 4.234081e+06 3.815192e+06 2.381029e+06 3.403512e+06 2.482207e+06 3.904118e+06 2.089916e+06 3.206264e+06 3.652239e+06 5.669166e+06 4.628774e+06 2.648420e+06 2.074664e+06 3.267049e+06 2.902257e+06 2.578636e+06 1.924520e+06 2.649110e+06 3.159633e+06 4.780013e+06 2.619424e+06 3.009481e+06 5.390220e+06 3.281206e+06 2.736284e+06 3.919974e+06 3.752747e+06 2.950492e+06 3.026862e+06 2.793365e+06 4.259367e+06 3.945439e+06 2.155913e+06 3.462276e+06 1.933031e+06 2.123064e+06 2.938626e+06 C27 H32 N8 O2 S_4.313 1.115961e+06 1.484973e+06 1.859128e+06 2.016346e+06 1.577596e+05 1.128250e+06 1.751734e+06 1.977236e+06 137049.29 1.493491e+06 1.775254e+06 1.731925e+06 133461.81 1.507849e+06 1.696255e+06 1.876360e+06 1.117881e+05 1.301734e+06 1.548997e+06 1.779815e+06 1.139411e+05 1.704033e+06 1.909658e+06 1.819730e+06 43742.592 1.432945e+06 1.710681e+06 1.682573e+06 6.511784e+04 1.391086e+06 1.626531e+06 2.076529e+06 75296.74 1.379357e+06 1.748131e+06 1.870735e+06 9.318322e+04 1.435102e+06 1.627793e+06 1.984502e+06 6.296881e+04 1.380323e+06 1.809968e+06 1.868247e+06 6.232431e+04 1.314913e+06 1.636487e+06 1.768196e+06 1.093710e+06 1.092127e+06 7.108427e+05 4.930312e+06 1.709859e+06 1.365017e+06 1.950912e+06 2.788699e+06 1.607102e+06 2.693386e+06 2.590884e+06 1.895744e+06 1.057974e+06 2.116854e+06 2.705761e+06 2.034955e+06 2.693558e+06 1.793700e+06 1.351699e+06 9.095402e+05 2.029266e+06 2.276561e+06 4.744131e+06 1.781748e+06 2.126996e+06 2.893167e+06 1.531444e+06 2.500730e+06 1.590653e+06 3.376491e+06 2.060030e+06 1.884071e+06 1.263215e+06 2.079947e+06 5.924501e+05 2.427089e+06 9.066101e+05 1.766466e+06 1.099753e+06 1.019560e+06 8.727388e+05 7.824539e+05 1.559821e+06 2.789141e+06 1.092052e+06 6.744337e+05 1.956244e+06 2.650201e+06 3.104496e+06 7.392729e+05 3.779318e+06 9.551089e+05 1.010540e+06 1.784057e+06 5.196661e+05 1.429943e+06 9.799396e+05 8.739528e+05 8.925045e+05 1.012607e+06 1.489022e+06 1.916165e+06 6.915875e+05 1.507990e+06 1.729823e+06 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8.255019e+05 2.838382e+06 9.660096e+05 1.934966e+06 2.630685e+05 9.496641e+05 1.184709e+06 6.083710e+05 4.830745e+05 1.776944e+06 1.514246e+06 1.176059e+06 8.142347e+05 9.857196e+05 1.438592e+06 3.736810e+06 6.472209e+05 7.730114e+05 8.867679e+05 1.811568e+06 1.625651e+06 8.632898e+05 1.195214e+06 9.416891e+05 4.050915e+06 2.511631e+06 8.469424e+05 1.381625e+06 8.682706e+06 1.144548e+06 1.389788e+06 1.241150e+06 1.773889e+06 9.912286e+05 1.527691e+06 7.207649e+05 1.110425e+06 7.598784e+05 2.881767e+06 1.618158e+06 3.104296e+06 1.390198e+06 1.144381e+06 1.604297e+06 1.989559e+06 7.279576e+05 1.792840e+06 1.038088e+06 8.824029e+05 1.328179e+06 1.890128e+06 1.212577e+06 7.705422e+05 9.333911e+05 2.207838e+06 1.810981e+06 1.349397e+06 1.909962e+06 1.208328e+06 1.657929e+06 9.948115e+05 1.371075e+06 1.908951e+06 2.422598e+06 3.246366e+06 5.751185e+06 2.079937e+06 1.252774e+06 7.501332e+05 1.940346e+05 1.637893e+06 2.654324e+06 C21 H44 N O6 P_4.313 3.556582e+06 3.721062e+06 4.310699e+06 4.104564e+06 1.347740e+05 3.003059e+06 4.651759e+06 5.062508e+06 116973.63 2.942714e+06 4.066191e+06 4.263665e+06 117718.47 3.719871e+06 3.917373e+06 4.556321e+06 1.068765e+05 3.337957e+06 3.841926e+06 4.436715e+06 1.197174e+05 3.412479e+06 3.353091e+06 5.523653e+06 43533.693 3.412188e+06 4.215621e+06 3.914192e+06 6.455144e+04 3.504587e+06 4.059051e+06 4.374346e+06 80477.76 3.515514e+06 3.862301e+06 4.347198e+06 9.824481e+04 3.580594e+06 3.818287e+06 4.470534e+06 6.213817e+04 3.187498e+06 4.061958e+06 5.260756e+06 6.475683e+04 3.566928e+06 5.022091e+06 2.276241e+06 4.406092e+06 2.370824e+06 2.088177e+06 1.190756e+07 3.861496e+06 4.196307e+06 4.385930e+06 1.128613e+07 4.467959e+06 7.443537e+06 6.075224e+06 5.403560e+06 3.103640e+06 4.431402e+06 6.183102e+06 4.734559e+06 9.110595e+06 5.173031e+06 3.437088e+06 2.064340e+06 4.936201e+06 4.645224e+06 1.365179e+07 3.326878e+06 7.530687e+06 7.606641e+06 3.575301e+06 5.758749e+06 3.873231e+06 8.241940e+06 5.350920e+06 4.467743e+06 2.880785e+06 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1.698616e+06 4.125056e+06 2.193172e+06 1.634231e+06 2.786559e+06 4.846719e+06 3.074590e+06 2.415576e+06 2.631888e+06 4.382036e+06 6.005872e+06 3.664993e+06 4.187404e+06 2.636559e+06 3.737440e+06 2.845212e+06 3.758299e+06 4.867826e+06 6.755833e+06 6.815875e+06 1.338949e+07 4.682380e+06 2.942962e+06 2.281663e+06 8.290936e+05 3.564983e+06 6.729779e+06 C8 H6 N2 O3 S_4.313 5.019686e+06 4.573662e+06 4.688725e+06 3.122042e+06 1.749296e+05 3.929272e+06 4.460233e+06 4.404645e+06 147306.12 4.222306e+06 4.963997e+06 3.958835e+06 164103.92 4.027675e+06 4.297629e+06 4.041958e+06 1.342603e+05 3.981751e+06 4.009555e+06 4.122068e+06 1.433362e+05 4.344640e+06 4.680652e+06 4.649178e+06 55760.929 3.801697e+06 4.685753e+06 4.336250e+06 8.942561e+04 3.903734e+06 3.228771e+06 4.901139e+06 111420.35 3.080708e+06 5.615652e+06 3.512819e+06 1.311210e+05 4.374403e+06 4.325920e+06 4.357545e+06 8.786792e+04 3.960084e+06 4.616371e+06 5.063174e+06 9.439550e+04 3.111429e+06 4.301533e+06 4.195014e+06 3.056255e+06 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4.838047e+06 4.611523e+06 2.861287e+06 3.693160e+06 6.364499e+06 3.750608e+06 2.063427e+06 7.042725e+06 5.882853e+06 4.552099e+06 4.396934e+06 7.909105e+06 4.403437e+06 5.373630e+06 4.664137e+06 2.392652e+06 2.565520e+06 3.114498e+06 2.657938e+06 4.169193e+06 3.777866e+06 6.292842e+06 6.830043e+06 3.709630e+06 6.180959e+06 3.926358e+06 2.902123e+06 6.305927e+06 3.198835e+06 4.601553e+06 4.276318e+06 9.664264e+06 7.389048e+06 3.783633e+06 3.790527e+06 4.603728e+06 4.415531e+06 3.057275e+06 3.014815e+06 4.065675e+06 4.632803e+06 5.725378e+06 5.248928e+06 3.921096e+06 8.278963e+06 5.198662e+06 4.099195e+06 3.353857e+06 8.357801e+06 3.615679e+06 3.275709e+06 2.449582e+06 5.476566e+06 5.073058e+06 2.893471e+06 3.825461e+06 2.245816e+06 3.229866e+06 4.414055e+06 C6 H5 N O4 S_4.313 1.116728e+08 1.048760e+08 9.974335e+07 1.043051e+08 9.787335e+05 7.885115e+07 1.117024e+08 1.022670e+08 918153.86 8.514550e+07 1.083981e+08 1.104041e+08 1702972.31 1.034681e+08 8.411426e+07 8.740919e+07 8.451374e+05 1.015645e+08 1.028991e+08 1.060471e+08 7.636034e+05 8.831600e+07 1.120695e+08 1.114973e+08 206168.129 8.552199e+07 1.104734e+08 1.036361e+08 4.174903e+05 7.806323e+07 8.355006e+07 1.134541e+08 397432.06 1.054149e+08 1.029574e+08 1.064253e+08 7.770545e+05 7.954375e+07 1.070118e+08 9.876251e+07 3.165978e+05 9.474679e+07 1.025585e+08 1.131114e+08 6.599115e+05 8.933709e+07 9.844043e+07 9.804266e+07 6.306079e+07 2.018093e+08 7.405104e+07 6.206568e+07 1.093363e+08 6.878827e+07 1.004445e+08 9.443143e+07 2.111729e+08 9.070368e+07 1.023867e+08 8.065328e+07 8.058665e+07 7.499353e+07 7.963709e+07 2.171485e+08 1.434732e+08 1.516204e+08 1.144823e+08 9.120495e+07 4.894761e+07 6.818108e+07 1.422622e+08 1.740172e+08 1.148742e+08 8.552216e+07 1.402153e+08 6.926841e+07 1.252794e+08 4.194734e+07 7.821638e+07 8.042430e+07 1.140427e+08 9.826421e+07 1.450202e+08 1.655713e+08 7.443742e+07 8.615907e+07 5.778920e+07 1.719634e+08 1.226650e+08 8.875870e+07 9.237602e+07 1.059079e+08 1.267117e+08 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1.734614e+08 1.295481e+08 9.434970e+07 8.714433e+07 1.566833e+08 1.151951e+08 8.402206e+07 8.704957e+07 1.345395e+08 1.198392e+08 7.470208e+07 1.086808e+08 6.376064e+07 8.186063e+07 1.179914e+08 113.01215_4.313 4.617361e+06 3.676470e+06 3.721058e+06 3.830342e+06 2.072668e+05 3.559475e+06 3.939750e+06 4.270165e+06 181268.85 3.807135e+06 3.943396e+06 3.602636e+06 180765.95 3.697542e+06 3.812352e+06 3.968108e+06 1.538755e+05 3.521177e+06 3.711118e+06 3.445635e+06 1.563386e+05 3.412523e+06 3.843649e+06 6.625407e+06 55190.872 2.520511e+06 3.404638e+06 3.568898e+06 9.151958e+04 3.019048e+06 4.142112e+06 3.909904e+06 128194.59 3.665578e+06 3.990182e+06 3.855294e+06 1.516563e+05 3.663163e+06 3.850911e+06 3.821588e+06 1.050779e+05 3.820950e+06 3.903806e+06 4.215345e+06 1.072144e+05 3.230551e+06 3.533452e+06 4.099592e+06 2.187919e+06 7.006337e+06 3.706611e+06 2.100204e+06 5.113295e+06 2.111416e+06 3.467773e+06 4.892011e+06 7.463386e+06 2.797954e+06 4.530071e+06 2.695955e+06 2.578360e+06 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3.099310e+06 3.065296e+06 3.965405e+06 2.909391e+06 4.900867e+06 2.816438e+06 5.567176e+06 3.534263e+06 4.628089e+06 2.537492e+06 2.378110e+06 2.360246e+06 4.199998e+06 4.546778e+06 2.174456e+06 2.572943e+06 3.600297e+06 3.456866e+06 2.330088e+06 1.060591e+07 4.214807e+06 2.829831e+06 1.904840e+06 1.871932e+06 4.971840e+06 3.039891e+06 4.905084e+06 6.302397e+06 4.982593e+06 3.740197e+06 5.679947e+06 7.666929e+06 4.734371e+06 2.995989e+06 3.919990e+06 1.646527e+06 4.262688e+06 3.855838e+06 4.667397e+06 5.655356e+06 4.858224e+06 3.525892e+06 2.609091e+06 2.663635e+06 3.231519e+06 4.374765e+06 2.467763e+06 3.931063e+06 3.460169e+06 4.135811e+06 3.158165e+06 2.946680e+06 3.871889e+06 2.466299e+06 2.802025e+06 2.575868e+06 1.617905e+06 2.517906e+06 3.069477e+06 4.097990e+06 3.931155e+06 3.936024e+06 7.076358e+06 4.388192e+06 6.312616e+06 4.135456e+06 3.580328e+06 2.679825e+06 2.841639e+06 5.637351e+06 2.675694e+06 1.645282e+06 5.874441e+06 4.865872e+06 3.583748e+06 3.133778e+06 5.429373e+06 3.186868e+06 2.464414e+06 4.558141e+06 2.391253e+06 1.786738e+06 2.978617e+06 2.284228e+06 2.876035e+06 4.221872e+06 4.764784e+06 5.954279e+06 4.683264e+06 3.942468e+06 3.338376e+06 2.379556e+06 6.436855e+06 3.057694e+06 4.050451e+06 4.089518e+06 6.350927e+06 5.686044e+06 3.381663e+06 2.924107e+06 3.812638e+06 3.718007e+06 2.431670e+06 2.550138e+06 2.813133e+06 4.236352e+06 4.772020e+06 3.851815e+06 3.431009e+06 6.415894e+06 4.859257e+06 3.147563e+06 3.353500e+06 6.413041e+06 4.544030e+06 2.864620e+06 3.266998e+06 4.421627e+06 4.780430e+06 2.384747e+06 3.725866e+06 2.151608e+06 2.593914e+06 3.762208e+06 C30 H36 N7 O3 P_4.314 7.916946e+05 8.125661e+05 8.992775e+05 1.111262e+06 1.379029e+05 9.004063e+05 1.203557e+06 1.139657e+06 117461.25 8.462552e+05 9.134807e+05 1.026360e+06 117861.51 1.006227e+06 9.814269e+05 1.029250e+06 1.050071e+05 8.325553e+05 9.208751e+05 1.146948e+06 1.124158e+05 8.815121e+05 9.570773e+05 1.265417e+06 41492.422 7.626209e+05 1.047018e+06 1.030878e+06 5.971096e+04 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8.438937e+05 1.237935e+06 C7 H14 N O8 P_4.314 7.933667e+06 7.026667e+06 7.024142e+06 6.802650e+06 1.589218e+05 6.052501e+06 7.926358e+06 7.691606e+06 151531.57 6.627119e+06 7.346917e+06 6.507277e+06 158272.85 6.543378e+06 6.562100e+06 7.000949e+06 1.368873e+05 7.182965e+06 6.755328e+06 7.561660e+06 1.496736e+05 7.077102e+06 7.475800e+06 7.218071e+06 62214.991 5.826342e+06 7.335124e+06 6.557319e+06 9.647478e+04 6.322777e+06 7.220014e+06 8.163980e+06 105340.33 6.632570e+06 6.540654e+06 7.302764e+06 1.350366e+05 6.831096e+06 6.690985e+06 7.231112e+06 9.162577e+04 6.740416e+06 6.916932e+06 8.559569e+06 8.950328e+04 5.586148e+06 6.541979e+06 7.368312e+06 3.608224e+06 1.240089e+07 4.579697e+06 3.265897e+06 7.712888e+06 4.737067e+06 6.578669e+06 9.232722e+06 9.967783e+06 7.224977e+06 1.022820e+07 5.643903e+06 5.152632e+06 5.921111e+06 5.269056e+06 1.424311e+07 8.724122e+06 1.217590e+07 7.391077e+06 5.827448e+06 3.474278e+06 4.560934e+06 9.820589e+06 1.081864e+07 8.756511e+06 4.773214e+06 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4.319367e+06 2.857756e+06 4.520568e+06 1.649100e+06 2.380613e+06 2.173430e+06 3.819451e+06 3.005422e+06 3.300541e+06 3.884057e+06 2.546127e+06 2.854128e+06 2.551380e+06 2.048387e+06 3.493150e+06 3.348461e+06 3.374061e+06 5.549666e+06 2.842414e+06 3.091349e+06 3.084091e+06 3.570271e+06 2.746676e+06 3.583101e+06 2.478586e+06 4.816562e+06 3.008776e+06 4.023995e+06 2.206883e+06 2.059547e+06 2.024420e+06 3.587589e+06 2.548900e+06 2.199795e+06 1.775241e+06 3.684335e+06 2.415900e+06 2.110203e+06 7.773999e+06 4.329241e+06 2.040798e+06 1.793911e+06 1.419164e+06 2.839420e+06 2.607154e+06 3.565425e+06 4.495449e+06 2.695694e+06 2.987530e+06 4.366422e+06 4.593082e+06 3.827574e+06 2.921667e+06 3.561440e+06 2.033134e+06 2.459044e+06 3.554999e+06 3.850875e+06 3.721646e+06 3.440616e+06 3.266175e+06 2.487426e+06 2.027184e+06 2.911898e+06 3.755735e+06 2.572494e+06 3.604550e+06 2.636331e+06 3.475802e+06 2.444062e+06 2.638839e+06 2.993692e+06 2.169661e+06 2.054690e+06 2.000789e+06 1.336123e+06 2.318144e+06 3.832380e+06 4.517330e+06 3.673154e+06 3.555879e+06 5.143295e+06 4.283686e+06 3.366042e+06 2.651582e+06 2.694294e+06 2.211840e+06 2.562464e+06 4.640342e+06 2.455649e+06 1.320320e+06 4.678247e+06 4.079300e+06 3.580642e+06 3.026930e+06 5.492223e+06 3.273820e+06 1.833078e+06 3.909191e+06 2.143994e+06 1.839654e+06 2.337515e+06 1.836753e+06 2.837134e+06 4.848948e+06 4.612585e+06 4.111440e+06 3.742982e+06 4.583492e+06 3.141963e+06 1.952276e+06 6.438154e+06 2.437765e+06 3.231646e+06 4.019433e+06 4.359659e+06 4.943151e+06 2.393843e+06 3.014429e+06 3.251864e+06 2.881585e+06 2.315800e+06 2.069808e+06 3.049094e+06 3.226334e+06 4.289975e+06 3.072596e+06 2.941039e+06 3.338653e+06 4.568489e+06 2.997971e+06 2.668409e+06 3.462453e+06 3.332977e+06 2.212732e+06 2.318556e+06 2.915227e+06 3.382453e+06 1.889580e+06 3.346754e+06 1.781288e+06 2.177731e+06 3.445201e+06 C18 H37 N P2_4.316 1.656774e+05 8.492384e+05 6.849705e+05 8.430913e+05 1.691111e+05 7.314180e+05 9.724102e+05 1.631745e+05 166342.72 9.893876e+05 1.215540e+06 2.131943e+05 198364.70 6.562594e+05 8.022977e+05 9.266018e+05 1.506250e+05 9.547762e+05 1.377468e+05 6.551978e+05 1.313783e+05 7.499818e+05 8.104227e+05 9.751201e+05 40630.878 1.047850e+06 1.087491e+05 6.629310e+05 6.361120e+04 7.818991e+05 7.506602e+05 8.528794e+05 79865.48 7.926498e+05 1.179303e+05 8.373892e+05 9.389154e+04 1.160635e+05 9.118255e+05 1.035186e+05 6.123156e+04 7.914841e+05 9.668507e+04 1.005293e+05 5.901760e+04 7.629304e+05 8.569666e+05 8.293272e+05 2.062512e+06 1.198156e+06 1.621836e+06 1.067881e+05 4.284635e+05 8.398263e+05 1.199014e+06 4.738134e+05 4.980946e+05 1.339409e+06 1.013666e+06 1.888749e+05 1.049092e+06 8.970376e+05 9.776790e+05 1.066423e+05 1.083570e+05 5.670678e+05 7.351552e+05 3.868126e+05 9.610458e+05 4.452233e+05 1.527475e+05 9.514680e+05 9.299510e+04 6.688091e+05 5.255140e+05 1.126575e+05 1.316771e+05 3.032342e+05 6.617984e+05 9.080091e+05 1.630533e+06 3.665413e+05 4.501393e+05 9.202064e+05 2.612442e+05 9.607001e+05 4.374942e+05 1.048280e+06 6.615894e+05 8.552675e+05 1.197166e+05 1.017994e+06 8.327446e+05 1.676583e+05 7.700966e+05 5.959966e+05 5.358382e+05 3.475415e+05 6.847199e+05 7.794682e+05 1.388585e+06 1.185689e+05 1.061984e+05 1.162898e+06 1.121673e+05 1.026821e+06 2.813448e+05 5.066077e+05 3.873318e+05 5.977931e+05 1.063069e+06 4.259782e+05 2.749373e+05 1.203034e+05 6.002260e+05 9.976913e+05 5.573604e+05 3.823665e+05 1.163358e+05 6.105192e+05 8.108588e+05 1.005253e+05 4.437511e+05 3.106082e+05 3.648330e+05 2.263232e+05 1.759620e+06 8.992078e+04 1.179657e+06 1.854327e+05 3.286422e+05 7.015858e+05 9.260230e+05 3.576270e+05 5.981829e+05 1.081798e+06 7.568633e+05 1.017071e+05 7.161988e+05 1.089957e+06 3.050777e+05 1.404935e+05 1.132159e+06 1.040699e+05 3.890310e+05 1.231617e+05 9.654416e+05 1.232058e+05 1.586022e+06 6.904060e+05 1.138678e+06 1.043534e+06 7.363684e+05 1.693888e+05 4.315679e+05 4.992193e+05 1.885410e+06 1.004082e+06 1.043121e+05 1.674122e+06 9.469679e+05 1.105177e+05 4.926297e+05 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5.458541e+06 3.942082e+06 3.300417e+06 2.524186e+06 2.931324e+06 5.406367e+06 2.810939e+06 1.451725e+06 4.821719e+06 4.717320e+06 3.721916e+06 2.814696e+06 4.930759e+06 5.307726e+06 1.795484e+06 3.425144e+06 2.154552e+06 2.011526e+06 2.708289e+06 2.051130e+06 3.533826e+06 3.568208e+06 4.965121e+06 5.311867e+06 3.710875e+06 4.392312e+06 2.887103e+06 2.312452e+06 6.617095e+06 2.260668e+06 3.144838e+06 4.190257e+06 4.513644e+06 5.037673e+06 3.018228e+06 2.626655e+06 3.787789e+06 2.912880e+06 2.412190e+06 2.457907e+06 3.205533e+06 3.535407e+06 4.238598e+06 4.410636e+06 3.345577e+06 5.520895e+06 4.546176e+06 3.193071e+06 2.721195e+06 5.766055e+06 4.007691e+06 2.582850e+06 2.899101e+06 4.417669e+06 4.409021e+06 2.015369e+06 3.472311e+06 2.077185e+06 2.510053e+06 3.422392e+06 C8 H13 N O2 S_4.34 1.558006e+05 3.651941e+06 3.551485e+06 3.637775e+06 1.640714e+05 3.375498e+06 3.925842e+06 3.080037e+06 152489.89 3.995373e+06 3.633253e+06 4.041646e+06 148550.25 3.481708e+06 3.468417e+06 3.548968e+06 1.310808e+05 3.439893e+06 3.716990e+06 3.533753e+06 1.809703e+05 3.288972e+06 3.715101e+06 4.796041e+06 49270.608 3.195071e+06 3.594629e+06 3.160175e+06 8.982477e+04 3.247484e+06 3.637271e+06 3.912926e+06 104345.27 3.668906e+06 3.425701e+06 3.800429e+06 1.312283e+05 3.697749e+06 3.508958e+06 3.614194e+06 8.993124e+04 3.095214e+06 4.128924e+06 4.058237e+06 8.520310e+04 3.244452e+06 3.443956e+06 3.652086e+06 3.591135e+06 5.149491e+06 2.929583e+06 8.959412e+06 6.451920e+06 2.867805e+06 7.409443e+06 7.639468e+06 1.557159e+06 3.936737e+06 5.193991e+06 1.493985e+06 1.092031e+07 9.177014e+06 3.371415e+06 6.187703e+06 4.737200e+06 2.184752e+06 2.536660e+06 2.194349e+06 3.377576e+06 2.438994e+06 8.330114e+06 3.808918e+06 5.479814e+06 7.723334e+06 4.016748e+06 3.180586e+06 6.126552e+06 2.675934e+06 1.362558e+05 4.668863e+06 3.426005e+06 6.260123e+06 2.278005e+06 2.499729e+06 2.653942e+06 5.521912e+06 3.280296e+06 3.070426e+06 3.424367e+06 5.437265e+06 8.645638e+06 3.486301e+06 1.119065e+06 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3.005980e+06 7.126764e+06 4.145885e+06 8.659465e+06 3.939665e+06 4.921533e+06 4.795236e+06 7.187327e+06 4.591783e+06 7.738962e+06 3.577241e+06 4.253074e+06 5.436327e+06 6.887005e+06 4.523937e+06 4.411849e+06 5.644123e+06 6.425810e+06 3.974238e+06 2.791120e+06 8.321922e+06 3.591575e+06 4.211384e+06 9.704850e+06 3.783112e+06 4.438035e+06 1.332962e+06 5.505512e+06 2.154568e+06 9.965475e+06 7.861592e+06 4.833900e+06 7.135467e+06 9.145271e+06 5.520994e+06 1.100663e+07 5.457902e+06 4.191328e+06 7.470603e+06 3.648093e+06 8.381058e+06 7.637661e+06 1.052823e+07 4.585740e+06 6.405108e+06 4.953535e+06 8.652725e+06 4.900997e+06 8.466581e+06 2.266132e+06 3.370448e+06 6.608516e+06 5.410231e+06 1.997723e+06 8.787070e+06 2.092949e+06 2.223724e+06 3.689598e+06 3.789390e+06 3.557415e+06 4.559517e+06 9.487255e+06 6.276366e+06 5.663489e+06 1.557477e+07 3.517398e+06 4.663729e+06 6.177165e+06 4.253217e+06 6.172803e+06 5.420362e+06 5.254064e+06 4.712772e+06 5.249819e+06 8.064626e+06 9.415929e+06 4.907676e+06 3.312175e+06 5.228781e+06 7.344880e+06 8.474932e+06 4.120999e+06 8.378224e+06 5.638261e+06 2.320065e+06 8.850643e+06 5.073057e+06 8.240772e+06 4.652224e+06 7.063950e+06 1.010476e+07 4.315504e+06 2.075250e+06 3.598096e+06 4.538142e+06 6.133009e+06 5.595289e+06 1.026397e+07 1.400269e+06 3.378216e+06 3.650572e+06 9.523819e+06 3.652692e+06 4.749394e+06 2.676831e+06 3.141142e+06 4.200333e+06 2.446240e+06 5.925301e+06 8.008306e+06 3.310042e+06 2.220755e+06 2.872019e+06 3.471926e+06 5.395644e+06 5.374554e+06 5.285806e+06 4.669789e+06 4.387971e+06 3.829103e+06 3.484153e+06 2.266874e+06 3.579894e+06 4.736750e+06 4.569565e+06 4.150898e+06 3.569453e+06 2.363484e+06 8.318746e+06 5.630744e+06 9.992499e+06 6.238818e+06 1.143350e+07 6.965360e+06 9.611056e+06 5.129181e+06 5.467720e+06 5.319226e+06 6.431120e+06 8.151568e+06 6.041472e+06 5.448895e+06 5.126516e+06 2.924973e+06 1.049059e+07 2.475100e+06 3.651193e+06 5.037617e+06 3.632982e+06 5.140557e+06 7.881426e+06 5.186411e+06 6.820734e+06 5.332959e+06 3.183228e+06 8.500622e+06 4.877975e+06 9.766129e+06 4.298344e+06 6.682072e+06 6.434248e+06 9.254773e+06 4.361821e+06 3.037560e+06 5.619456e+06 7.470211e+06 C20 H39 N O2 S_4.36 1.142705e+06 7.397466e+05 7.688643e+05 8.248321e+05 1.095580e+05 7.331204e+05 1.255941e+06 1.070727e+06 135108.95 5.532787e+05 2.015613e+05 4.457004e+05 136959.80 1.095210e+06 1.059951e+06 9.127406e+05 9.189922e+04 7.426019e+05 7.395090e+05 5.967969e+05 9.242873e+04 8.987609e+05 8.503160e+05 1.109504e+06 33719.764 7.722311e+05 6.635672e+05 7.077179e+05 6.096282e+04 8.021207e+05 7.852240e+05 8.282623e+05 75997.65 8.306457e+05 7.903784e+05 7.018415e+05 9.109197e+04 7.065122e+05 9.141221e+05 9.984547e+05 6.393806e+04 8.223026e+05 7.088474e+05 6.884607e+05 6.827303e+04 8.563219e+05 8.372838e+05 7.892029e+05 1.605699e+06 1.132687e+06 2.341619e+06 1.079886e+06 5.258690e+05 6.733432e+05 1.120107e+06 6.201025e+05 3.526455e+05 1.218544e+06 1.914722e+06 1.039269e+06 8.474597e+05 1.333206e+06 1.287010e+06 2.177555e+06 6.025243e+05 5.582048e+05 4.636415e+05 5.026190e+05 1.019162e+06 9.177177e+05 1.029215e+06 1.565887e+06 2.178696e+06 7.186647e+05 7.368876e+05 1.015988e+06 1.096988e+06 4.518457e+05 1.143865e+06 1.444664e+06 1.487465e+06 5.271655e+05 4.488413e+05 8.425013e+05 4.009864e+05 1.113300e+06 9.284200e+05 6.764457e+05 6.907259e+05 1.074984e+06 2.121338e+05 1.023509e+06 1.184979e+06 2.915114e+05 9.590620e+05 6.708720e+05 9.236054e+05 5.804265e+05 6.170336e+05 7.488883e+05 1.356059e+06 5.763945e+05 1.606771e+05 1.424943e+06 1.233763e+06 1.588748e+06 2.871886e+05 5.724562e+05 4.335537e+05 4.160888e+05 1.438174e+06 5.645434e+05 5.468482e+05 1.003832e+05 1.312188e+05 6.824906e+05 3.202595e+05 3.285625e+05 1.536674e+06 8.804118e+05 1.184093e+06 1.009055e+06 8.814794e+05 7.974362e+05 3.538206e+05 7.270110e+05 2.287462e+06 1.177817e+06 1.194165e+06 1.455822e+06 3.167000e+05 1.363680e+06 1.871966e+06 3.277348e+05 3.488759e+05 8.319604e+05 1.443946e+06 3.197876e+05 5.711273e+05 1.480561e+06 1.291353e+05 9.333130e+04 7.638732e+05 1.349424e+06 2.897661e+05 1.394141e+06 6.765910e+05 9.322061e+05 1.450067e+06 7.731174e+05 1.053357e+06 7.602943e+05 9.673625e+05 1.240775e+05 7.756489e+05 5.989775e+05 2.357434e+06 1.388939e+06 1.159758e+06 2.078513e+06 1.836566e+06 9.957752e+05 3.894277e+05 2.431796e+05 6.887695e+05 1.675125e+06 1.652109e+06 9.894667e+05 9.126808e+05 1.224913e+06 5.787592e+05 2.436776e+05 5.965040e+05 1.051885e+06 6.856006e+05 6.856309e+05 1.532361e+06 1.597012e+06 6.474802e+05 3.377273e+05 1.082864e+05 4.853068e+05 1.653162e+05 8.919626e+05 2.667521e+05 6.090149e+05 1.549733e+06 4.303251e+05 3.543457e+05 6.597799e+05 6.351579e+05 1.278028e+05 1.017095e+06 2.839083e+05 3.298352e+05 2.875504e+05 7.920005e+05 1.902638e+05 2.198866e+06 1.007364e+06 1.035781e+06 1.274227e+06 3.463249e+05 1.086897e+06 2.695089e+05 1.218474e+06 1.425910e+06 8.570461e+05 9.011957e+05 5.623711e+05 1.424794e+06 8.720639e+05 1.083198e+06 6.615165e+05 7.993235e+05 3.215825e+05 4.374260e+05 2.905082e+05 1.594198e+05 2.132485e+06 2.487269e+06 2.947151e+06 1.060819e+06 1.219230e+06 6.671603e+05 6.054273e+05 2.526552e+05 2.735912e+05 5.289114e+05 6.262763e+05 3.499054e+05 1.250484e+06 1.098092e+06 7.382324e+05 1.149144e+06 1.490491e+06 5.895660e+05 1.879619e+06 7.349066e+05 9.028063e+05 1.098097e+06 1.224015e+06 1.548717e+05 6.628293e+05 7.552423e+05 1.695579e+05 6.680939e+05 2.008557e+06 2.049051e+06 6.935131e+05 2.658695e+05 2.017951e+06 8.779107e+05 1.112991e+05 2.329771e+06 1.388061e+06 9.780810e+05 6.272763e+05 9.332830e+05 4.513033e+05 1.503821e+06 2.198332e+06 C13 H13 N3_4.36 1.724682e+05 3.077332e+05 2.688250e+05 1.991811e+05 1.688265e+05 2.671851e+05 1.652524e+05 2.630399e+05 116159.66 3.044257e+05 3.249544e+05 4.202353e+05 113767.21 1.325162e+05 1.146330e+05 1.937651e+05 1.133221e+06 1.317655e+05 1.519685e+05 3.622639e+05 1.529011e+05 1.628971e+05 3.467759e+05 3.938900e+05 57237.710 1.784405e+05 1.725895e+05 1.773334e+05 1.030161e+05 1.713738e+05 2.097051e+05 2.812993e+05 107052.60 3.219524e+05 2.300194e+05 2.714797e+05 1.390781e+05 1.556884e+05 1.664230e+05 4.352987e+05 9.541763e+04 1.885083e+05 1.922811e+05 1.644846e+05 9.918782e+04 1.607486e+05 1.444866e+05 3.181872e+05 1.409339e+05 1.212132e+05 1.868937e+05 1.570182e+05 1.707612e+05 1.646767e+05 1.317315e+05 1.307839e+05 2.454185e+05 1.578705e+05 2.208486e+05 1.304284e+05 1.717470e+05 1.583895e+05 1.346163e+05 1.601807e+05 1.585146e+05 1.559399e+05 1.478124e+05 1.679587e+05 1.600154e+05 1.504470e+05 1.319457e+05 1.497344e+05 1.393378e+05 1.395361e+05 1.802576e+05 1.687549e+05 1.553364e+05 1.411849e+05 1.257263e+05 1.520570e+05 2.885367e+07 1.580056e+05 3.312643e+05 1.262030e+05 1.429329e+05 1.717339e+05 1.529152e+05 1.221461e+05 1.366481e+05 1.453732e+05 1.870997e+05 1.058008e+05 2.210758e+05 1.373923e+05 1.787000e+05 1.417463e+05 1.530489e+05 1.716050e+05 3.013839e+06 2.475644e+05 1.137920e+05 4.969376e+06 1.549430e+05 1.660465e+05 1.608736e+05 1.732623e+05 1.726911e+05 1.748599e+05 1.748176e+05 1.833951e+05 1.959565e+05 1.371159e+05 3.221318e+06 1.531188e+05 1.023233e+05 7.307086e+05 1.471062e+05 1.562346e+05 2.970718e+06 1.530490e+05 2.079732e+05 4.095301e+05 1.660582e+05 1.801733e+05 1.673263e+05 2.713190e+05 1.145077e+05 1.396603e+05 1.271827e+05 7.907733e+06 1.637491e+05 1.625686e+05 3.392467e+06 1.802026e+05 1.131462e+05 1.524043e+05 1.357851e+05 1.483185e+05 1.872772e+05 1.558488e+05 4.272546e+06 1.632680e+05 1.262820e+05 1.535049e+05 2.152754e+06 3.716247e+06 3.524599e+06 1.776400e+05 1.360902e+05 4.281008e+05 1.046122e+05 1.843100e+05 9.204598e+05 1.676839e+05 1.414791e+05 1.181910e+05 1.718049e+05 1.367956e+07 1.455992e+05 1.070458e+05 1.742017e+05 1.551662e+05 1.407513e+05 1.459069e+05 1.590003e+05 1.201082e+05 1.568458e+05 1.557551e+05 1.928246e+05 1.583247e+05 9.725870e+04 1.432556e+05 1.556432e+05 1.537271e+05 1.497183e+05 1.016646e+05 1.794356e+05 1.515910e+05 1.444772e+05 1.502652e+05 9.060174e+05 8.599973e+05 1.554420e+05 1.076641e+05 1.601749e+05 1.892912e+05 1.274759e+05 1.514915e+05 1.039825e+05 1.590349e+05 1.696742e+05 2.201241e+05 1.575010e+05 2.045646e+05 1.415562e+05 1.470032e+05 1.579902e+05 1.786621e+05 1.744166e+05 1.492327e+05 1.035161e+05 1.329372e+05 1.498901e+05 1.149317e+06 1.391097e+05 1.295785e+05 1.673318e+05 1.395330e+05 1.300530e+05 1.387156e+05 1.606568e+05 1.403167e+05 1.789853e+05 3.420693e+06 1.310704e+05 1.841485e+05 1.548693e+05 1.640673e+05 8.283980e+05 4.031618e+05 1.238262e+05 1.009920e+05 1.865346e+05 1.756861e+05 1.369360e+05 1.188293e+05 2.339156e+05 1.637352e+05 2.454334e+05 1.785673e+05 1.574426e+05 1.703546e+05 4.689745e+05 1.839934e+05 1.769673e+05 1.885852e+05 1.540716e+05 1.674525e+05 1.516748e+05 1.400717e+05 1.491410e+05 1.116255e+05 1.566154e+05 1.351289e+05 1.272625e+05 1.432777e+05 1.751543e+05 1.814365e+05 1.482268e+05 1.204986e+05 9.974811e+04 1.951527e+05 1.026434e+05 1.042115e+05 4.629970e+05 1.422815e+05 1.202355e+05 1.593222e+05 1.072202e+06 1.983116e+05 1.871141e+05 2.664880e+05 289.60209_4.364 1.080438e+07 5.455219e+06 5.477155e+06 5.499648e+06 1.529199e+05 5.345289e+06 6.183928e+06 5.482736e+06 142085.79 5.498236e+06 5.628740e+06 5.434503e+06 138523.51 5.797290e+06 5.621260e+06 5.735381e+06 1.214687e+05 4.713772e+06 5.886912e+06 5.460393e+06 1.272058e+05 5.277343e+06 5.931262e+06 6.775544e+06 45715.288 4.343686e+06 6.094995e+06 5.658977e+06 6.833307e+04 4.652506e+06 5.902608e+06 5.558367e+06 75094.28 5.619773e+06 5.533636e+06 5.467740e+06 1.035564e+05 5.263828e+06 5.367356e+06 6.428327e+06 6.314738e+04 5.038794e+06 5.348375e+06 7.404000e+06 6.348772e+04 4.566617e+06 5.000031e+06 5.600190e+06 1.910152e+06 5.218819e+06 6.210322e+06 4.459578e+06 6.996237e+06 3.785518e+06 5.684269e+06 6.542279e+06 9.162401e+06 1.018545e+07 1.385749e+07 3.493714e+06 5.555614e+06 6.209834e+06 5.136684e+06 1.516124e+07 1.338362e+07 4.433383e+06 7.626420e+06 4.379792e+06 5.802797e+06 3.119803e+06 7.348400e+06 3.969135e+06 5.008349e+06 1.067152e+07 7.657546e+06 3.919371e+06 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8.475346e+06 5.485088e+06 5.614615e+06 5.943330e+06 6.643995e+06 8.114039e+06 5.807955e+06 7.457950e+06 5.462498e+06 2.927293e+06 9.630148e+06 3.612520e+06 3.146656e+06 5.037001e+06 3.761675e+06 4.682418e+06 7.710916e+06 5.781235e+06 6.823675e+06 4.574717e+06 3.253246e+06 8.003261e+06 4.072290e+06 8.307153e+06 5.025122e+06 7.174443e+06 6.508368e+06 9.190718e+06 4.516911e+06 2.873501e+06 4.779593e+06 7.206429e+06 C22 H36 N7 O4 P3_4.374 2.418526e+07 1.293480e+07 1.284379e+07 1.477322e+07 1.479857e+05 1.401991e+07 1.300881e+07 1.222574e+07 146776.26 1.428452e+07 1.268367e+07 1.330624e+07 134087.83 1.361330e+07 1.319595e+07 1.449337e+07 1.082835e+05 1.340270e+07 1.366076e+07 1.313835e+07 1.180562e+05 1.373858e+07 1.327806e+07 1.394026e+07 44417.946 1.200191e+07 1.385686e+07 1.564076e+07 6.349019e+04 1.084021e+07 1.408979e+07 1.344678e+07 69098.12 1.351346e+07 1.288884e+07 1.370207e+07 9.885105e+04 1.294153e+07 1.458787e+07 1.425430e+07 6.606249e+04 1.336978e+07 1.124037e+07 1.503872e+07 6.734394e+04 1.265498e+07 1.218418e+07 1.468172e+07 5.389285e+06 1.256963e+07 6.908260e+06 1.440990e+07 1.265144e+07 1.400858e+07 1.765729e+07 2.311641e+07 3.090415e+07 3.373690e+07 2.372523e+07 1.190624e+07 1.481356e+07 1.808033e+07 1.480345e+07 3.069575e+07 1.993802e+07 7.340191e+06 1.786591e+07 9.509717e+06 1.306018e+07 1.088770e+07 1.670090e+07 1.315369e+07 1.455193e+07 1.877860e+07 2.315017e+07 1.245534e+07 1.151357e+07 1.585811e+07 2.859900e+07 1.675061e+07 1.429686e+07 5.639582e+06 7.012186e+06 8.591062e+06 1.523796e+07 1.941846e+07 7.112930e+06 7.071135e+06 1.374823e+07 1.117179e+07 1.210976e+07 1.298797e+07 1.190676e+07 1.853994e+07 1.408962e+07 1.533902e+07 8.140166e+06 1.675748e+07 9.025584e+06 1.516078e+07 1.368319e+07 1.405246e+07 1.366429e+07 1.740791e+07 1.179958e+07 1.720346e+07 6.344647e+06 1.076526e+07 1.735086e+07 1.461668e+07 1.018728e+07 1.233375e+07 2.490223e+07 1.476394e+07 1.089526e+07 6.363057e+06 2.110501e+07 1.317961e+07 1.964956e+07 2.084287e+07 9.147253e+06 8.107562e+06 4.573873e+06 1.495664e+07 8.261427e+06 1.333732e+07 1.451843e+07 6.774954e+06 1.376731e+07 1.190724e+07 2.132232e+07 1.352614e+07 1.104981e+07 9.745816e+06 1.764056e+07 9.946193e+06 1.571198e+07 1.537968e+07 1.503675e+07 1.704243e+07 1.508696e+07 1.175073e+07 1.865232e+07 1.046231e+07 2.517526e+07 6.784789e+06 8.490064e+06 1.270320e+07 1.420142e+07 5.360938e+06 1.286221e+07 6.264016e+06 1.416491e+07 8.840619e+06 1.427299e+07 1.066273e+07 1.212384e+07 1.430150e+07 1.243877e+07 1.432349e+07 1.352140e+07 6.939617e+06 1.767152e+07 1.470130e+07 9.040469e+06 1.579775e+07 1.714885e+07 1.031334e+07 1.476263e+07 8.072479e+06 1.627779e+07 1.312611e+07 1.332127e+07 6.411501e+06 1.268856e+07 1.205498e+07 1.337367e+07 1.022914e+07 1.778218e+07 1.218331e+07 5.449660e+06 2.343940e+07 2.063354e+07 1.582630e+07 8.446245e+06 1.044964e+07 1.972205e+07 1.039974e+07 7.432038e+06 8.902591e+06 6.855352e+06 1.158832e+07 9.159510e+06 1.330207e+07 3.789461e+06 9.529659e+06 1.334025e+07 2.021013e+07 8.593681e+06 1.095673e+07 8.086892e+06 7.409767e+06 1.354892e+07 9.333350e+06 1.868129e+07 1.172263e+07 7.794356e+06 8.782409e+06 6.918595e+06 1.219944e+07 6.613009e+06 1.243949e+07 1.243836e+07 9.095517e+06 8.715203e+06 7.897416e+06 1.159249e+07 8.140227e+06 6.177790e+06 9.272869e+06 1.116839e+07 1.137354e+07 1.379995e+07 9.779166e+06 1.648807e+07 1.501659e+07 2.645467e+07 1.913348e+07 1.650891e+07 1.442376e+07 1.903212e+07 8.179562e+06 1.056829e+07 7.980819e+06 9.735904e+06 1.324340e+07 1.244047e+07 1.465534e+07 1.196389e+07 5.584848e+06 1.919410e+07 7.123987e+06 9.020798e+06 1.275934e+07 9.708689e+06 9.577967e+06 2.004414e+07 1.115562e+07 1.683229e+07 9.050723e+06 8.710000e+06 9.445628e+06 1.349277e+07 1.316163e+07 1.179092e+07 1.713888e+07 1.299686e+07 1.633832e+07 1.370533e+07 7.845509e+06 1.284511e+07 1.678664e+07 C9 H15 N O2_4.376 3.698228e+05 2.322140e+06 2.517968e+06 2.209984e+06 3.721919e+05 2.877300e+06 2.475419e+06 2.555731e+06 352671.76 3.060604e+06 1.935493e+06 2.390679e+06 316085.63 2.342891e+06 2.677097e+06 1.918530e+06 2.680285e+05 3.319515e+06 2.457111e+06 2.863870e+06 2.657387e+05 2.099002e+06 2.205868e+06 2.643346e+06 94486.550 2.723144e+06 2.457550e+06 2.598845e+06 1.320900e+05 2.013649e+06 2.857190e+06 2.426609e+06 157604.88 2.574040e+06 2.518553e+06 2.390655e+06 2.088361e+05 2.366892e+06 2.870466e+06 2.161744e+06 1.233817e+05 2.070814e+06 3.433399e+06 2.419148e+06 1.217204e+05 2.309498e+06 2.113865e+06 2.747133e+06 4.495037e+06 5.489335e+06 2.947376e+06 3.934615e+06 2.317982e+06 3.074256e+06 2.908715e+06 4.657875e+06 4.778779e+06 4.067526e+06 4.584513e+06 4.782110e+06 6.459500e+06 6.275626e+06 6.162443e+06 7.096283e+06 5.125229e+06 3.210053e+06 2.440743e+06 4.379733e+06 5.069651e+06 5.070981e+06 9.680259e+06 6.950189e+06 6.900299e+06 7.546219e+06 2.931290e+06 2.446919e+06 2.949511e+06 2.501210e+06 2.798597e+05 2.998761e+06 3.412448e+06 2.934078e+06 2.349878e+06 2.636283e+06 1.833726e+06 2.565372e+06 2.355919e+06 2.433024e+06 3.422749e+06 2.734755e+06 2.568635e+06 2.799597e+06 3.393797e+06 2.149187e+06 4.152299e+06 2.446756e+06 2.916590e+06 1.608277e+06 2.191931e+06 2.074574e+06 2.674878e+06 2.979401e+06 1.872059e+06 3.158114e+06 2.537289e+06 2.404075e+06 2.313482e+06 2.981389e+06 1.970675e+06 1.653227e+06 2.415679e+06 3.677381e+06 2.522502e+06 2.336824e+06 2.488826e+06 3.292968e+06 2.745961e+06 2.305255e+06 1.980597e+06 3.464701e+06 2.267244e+06 2.015549e+06 1.525656e+06 2.210626e+06 2.731315e+06 1.581567e+06 5.681746e+06 1.966012e+06 2.414072e+06 2.678639e+06 2.276727e+06 2.425757e+05 2.797438e+06 3.159844e+06 3.428146e+06 2.478391e+06 4.217452e+06 2.637382e+06 2.006987e+06 3.045772e+06 1.898526e+05 3.874610e+06 3.199895e+06 2.300247e+05 4.240224e+05 3.059071e+05 2.011784e+05 2.333228e+05 3.996054e+05 2.235552e+05 3.352513e+05 2.281818e+05 2.426534e+05 1.118122e+06 1.109370e+06 1.736465e+06 3.024686e+06 2.896251e+06 2.910153e+06 1.482634e+06 1.509390e+06 1.449572e+06 2.037723e+06 2.231582e+06 3.559017e+06 2.635469e+06 3.156581e+06 2.337299e+06 2.493425e+06 3.325687e+06 3.466875e+06 3.237810e+06 3.095999e+06 3.897966e+06 3.621245e+06 3.173154e+06 5.008882e+06 5.951947e+06 6.581155e+06 4.899373e+06 1.222197e+06 2.000647e+05 2.811342e+05 9.669470e+05 2.569134e+05 2.559150e+05 3.390537e+05 1.884802e+05 1.270790e+06 1.967413e+05 9.649712e+05 3.039142e+05 2.246791e+05 2.221390e+05 1.206444e+06 2.985619e+05 1.038997e+06 9.144194e+05 2.868300e+05 9.055191e+05 1.576959e+06 1.615080e+06 2.530385e+05 2.843481e+05 3.435396e+05 3.626610e+05 2.357785e+05 3.366442e+05 2.333576e+05 3.187166e+05 2.232209e+05 3.037364e+05 2.874979e+05 2.263650e+05 1.943779e+05 2.712742e+05 1.583569e+06 1.933242e+05 4.170143e+05 2.383389e+05 3.201295e+05 3.677775e+05 2.551866e+05 3.008830e+05 2.435394e+05 4.114266e+05 2.109180e+05 1.899455e+05 2.559762e+05 3.563673e+05 2.490674e+05 2.342374e+05 2.266609e+05 3.060669e+05 2.398183e+05 2.270410e+05 3.998801e+05 2.255305e+05 4.136172e+06 2.219094e+06 5.538280e+06 7.051348e+06 7.223636e+06 1.019839e+07 6.121831e+06 7.479883e+06 6.686682e+06 5.249741e+06 6.111695e+06 1.104893e+07 8.872688e+06 4.821306e+05 8.099309e+06 2.322989e+06 1.587367e+07 2.257663e+06 1.830674e+06 2.975676e+05 1.776986e+06 4.094511e+06 7.309146e+06 6.944971e+06 2-arachidonyl-sn-glycero-3-phosphoethanolamine_4.378 2.687205e+07 1.652589e+07 1.759971e+07 1.462985e+07 1.294947e+05 1.667066e+07 1.631106e+07 1.713670e+07 129383.87 1.593094e+07 1.634450e+07 1.721852e+07 128434.37 1.542845e+07 1.698887e+07 1.731081e+07 1.143151e+05 1.492758e+07 1.651393e+07 1.619700e+07 1.256917e+05 1.626579e+07 1.547724e+07 2.003917e+07 45852.727 1.454362e+07 1.658824e+07 1.647564e+07 6.754233e+04 1.520756e+07 1.598078e+07 1.781148e+07 73484.08 1.582498e+07 1.684205e+07 1.583814e+07 1.040274e+05 1.583496e+07 1.712119e+07 1.679673e+07 6.603040e+04 1.512095e+07 1.705901e+07 1.813486e+07 6.574571e+04 1.624978e+07 1.317068e+07 1.813273e+07 7.909226e+06 1.466157e+07 6.357985e+06 2.118603e+07 1.356671e+07 1.572065e+07 2.109137e+07 3.216110e+07 3.686479e+07 4.775526e+07 3.421582e+07 1.385476e+07 1.946098e+07 2.309145e+07 1.838050e+07 3.876022e+07 2.435786e+07 9.475644e+06 2.585138e+07 8.407622e+06 1.659493e+07 1.273530e+07 1.979576e+07 2.005404e+07 1.657463e+07 2.288992e+07 2.656039e+07 1.990052e+07 1.377279e+07 1.948249e+07 3.910283e+07 2.232734e+07 1.670035e+07 6.900587e+06 7.715486e+06 1.237452e+07 1.746160e+07 1.825268e+07 8.739076e+06 6.707577e+06 1.416208e+07 1.079334e+07 1.386724e+07 1.466502e+07 1.326957e+07 1.989843e+07 1.695403e+07 2.017642e+07 9.632878e+06 2.047632e+07 1.311851e+07 1.938684e+07 1.692455e+07 1.875133e+07 1.485567e+07 2.008237e+07 1.339535e+07 1.954157e+07 9.785302e+06 1.109657e+07 1.828705e+07 1.828735e+07 9.095009e+06 1.369225e+07 2.243021e+07 1.786196e+07 1.382833e+07 7.319164e+06 1.614729e+07 1.161201e+07 1.867156e+07 2.494738e+07 8.726370e+06 8.721672e+06 5.156718e+06 1.893981e+07 8.448023e+06 1.432936e+07 1.532097e+07 8.214913e+06 1.561262e+07 1.286663e+07 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8.212117e+06 7.514889e+06 1.226890e+07 1.174231e+07 1.503333e+07 1.360176e+07 1.023943e+07 1.170801e+07 9.915183e+06 1.418531e+07 9.499945e+06 8.795310e+06 1.057065e+07 1.227621e+07 1.188553e+07 1.576391e+07 9.587922e+06 1.728392e+07 1.601660e+07 3.300073e+07 1.960838e+07 2.165061e+07 1.775511e+07 2.336522e+07 9.680857e+06 1.118868e+07 9.916856e+06 1.302730e+07 1.560193e+07 1.523083e+07 1.815765e+07 1.279960e+07 6.454872e+06 2.381646e+07 7.874377e+06 1.103947e+07 1.417997e+07 1.009653e+07 1.222371e+07 2.297875e+07 1.337329e+07 1.888462e+07 9.297920e+06 1.024803e+07 1.281621e+07 1.429644e+07 1.623154e+07 1.348362e+07 2.356895e+07 1.319337e+07 1.923521e+07 1.709881e+07 9.595875e+06 1.722978e+07 2.217571e+07 C13 H36 N9 O13 P_4.388 1.505288e+06 1.032132e+06 7.681668e+05 6.308920e+05 1.023101e+05 6.941185e+05 8.419522e+05 8.675419e+05 99268.84 7.634681e+05 7.677321e+05 8.931949e+05 96241.52 6.762464e+05 8.317291e+05 7.555741e+05 8.100093e+04 7.684495e+05 8.582359e+05 8.827167e+05 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4.534377e+06 2.231383e+06 2.047018e+06 2.126217e+06 3.869352e+06 2.274211e+06 2.499529e+06 2.502004e+06 5.882437e+06 1.839006e+06 2.127520e+06 2.676895e+06 2.466791e+06 2.262820e+06 4.290534e+06 2.384518e+06 1.990665e+06 2.252852e+06 2.506899e+06 1.706853e+06 2.446966e+06 2.500224e+06 2.510726e+06 5.960713e+06 2.087228e+06 2.912382e+06 2.070715e+06 1.429342e+06 2.764714e+06 3.233100e+06 C6 H21 N6 O5 P_4.394 4.524438e+06 2.462172e+06 3.091671e+06 2.456473e+06 1.343989e+05 3.404739e+06 2.738021e+06 2.749524e+06 139941.93 2.561079e+06 2.719796e+06 2.803357e+06 119757.90 3.200283e+06 2.456269e+06 3.280536e+06 1.055279e+05 2.555164e+06 2.547416e+06 3.291562e+06 1.063985e+05 2.604663e+06 2.892091e+06 2.724076e+06 42089.696 2.575404e+06 3.126853e+06 2.718175e+06 6.245211e+04 2.570719e+06 3.029806e+06 2.659613e+06 68100.83 2.833873e+06 2.563467e+06 3.174012e+06 9.642355e+04 2.565668e+06 2.873452e+06 3.173720e+06 5.788365e+04 2.407149e+06 2.916572e+06 3.167272e+06 6.286780e+04 2.423499e+06 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1.538468e+06 1.546999e+06 1.252997e+06 1.412957e+06 1.017221e+06 1.744652e+06 1.311564e+06 1.650384e+06 1.196870e+06 1.006384e+06 1.317119e+06 1.241131e+06 6.219867e+05 1.640152e+06 9.280004e+05 1.711084e+06 5.620692e+05 1.674336e+06 8.389984e+05 1.371907e+06 8.322494e+05 1.670088e+06 2.432080e+06 1.696923e+06 1.297599e+06 1.280799e+06 1.121849e+06 1.926565e+06 1.622611e+06 1.449871e+06 1.835739e+06 1.526001e+06 1.136355e+06 1.329166e+06 1.904367e+06 1.150648e+06 1.425074e+06 5.031491e+05 1.586362e+06 2.630457e+06 1.337591e+06 1.763099e+06 1.276460e+06 7.006701e+05 2.610034e+06 8.539699e+05 1.416872e+06 1.203032e+06 1.373361e+06 1.769577e+06 7.628790e+05 1.824197e+06 1.175892e+06 2.164594e+06 1.648107e+06 1.368207e+06 1.547978e+06 2.384564e+05 6.113510e+05 1.132415e+06 9.800250e+05 1.254780e+06 1.567424e+06 1.401383e+06 1.529747e+06 8.441648e+05 1.235220e+06 1.068941e+06 1.021243e+06 1.040777e+06 5.324703e+05 1.044316e+06 1.328287e+06 1.443037e+06 1.105183e+06 1.602155e+06 1.014883e+06 1.670370e+06 1.122088e+06 9.020788e+05 1.017403e+06 8.152778e+05 1.019738e+06 1.680799e+06 1.413751e+06 1.360511e+06 1.637248e+06 1.398312e+06 1.265730e+06 1.495860e+06 1.694191e+06 1.573494e+06 1.477405e+06 1.137301e+06 1.922640e+06 1.123949e+06 1.940247e+06 9.775371e+05 1.450709e+06 2.051319e+06 1.837538e+06 8.002601e+05 2.097333e+06 7.866452e+05 1.070915e+06 1.240728e+06 1.064585e+06 7.638891e+05 1.170938e+06 7.898599e+05 1.694965e+06 1.476239e+06 1.638451e+06 5.660146e+05 1.246409e+06 1.869203e+06 3.206975e+06 2.171704e+06 1.570506e+06 1.671662e+06 1.548986e+06 1.761788e+06 7.138441e+05 1.536969e+06 3.074267e+06 C8 H22 N3 O6 P_4.406 3.270422e+06 1.685069e+06 2.434618e+06 1.811489e+06 1.333684e+05 1.854283e+06 1.706287e+06 1.877309e+06 147394.69 2.171865e+06 1.639217e+06 1.796572e+06 131945.21 2.127801e+06 2.041591e+06 2.043903e+06 1.222437e+05 1.830485e+06 1.771245e+06 1.922153e+06 1.158458e+05 1.856485e+06 1.796126e+06 2.320303e+06 36710.052 1.718781e+06 2.161081e+06 1.980380e+06 3.987844e+04 1.615643e+06 1.788366e+06 1.658023e+06 74310.85 2.297606e+06 1.989442e+06 1.800931e+06 9.787698e+04 1.885122e+06 1.952638e+06 2.246091e+06 5.856810e+04 1.676719e+06 1.804160e+06 2.182169e+06 6.178958e+04 1.832898e+06 1.534935e+06 2.174272e+06 5.730575e+05 2.572326e+06 1.287469e+06 2.392318e+06 1.245207e+06 1.797028e+06 1.818964e+06 2.843177e+06 8.101861e+06 7.151407e+06 2.632669e+06 2.424922e+06 1.808475e+06 3.873022e+06 1.797259e+06 6.327909e+06 1.554214e+06 4.246783e+05 2.563461e+06 6.874717e+05 1.432356e+06 1.201026e+06 2.269283e+06 1.253982e+06 1.667827e+06 2.118564e+06 2.623813e+06 2.386159e+06 4.439918e+05 2.629449e+06 3.784818e+06 1.854401e+06 1.510362e+06 4.073512e+05 5.410320e+05 6.518758e+05 1.458527e+06 2.167095e+06 1.951760e+06 1.644804e+06 1.147163e+06 1.946331e+06 8.011601e+05 1.159820e+06 1.976624e+06 2.534672e+06 1.531650e+06 2.826241e+06 1.534372e+06 1.160334e+06 1.536100e+06 1.633459e+06 1.924675e+06 3.403098e+06 2.120477e+06 2.687334e+06 1.102015e+06 1.065036e+06 1.079057e+06 1.629801e+06 1.987179e+06 1.683949e+06 1.808057e+06 1.575905e+06 2.173608e+06 2.902432e+06 1.975493e+06 5.407979e+05 1.811258e+06 2.146787e+06 2.147221e+06 5.763633e+06 1.576896e+06 5.618132e+05 7.047045e+05 2.467729e+06 1.061667e+06 2.583253e+06 1.515096e+06 7.909336e+05 2.003802e+06 6.212135e+05 2.092159e+06 2.231754e+06 2.174479e+06 1.826051e+06 3.438495e+06 1.251685e+06 2.737466e+06 4.811473e+06 3.887124e+06 2.604061e+06 1.917636e+06 1.115557e+06 2.100512e+06 1.383368e+06 3.852178e+06 1.913044e+06 1.414448e+06 2.880778e+06 2.445349e+06 3.072401e+05 1.506416e+06 6.903017e+05 3.075958e+06 2.004806e+06 2.244711e+06 1.608810e+06 1.576389e+06 1.370846e+06 8.199898e+05 4.797576e+06 1.690430e+06 4.840417e+05 3.348089e+06 2.285780e+06 9.496483e+05 3.381221e+06 2.368742e+06 1.711371e+06 2.195128e+06 1.403124e+06 4.735221e+06 2.370907e+06 1.386992e+06 5.900027e+05 1.483473e+06 1.126603e+06 1.537126e+06 1.863328e+06 3.671776e+06 1.539404e+06 5.821889e+05 1.352362e+06 4.388999e+06 1.714969e+06 9.563050e+05 1.648927e+06 2.706628e+06 1.265573e+06 5.256535e+05 7.060272e+05 1.141270e+06 1.908004e+06 8.954008e+05 3.822883e+06 4.697667e+05 1.286184e+06 4.211995e+06 1.308221e+06 8.452026e+05 1.144389e+06 2.178538e+06 1.196734e+06 2.512867e+06 1.764651e+06 3.487617e+06 2.459852e+06 1.382265e+06 1.693341e+06 8.286198e+05 1.049460e+06 1.311253e+06 1.313019e+06 1.242172e+06 1.639869e+06 6.514516e+05 2.007318e+06 2.282246e+06 5.753873e+05 2.181588e+06 2.028241e+06 1.716452e+06 2.651306e+06 2.141459e+06 1.280282e+06 1.700712e+06 1.025762e+06 3.345554e+06 3.203622e+06 3.127276e+06 2.301613e+06 2.076034e+06 5.682144e+05 1.596085e+06 9.364114e+05 1.077133e+06 1.628880e+06 3.161692e+06 1.460876e+06 8.282591e+05 7.467706e+05 4.677363e+06 5.851239e+05 6.315641e+05 1.931162e+06 1.366750e+06 1.105928e+06 2.773916e+06 7.554458e+05 1.402191e+06 1.341787e+06 1.135035e+06 5.988343e+05 1.535856e+06 1.824268e+06 1.723460e+06 2.832531e+06 5.936837e+05 2.347144e+06 2.418270e+06 1.128687e+06 1.935383e+06 2.575410e+06 XANTHINE 1.287275e+07 1.579526e+07 1.640476e+07 1.595019e+07 2.321200e+05 1.821664e+07 1.729504e+07 1.849881e+07 242517.30 1.587620e+07 1.618071e+07 1.830794e+07 228214.96 1.539433e+07 1.672641e+07 1.672418e+07 2.278319e+05 1.628781e+07 1.674208e+07 1.732008e+07 2.238501e+05 1.530481e+07 1.729034e+07 2.031863e+07 113555.241 1.500517e+07 1.697323e+07 1.615689e+07 8.824541e+04 1.541482e+07 1.610607e+07 1.829014e+07 167196.84 1.633725e+07 1.806088e+07 1.629279e+07 2.231716e+05 1.523215e+07 1.719105e+07 1.747159e+07 1.284003e+05 1.575031e+07 1.838420e+07 1.822524e+07 1.306269e+05 1.466461e+07 1.570348e+07 1.764761e+07 1.489699e+07 1.104576e+07 1.296089e+07 7.171253e+07 2.024904e+07 1.418461e+07 1.454068e+07 2.294584e+07 1.077867e+07 1.055409e+07 9.510520e+06 5.443376e+07 1.732394e+07 1.174073e+07 1.758966e+07 1.690354e+07 3.688938e+07 2.716890e+07 1.048679e+07 8.041142e+06 4.652732e+06 1.311375e+07 6.228480e+07 1.225431e+07 1.468869e+07 3.731944e+07 8.305060e+06 3.362069e+07 1.019310e+07 2.480800e+07 4.129189e+07 1.582623e+07 8.186497e+06 2.856611e+07 1.030974e+07 2.419460e+07 8.771995e+06 1.475960e+07 6.419656e+06 5.924063e+06 1.106898e+07 7.593922e+06 1.764780e+07 5.105970e+07 5.558385e+06 1.065399e+07 1.018597e+07 3.908128e+07 5.045996e+07 5.817736e+06 4.209382e+07 9.298767e+06 5.818895e+06 2.032405e+07 6.572299e+06 2.316913e+07 6.546197e+06 7.480957e+06 8.322326e+06 5.047690e+06 1.258383e+07 1.137961e+07 7.224427e+06 1.439634e+07 9.425274e+06 3.148582e+07 7.489652e+07 7.175818e+06 2.495190e+07 1.126577e+07 6.851496e+06 8.578798e+06 8.472745e+06 3.909088e+06 3.112143e+06 4.467517e+06 6.119782e+06 5.684342e+06 1.616031e+07 4.933496e+06 5.713904e+06 2.214713e+07 1.013851e+07 4.917457e+07 5.626339e+06 4.493277e+06 6.364552e+06 6.757525e+06 1.240748e+07 5.756738e+06 7.596900e+06 5.908708e+06 9.377755e+06 9.779585e+06 6.645944e+06 6.506973e+06 8.624398e+06 7.807425e+06 6.611553e+06 8.872319e+06 6.795913e+06 1.019074e+07 8.092471e+06 1.522668e+07 8.567208e+06 1.764538e+07 1.404134e+07 6.430809e+06 7.545944e+06 1.643702e+07 1.266149e+07 1.225487e+07 1.230223e+07 1.344827e+07 2.577586e+07 1.364152e+07 9.821549e+06 1.022898e+07 9.918892e+06 1.304222e+07 8.666823e+06 1.595091e+07 1.626278e+07 1.148221e+07 5.855305e+06 1.032303e+07 1.075027e+07 2.206105e+07 1.289838e+07 2.059515e+07 8.380279e+06 2.649034e+07 4.114295e+07 4.981545e+06 8.139245e+06 2.095834e+07 3.714297e+07 1.900102e+07 9.605942e+06 9.017309e+06 1.317005e+07 1.071729e+07 5.058781e+06 2.583612e+07 9.738659e+06 2.017140e+07 1.224140e+07 1.261520e+07 1.020974e+07 9.609972e+06 1.418230e+07 1.392189e+07 1.700148e+07 1.452293e+07 9.498611e+06 9.549563e+06 8.467919e+06 7.066605e+07 9.091266e+06 1.268379e+07 1.097295e+07 1.138622e+07 1.774973e+07 1.104710e+07 8.287110e+06 9.331772e+06 6.464964e+07 2.512386e+07 9.308238e+06 8.509916e+06 3.094104e+08 1.332176e+07 8.872886e+06 9.171451e+06 7.559318e+06 1.094978e+07 1.882412e+07 9.970322e+06 1.506696e+07 8.609069e+06 2.722563e+07 6.431444e+06 6.815828e+07 1.701925e+07 1.764441e+07 1.726883e+07 1.815740e+07 1.068767e+07 5.619777e+06 6.981446e+06 4.415580e+06 1.351081e+07 2.086665e+07 1.301628e+07 1.675320e+07 1.221183e+07 2.366086e+07 3.635016e+07 1.052322e+07 1.248931e+07 6.919299e+06 2.363027e+07 1.260463e+07 4.403688e+07 1.982611e+07 1.546150e+07 2.757063e+07 6.268974e+07 1.214192e+07 1.050226e+07 7.964127e+06 5.265423e+06 6.241231e+06 1.239746e+07 1-Oleoyl-2-hydroxy-sn-glycero-3-PE_4.408 2.011828e+07 1.049376e+07 1.083988e+07 1.016287e+07 1.286796e+05 1.230059e+07 1.155415e+07 1.203124e+07 137420.97 9.850922e+06 1.070036e+07 1.154982e+07 127538.18 1.166155e+07 1.084333e+07 9.685149e+06 1.282583e+05 1.108915e+07 1.054782e+07 1.178048e+07 1.197121e+05 1.035395e+07 1.266476e+07 1.163480e+07 40170.980 1.044188e+07 1.029230e+07 1.115947e+07 4.400526e+04 1.039084e+07 1.092204e+07 1.137116e+07 81791.46 1.115580e+07 1.154364e+07 1.104541e+07 1.127989e+05 1.117029e+07 1.123000e+07 1.182631e+07 6.856449e+04 7.941790e+06 1.025318e+07 1.552992e+07 6.514638e+04 9.706556e+06 9.560218e+06 1.147823e+07 4.410582e+06 1.367502e+07 8.045605e+06 1.111745e+07 7.092379e+06 8.885644e+06 1.179771e+07 2.229767e+07 4.495806e+07 4.227130e+07 1.766618e+07 1.194718e+07 1.287828e+07 2.511178e+07 1.055857e+07 4.454458e+07 1.212639e+07 2.425044e+06 1.576885e+07 3.996942e+06 8.314461e+06 4.994942e+06 1.527087e+07 8.119633e+06 1.164173e+07 1.172553e+07 1.444670e+07 1.482758e+07 3.634490e+06 1.463933e+07 2.268157e+07 1.575650e+07 7.858393e+06 3.964169e+06 3.236324e+06 5.088384e+06 7.090708e+06 1.348871e+07 9.056398e+06 8.581555e+06 6.743028e+06 9.703739e+06 4.933838e+06 9.087254e+06 9.456622e+06 1.366659e+07 9.567432e+06 2.046688e+07 8.908288e+06 8.357147e+06 8.125022e+06 9.043127e+06 1.402027e+07 1.956914e+07 1.009494e+07 1.490905e+07 5.834475e+06 9.069615e+06 6.683390e+06 7.123140e+06 7.436702e+06 7.259709e+06 7.219474e+06 8.776533e+06 1.384839e+07 1.916360e+07 1.233376e+07 3.893409e+06 1.094158e+07 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1.856585e+06 2.269479e+06 2.284494e+06 1.682040e+06 1.920843e+06 1.185184e+06 2.417252e+06 2.833553e+06 2.093589e+06 1.566968e+06 1.768066e+06 1.215694e+06 3.313613e+06 1.116687e+06 1.997914e+06 3.086515e+06 1.872845e+06 1.828477e+06 1.787344e+06 2.863085e+06 2.133444e+06 2.469184e+06 1.952818e+06 2.365794e+06 2.142554e+06 1.082692e+06 1.105062e+06 1.182238e+06 1.203402e+06 1.751922e+06 1.776767e+06 2.098887e+06 2.466965e+06 1.450105e+06 2.064018e+06 1.722777e+06 1.571259e+06 1.905598e+06 1.283275e+06 2.069447e+06 1.196945e+06 2.149082e+06 1.268992e+06 1.786507e+06 1.985540e+06 2.007557e+06 1.834445e+06 1.520438e+06 1.484868e+06 1.039530e+06 1.905725e+06 2.417266e+06 1.969012e+06 2.673495e+06 2.249348e+06 1.920712e+06 1.701429e+06 1.789271e+06 2.167177e+06 2.001385e+06 2.034382e+06 2.202138e+06 2.425859e+06 1.787921e+06 2.770037e+06 2.169681e+06 2.778855e+06 3.227774e+06 2.869393e+06 1.026012e+06 2.021998e+06 1.416838e+06 2.266969e+06 1.743863e+06 2.104506e+06 1.487570e+06 1.408534e+06 1.553378e+06 2.242272e+06 1.546717e+06 1.940305e+06 9.026904e+05 2.222021e+06 2.079568e+06 2.777771e+06 2.154575e+06 1.458700e+06 2.501393e+06 2.195677e+06 2.041311e+06 1.317911e+06 2.212989e+06 2.098448e+06 "2-[(4E,7E,10E,13E,16E,19E)-4,7,10,13,16,19-Docosahexaenoyloxy]-3-(hexadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate_4.427" 2.083927e+07 2.119469e+07 1.441234e+07 1.107663e+07 1.213473e+05 1.547050e+07 1.231042e+07 1.435078e+07 139121.13 1.602786e+07 1.539731e+07 2.003158e+07 140222.60 1.422725e+07 1.655031e+07 1.350963e+07 1.491672e+05 1.320724e+07 1.332978e+07 1.916525e+07 1.565685e+05 1.360981e+07 1.531662e+07 1.561158e+07 40597.285 1.130346e+07 1.141384e+07 2.712149e+07 4.852237e+04 1.531470e+07 1.094742e+07 1.285361e+07 85270.57 1.697275e+07 1.359961e+07 1.539117e+07 1.273438e+05 1.565315e+07 1.573732e+07 1.621428e+07 7.729560e+04 1.360514e+07 1.580850e+07 1.784577e+07 7.667385e+04 1.121014e+07 1.714134e+07 1.482361e+07 2.113496e+07 1.271398e+07 8.206337e+06 2.703240e+07 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1.269285e+07 9.541113e+06 8.935590e+06 8.411308e+06 1.474139e+05 6.156106e+06 9.793602e+06 8.448627e+06 140114.12 6.845497e+06 8.540625e+06 9.395723e+06 124096.26 8.897131e+06 8.424619e+06 8.835349e+06 1.120573e+05 7.264728e+06 8.036844e+06 8.872305e+06 1.138224e+05 8.786669e+06 7.040085e+06 9.934906e+06 33859.414 9.556552e+06 7.512475e+06 8.053949e+06 5.213292e+04 8.448487e+06 7.804796e+06 7.659632e+06 75884.09 8.416811e+06 9.276048e+06 7.809448e+06 9.374927e+04 9.400180e+06 9.757322e+06 8.330739e+06 6.019339e+04 7.464324e+06 7.844154e+06 8.325094e+06 6.692563e+04 7.825248e+06 9.960501e+06 7.857540e+06 3.192970e+06 6.932608e+06 5.499941e+06 6.544898e+06 8.909461e+06 7.922747e+06 1.098431e+07 1.988131e+07 3.814058e+07 3.389868e+07 1.077860e+07 6.937833e+06 7.818931e+06 1.574952e+07 7.832307e+06 1.696400e+07 6.775214e+06 2.885000e+06 1.753415e+07 4.651310e+06 6.035204e+06 5.970847e+06 1.175844e+07 9.092313e+06 4.658293e+06 7.315181e+06 1.769637e+07 1.195969e+07 2.685760e+06 1.128528e+07 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1.291567e+07 7.814724e+06 7.926628e+06 5.133144e+06 1.217064e+07 1.122109e+07 3.497364e+06 1.602722e+07 9.861393e+06 4.118736e+06 1.285027e+07 1.330511e+07 5.233662e+06 1.120536e+07 7.024432e+06 1.105030e+07 1.152478e+07 9.246425e+06 3.620888e+06 8.838444e+06 4.607823e+06 7.913352e+06 6.559391e+06 1.173658e+07 5.739535e+06 3.168110e+06 1.024187e+07 1.789127e+07 7.888999e+06 3.795444e+06 8.546154e+06 1.253327e+07 5.717474e+06 2.093097e+06 9.066884e+06 5.910040e+06 6.056155e+06 6.963669e+06 1.475578e+07 3.837847e+06 8.247319e+06 1.803752e+07 7.739106e+06 5.821384e+06 5.053460e+06 7.112519e+06 4.503482e+06 1.064290e+07 7.299441e+06 1.195231e+07 1.656611e+07 8.078328e+06 9.647830e+06 4.085809e+06 4.916959e+06 4.016441e+06 4.401879e+06 6.352711e+06 6.723486e+06 3.785107e+06 8.596940e+06 9.872751e+06 4.562441e+06 5.204496e+06 9.681527e+06 1.124735e+07 1.002803e+07 9.472003e+06 6.296892e+06 7.427399e+06 8.525685e+06 2.396993e+07 1.447389e+07 1.428551e+07 1.129070e+07 7.236925e+06 4.697602e+06 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1.715355e+06 1.696170e+06 1.305922e+06 2.217277e+06 1.492016e+06 1.677909e+06 1.960162e+06 2.032181e+06 1.741348e+06 1.995970e+06 1.489829e+06 1.159106e+06 1.529040e+06 1.252644e+06 1.376475e+06 1.627450e+06 8.456422e+05 2.553091e+06 2.182632e+06 1.113203e+06 1.224610e+06 1.875628e+06 1.603000e+06 1.621624e+06 2.389500e+06 3.628173e+06 1.148968e+06 3.444688e+06 2.571963e+06 2.186100e+06 1.459318e+06 1.335393e+06 1.021566e+06 2.911647e+06 1.660163e+06 8.922117e+05 2.986765e+06 2.055393e+06 3.914531e+06 1.864696e+06 1.273931e+06 1.940117e+06 1.440289e+06 1.953456e+06 2.013198e+06 1.186076e+06 2.366389e+06 1.126631e+06 1.759253e+06 1.047210e+06 1.738199e+06 1.529402e+06 1.738934e+06 1.440187e+06 5.212363e+05 1.986262e+06 2.282392e+06 1.174319e+06 3.706056e+06 1.688088e+06 2.129791e+06 1.808113e+06 1.725242e+06 8.456926e+05 1.524598e+06 1.476949e+06 1.481697e+06 1.507271e+06 7.826013e+05 1.468400e+06 2.442678e+06 2.155031e+06 1.273959e+06 1.601078e+06 1.277656e+06 2.443949e+06 1.192816e+06 9.387350e+05 2.144133e+06 1.303013e+06 2.253633e+06 9.824374e+05 2.358154e+06 1.225804e+06 8.050949e+05 1.982260e+06 1.413256e+06 1.333144e+06 7.381688e+05 1.054602e+06 7.473790e+05 5.415929e+05 1.200671e+06 1.523394e+06 9.096109e+05 1.471220e+06 1.064637e+06 7.538130e+05 1.339618e+06 5.515566e+05 1.165519e+06 1.160772e+06 1.609167e+06 1.329242e+06 1.476271e+06 1.153604e+06 1.207384e+06 1.093695e+06 1.433646e+06 1.231225e+06 1.281032e+06 1.597080e+06 6.039777e+05 5.344072e+05 1.592778e+06 7.951720e+05 2.317307e+06 2.089823e+06 1.730251e+06 1.441254e+06 1.633071e+06 1.777148e+06 1.541474e+06 1.724995e+06 9.523964e+05 1.507894e+06 5.630231e+05 1.568400e+06 1.879829e+06 2.038326e+06 3.473009e+06 3.222332e+06 5.018482e+05 1.548639e+06 1.226025e+06 2.576991e+06 1.372006e+06 1.554474e+06 8.242564e+05 9.326179e+05 1.711154e+06 1.792930e+06 1.375175e+06 2.025354e+06 6.060910e+05 1.646098e+06 1.818753e+06 2.695393e+06 2.341768e+06 1.349472e+06 1.916701e+06 1.796552e+06 2.090970e+06 8.681083e+05 1.964206e+06 1.922902e+06 "1-[(9Z)-octadecenoyl]-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphocholine_4.447" 1.550089e+07 9.447985e+06 9.420105e+06 7.830193e+06 1.122605e+05 8.251353e+06 8.567970e+06 9.253970e+06 115876.59 7.993992e+06 9.085342e+06 9.629506e+06 120235.37 8.421231e+06 8.761179e+06 9.106794e+06 1.142450e+05 7.787075e+06 8.663800e+06 8.253161e+06 1.163134e+05 8.568131e+06 9.187095e+06 1.063511e+07 34041.508 7.909047e+06 8.415511e+06 8.639889e+06 5.280826e+04 8.908550e+06 8.862144e+06 7.825696e+06 67568.37 8.370482e+06 9.391625e+06 9.486697e+06 1.039679e+05 7.657472e+06 9.351715e+06 9.748957e+06 6.026214e+04 6.994177e+06 9.382782e+06 1.003761e+07 6.003433e+04 7.857521e+06 7.767544e+06 9.320934e+06 6.663911e+06 8.313598e+06 1.850921e+07 6.538446e+06 9.028217e+06 7.826669e+06 6.700907e+06 7.926033e+06 4.346622e+06 5.520167e+06 1.449166e+07 8.974242e+06 1.152514e+07 1.130839e+07 9.407374e+06 1.489583e+07 1.197322e+07 7.896283e+06 8.340266e+06 6.987840e+06 7.139131e+06 7.977309e+06 1.251727e+07 8.451493e+06 9.085967e+06 8.534067e+06 8.545484e+06 8.230949e+06 1.237546e+07 1.042480e+07 1.485438e+07 8.451225e+06 8.626812e+06 7.203782e+06 6.625152e+06 9.959978e+06 6.175401e+06 7.837058e+06 7.231098e+06 7.309798e+06 7.592274e+06 8.083283e+06 6.925972e+06 1.344286e+07 7.040982e+06 7.824179e+06 1.013824e+07 1.326891e+07 5.729713e+06 1.040251e+07 7.192423e+06 6.775301e+06 7.114779e+06 6.823751e+06 6.439010e+06 7.070684e+06 6.770462e+06 7.050893e+06 6.314378e+06 3.554333e+06 4.800422e+06 5.250344e+06 6.252513e+06 1.051931e+07 9.882756e+06 8.563291e+06 5.730389e+06 6.724992e+06 6.803346e+06 4.305239e+06 6.911596e+06 9.923016e+06 6.125213e+06 4.382902e+06 2.765485e+06 6.639203e+06 6.736223e+06 9.486154e+06 1.048028e+07 8.526489e+06 1.094530e+07 7.578840e+06 7.846622e+06 1.219950e+07 8.866541e+06 8.084777e+06 9.289499e+06 6.832046e+06 1.017573e+07 7.306686e+06 6.684743e+06 7.580936e+06 8.624543e+06 8.057728e+06 1.015155e+07 7.208918e+06 6.362938e+06 6.596404e+06 5.664831e+06 1.031466e+07 1.004849e+07 3.353394e+06 7.267625e+06 5.446542e+06 7.626577e+06 5.271447e+06 7.848567e+06 7.509854e+06 7.898890e+06 6.161589e+06 8.002934e+06 1.092550e+07 1.981425e+07 9.341400e+06 4.087402e+06 1.152465e+07 8.691952e+06 1.052157e+07 7.267191e+06 1.100880e+07 8.034192e+06 1.260503e+07 9.866986e+06 1.111882e+07 1.001102e+07 7.368667e+06 4.880845e+06 9.812820e+06 1.497642e+07 8.258836e+06 6.970570e+06 8.865723e+06 3.665435e+06 9.537030e+06 8.813245e+06 7.985420e+06 6.050025e+06 9.164144e+06 8.307540e+06 8.838283e+06 7.633362e+06 7.874298e+06 1.550051e+07 9.601229e+06 9.123676e+06 1.256823e+07 5.951947e+06 6.339886e+06 9.831831e+06 9.970558e+06 7.602383e+06 8.496756e+06 3.850336e+06 6.450933e+06 7.195224e+06 7.881302e+06 6.774662e+06 1.080744e+07 5.791935e+06 6.383351e+06 4.923990e+06 6.520507e+06 1.081842e+07 6.656431e+06 8.639912e+06 8.532864e+06 5.803928e+06 8.460554e+06 7.177121e+06 7.833461e+06 1.114309e+07 5.763107e+06 1.037933e+07 1.012288e+07 8.414134e+06 6.090290e+06 7.503070e+06 7.266993e+06 7.768168e+06 9.107359e+06 1.073591e+07 9.552832e+06 7.398714e+06 9.924262e+06 6.449459e+06 1.046232e+07 7.342810e+06 7.953854e+06 1.046716e+07 9.555184e+06 7.609008e+06 1.427082e+07 1.085143e+07 7.275449e+06 7.667120e+06 7.683856e+06 8.577249e+06 7.313148e+06 8.003760e+06 9.604703e+06 9.665857e+06 9.614218e+06 8.046012e+06 1.126586e+07 1.026080e+07 2.700403e+07 8.236199e+06 1.152486e+07 9.551749e+06 1.082125e+07 1.330221e+07 9.043442e+06 7.931919e+06 1.782615e+07 1-STEAROYL-2-DOCOSAHEXANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE_4.449 5.178248e+07 5.740138e+07 3.106882e+07 3.867141e+07 1.054620e+05 3.544752e+07 4.252063e+07 4.253363e+07 113311.71 3.978352e+07 4.164479e+07 4.222755e+07 120611.67 4.031791e+07 4.129642e+07 4.246143e+07 1.126909e+05 4.026653e+07 3.929655e+07 4.147830e+07 1.190144e+05 3.738200e+07 4.623353e+07 4.557312e+07 35644.619 3.801181e+07 3.981481e+07 4.048084e+07 5.372960e+04 3.879198e+07 4.100681e+07 4.762792e+07 75274.17 4.205463e+07 3.862177e+07 4.588937e+07 1.133129e+05 2.620861e+07 4.658562e+07 4.546482e+07 5.988783e+04 3.544767e+07 4.317439e+07 4.938422e+07 5.994934e+04 3.583502e+07 3.771785e+07 4.255687e+07 2.873659e+07 3.555094e+07 6.748671e+07 2.521941e+07 5.988576e+07 3.499979e+07 2.538052e+07 3.605724e+07 1.927495e+07 2.919017e+07 8.580748e+07 4.022576e+07 4.317055e+07 3.819021e+07 3.071258e+07 6.482271e+07 7.074370e+07 3.275754e+07 3.940382e+07 4.077045e+07 2.891215e+07 3.595777e+07 5.105037e+07 4.030842e+07 4.196595e+07 3.482381e+07 3.369283e+07 3.437298e+07 6.073563e+07 4.201067e+07 7.413970e+07 3.687469e+07 6.297575e+07 5.105633e+07 4.083154e+07 5.331559e+07 2.556102e+07 3.983069e+07 2.942191e+07 3.982174e+07 1.891307e+07 2.029599e+07 5.166477e+07 3.792907e+07 3.442354e+07 3.605152e+07 5.299228e+07 4.979844e+07 3.121933e+07 4.627663e+07 2.956207e+07 3.582085e+07 3.055944e+07 2.413738e+07 4.130686e+07 3.397781e+07 4.866212e+07 3.577543e+07 3.157645e+07 2.906952e+07 2.489470e+07 3.545518e+07 3.403767e+07 4.010926e+07 3.657512e+07 3.758766e+07 2.734208e+07 3.702976e+07 3.493235e+07 2.415982e+07 3.750562e+07 5.126592e+07 3.108469e+07 2.283751e+07 1.095466e+07 2.545109e+07 3.136040e+07 6.203735e+07 4.226277e+07 3.338138e+07 4.678854e+07 4.460785e+07 2.782335e+07 7.046152e+07 5.187265e+07 4.129584e+07 3.907582e+07 2.499767e+07 5.807903e+07 3.859989e+07 5.076034e+07 2.311196e+07 4.313252e+07 5.507097e+07 4.511930e+07 3.520573e+07 2.560612e+07 2.692411e+07 3.835723e+07 4.223745e+07 3.277643e+07 2.263125e+07 4.387091e+07 2.840812e+07 3.188871e+07 3.185081e+07 2.634361e+07 3.233875e+07 5.198152e+07 3.907129e+07 3.546231e+07 3.982331e+07 8.566032e+07 4.728733e+07 1.643853e+07 6.690543e+07 3.581523e+07 4.867466e+07 2.568093e+07 5.953336e+07 3.310155e+07 4.479861e+07 6.247871e+07 6.384662e+07 3.495743e+07 3.687789e+07 2.136506e+07 5.925771e+07 7.825358e+07 3.386150e+07 5.153746e+07 4.426883e+07 1.759696e+07 4.320866e+07 2.963067e+07 3.956502e+07 3.571803e+07 3.159764e+07 3.590226e+07 4.023184e+07 3.342511e+07 3.086327e+07 6.926817e+07 3.948455e+07 4.133812e+07 7.746709e+07 1.887727e+07 3.643906e+07 3.729992e+07 4.692934e+07 4.594471e+07 2.972057e+07 2.730422e+07 3.081918e+07 4.174368e+07 2.549686e+07 3.601781e+07 4.401287e+07 2.543749e+07 2.601533e+07 1.748100e+07 2.191667e+07 4.687741e+07 3.495796e+07 4.327185e+07 5.577800e+07 4.575940e+07 3.802240e+07 2.133213e+07 2.640875e+07 5.401043e+07 1.786306e+07 4.086214e+07 3.581891e+07 2.473231e+07 2.561915e+07 3.501635e+07 2.983616e+07 3.328675e+07 3.128888e+07 5.780799e+07 4.120693e+07 3.975636e+07 3.709044e+07 4.207918e+07 4.469904e+07 5.192355e+07 5.246994e+07 3.620312e+07 3.528990e+07 3.557370e+07 3.949434e+07 4.756110e+07 3.291433e+07 2.694678e+07 3.560218e+07 3.628115e+07 2.706561e+07 3.329826e+07 4.422251e+07 3.728662e+07 6.147849e+07 3.338591e+07 6.600306e+07 4.624141e+07 8.518920e+07 3.790549e+07 4.718173e+07 3.998021e+07 5.620435e+07 3.919055e+07 3.603640e+07 2.548959e+07 6.116362e+07 "PC(14:1(9Z)/22:2(13Z,16Z))_4.45" 7.257269e+07 3.683367e+07 4.365482e+07 3.774692e+07 1.664290e+05 3.613437e+07 3.960597e+07 5.013454e+07 161476.17 3.624470e+07 3.765734e+07 4.074772e+07 174968.04 3.740038e+07 3.947973e+07 4.005144e+07 1.671768e+05 3.758136e+07 3.740187e+07 4.058776e+07 1.734894e+05 3.774023e+07 4.327045e+07 4.205389e+07 49688.403 3.600643e+07 4.492811e+07 3.910829e+07 7.952882e+04 3.473804e+07 3.795247e+07 4.306873e+07 107935.21 3.729689e+07 4.179261e+07 3.547886e+07 1.544133e+05 3.853509e+07 4.236507e+07 4.396185e+07 8.554901e+04 3.411809e+07 4.088237e+07 4.632648e+07 8.858184e+04 3.372568e+07 3.652124e+07 4.168467e+07 4.256989e+07 3.532960e+07 1.696909e+07 7.450952e+07 3.041398e+07 3.808853e+07 3.669036e+07 5.177993e+07 2.909989e+07 4.764456e+07 6.056391e+07 4.607791e+07 4.257122e+07 6.998007e+07 5.883905e+07 5.542753e+07 5.341672e+07 3.650720e+07 3.270083e+07 3.023063e+07 6.462929e+07 4.659321e+07 3.498408e+07 5.780621e+07 5.493565e+07 3.115405e+07 4.352752e+07 4.782866e+07 4.155530e+07 2.817048e+07 4.442327e+07 4.868720e+07 3.297301e+07 3.700133e+07 2.872565e+07 4.512546e+07 4.282420e+07 3.827905e+07 7.107124e+07 3.552462e+07 2.407509e+07 1.803531e+07 4.283715e+07 4.039563e+07 4.218519e+07 2.181523e+07 3.960586e+07 3.336740e+07 3.199522e+07 3.609878e+07 3.471561e+07 2.656179e+07 3.878338e+07 4.583983e+07 2.276754e+07 2.832319e+07 4.514020e+07 4.024260e+07 3.894095e+07 3.178668e+07 2.836932e+07 4.110754e+07 3.726071e+07 3.651148e+07 4.655636e+07 4.035993e+07 4.012115e+07 3.879558e+07 3.485166e+07 3.517468e+07 4.092693e+07 2.966155e+07 3.373813e+07 3.296738e+07 2.282484e+07 4.332690e+07 4.268049e+07 2.814658e+07 3.184017e+07 3.731956e+07 3.575240e+07 3.507250e+07 3.941648e+07 8.290685e+07 2.516028e+07 6.584596e+07 4.744508e+07 4.917858e+07 3.061925e+07 3.852847e+07 2.976158e+07 5.879443e+07 3.923141e+07 2.274663e+07 6.281446e+07 4.198201e+07 5.020691e+07 4.099392e+07 2.895391e+07 3.875098e+07 3.579917e+07 3.585806e+07 4.098508e+07 2.782794e+07 4.459580e+07 2.820837e+07 4.253754e+07 2.363092e+07 4.074891e+07 2.607348e+07 3.501179e+07 3.711787e+07 2.188043e+07 5.107996e+07 5.408397e+07 2.813995e+07 7.787048e+07 3.985310e+07 4.741806e+07 3.832949e+07 3.617217e+07 2.899488e+07 4.333230e+07 3.625887e+07 3.536579e+07 3.470686e+07 2.166440e+07 3.979000e+07 4.875873e+07 4.374819e+07 2.848956e+07 3.278766e+07 2.822271e+07 4.837089e+07 3.189212e+07 2.398151e+07 4.208182e+07 3.230347e+07 4.072623e+07 2.410849e+07 6.780625e+07 3.861076e+07 2.474474e+07 4.104363e+07 3.599650e+07 3.066142e+07 2.061107e+07 2.555873e+07 2.218606e+07 2.731413e+07 2.692419e+07 3.892501e+07 2.254039e+07 2.972154e+07 2.630678e+07 3.024199e+07 3.810184e+07 1.668288e+07 2.803226e+07 2.370474e+07 3.817454e+07 3.156264e+07 3.660433e+07 3.388687e+07 2.846369e+07 2.861135e+07 3.545795e+07 3.156293e+07 2.557468e+07 3.167964e+07 1.733084e+07 2.284029e+07 3.741912e+07 3.105866e+07 4.891202e+07 4.354932e+07 3.678785e+07 3.017973e+07 4.796222e+07 4.271908e+07 4.746885e+07 4.064666e+07 2.153120e+07 3.652651e+07 2.280671e+07 4.063000e+07 3.803249e+07 4.689690e+07 6.056401e+07 6.728520e+07 1.723367e+07 2.755377e+07 2.664770e+07 4.246140e+07 3.428635e+07 3.340616e+07 2.515892e+07 2.218973e+07 3.018636e+07 4.076997e+07 3.151113e+07 3.660449e+07 1.456088e+07 3.278438e+07 3.557447e+07 5.343847e+07 4.454434e+07 3.399762e+07 4.102435e+07 3.136016e+07 4.150084e+07 2.172201e+07 4.698117e+07 5.005258e+07 C45 H87 N9 O2 P2_4.45 2.994211e+06 1.912166e+06 2.283070e+06 1.751017e+06 1.155951e+05 2.082093e+06 2.500468e+06 2.005434e+06 116299.86 1.693560e+06 2.173201e+06 2.342349e+06 123032.34 1.901508e+06 2.293667e+06 1.818332e+06 1.213098e+05 2.003774e+06 1.728913e+06 2.232524e+06 1.277519e+05 2.061121e+06 2.069637e+06 2.254584e+06 37586.142 2.165078e+06 1.880296e+06 1.907978e+06 5.848320e+04 2.348734e+06 2.032167e+06 1.752969e+06 84824.44 2.272104e+06 1.992235e+06 2.021379e+06 1.132296e+05 1.883864e+06 2.013688e+06 2.198021e+06 5.718090e+04 1.688997e+06 3.183136e+06 1.948131e+06 5.628613e+04 1.561549e+06 1.520603e+06 2.487693e+06 2.098839e+06 2.916601e+06 1.620644e+06 1.823243e+06 1.371181e+06 1.429883e+06 2.141630e+06 2.077459e+06 1.571943e+06 1.634957e+06 2.103194e+06 1.577132e+06 2.985857e+06 2.294774e+06 2.353559e+06 4.033416e+06 3.350237e+06 1.159434e+06 1.326952e+06 2.653654e+06 1.778780e+06 2.369543e+06 2.291121e+06 2.441413e+06 2.979101e+06 1.858855e+06 1.866369e+06 2.764294e+06 1.211897e+06 2.724653e+06 3.161435e+06 2.293707e+06 2.470064e+06 2.132738e+06 1.629708e+06 1.867296e+06 1.184468e+06 1.827567e+06 1.347749e+06 1.063483e+06 1.458649e+06 1.486261e+06 2.389227e+06 9.595688e+05 1.814968e+06 1.877334e+06 2.114039e+06 1.234523e+06 1.629109e+06 1.936754e+06 2.109649e+06 4.275495e+06 3.164843e+06 1.369146e+06 2.008360e+06 1.299622e+06 2.277922e+06 3.010946e+06 1.835800e+06 1.572780e+06 1.605022e+06 2.400811e+06 1.369921e+06 1.543386e+06 1.486561e+06 2.031200e+06 1.494020e+06 1.583499e+06 1.697028e+06 1.457980e+06 1.792135e+06 4.118023e+06 9.779642e+05 7.448848e+05 5.638135e+05 1.603495e+06 1.625454e+06 3.170843e+06 2.303082e+06 9.436654e+05 2.322764e+06 1.595684e+06 1.323582e+06 3.240936e+06 1.302726e+06 1.984406e+06 2.316712e+06 1.218822e+06 1.482777e+06 1.951867e+06 1.674853e+06 1.751229e+06 1.317199e+06 1.490120e+06 2.972018e+06 2.085436e+06 1.680743e+06 2.057592e+06 1.127105e+06 1.660214e+06 1.427889e+06 1.226022e+06 1.598381e+06 1.289943e+06 1.528664e+06 1.426980e+06 1.869704e+06 2.266038e+06 3.153070e+06 2.223980e+06 9.160040e+05 2.165443e+06 2.498020e+06 2.635451e+06 1.881867e+06 1.147456e+06 1.956266e+06 1.555328e+06 2.792277e+06 1.690110e+06 2.558624e+06 2.661025e+06 1.333220e+06 1.273668e+06 2.924279e+06 1.614741e+06 1.803501e+06 1.360216e+06 1.939993e+06 2.189739e+06 2.582683e+06 1.229763e+06 1.011679e+06 2.787986e+06 1.258800e+06 2.581572e+06 8.176264e+05 4.174145e+06 2.981933e+06 1.254338e+06 3.569200e+06 2.932458e+06 2.669002e+06 1.337169e+06 1.605084e+06 1.957946e+06 8.112048e+05 1.117336e+06 1.604784e+06 1.948940e+06 1.316237e+06 2.706695e+06 1.068473e+06 1.818971e+06 1.436543e+06 1.533979e+06 1.529179e+06 1.495767e+06 2.477803e+06 2.552590e+06 1.342951e+06 7.335395e+05 3.000333e+06 2.097178e+06 2.329014e+06 1.731161e+06 1.673825e+06 1.364483e+06 1.960750e+06 1.150621e+06 1.725091e+06 1.654538e+06 1.070776e+06 1.060186e+06 2.128657e+06 1.662650e+06 1.560938e+06 1.479371e+06 2.523927e+06 1.301798e+06 1.587369e+06 3.103080e+06 1.073407e+06 2.204589e+06 1.726522e+06 2.292676e+06 1.675969e+06 2.104358e+06 2.576798e+06 2.746581e+06 2.381481e+06 3.426192e+06 2.023805e+06 1.790057e+06 2.254055e+06 1.192431e+06 1.397879e+06 1.846583e+06 1.139566e+06 1.829126e+06 2.377550e+06 2.026945e+06 2.481759e+06 1.322910e+06 2.012721e+06 3.290053e+06 2.994790e+06 1.228226e+06 2.501427e+06 1.915087e+06 3.430349e+06 1.792005e+06 3.676693e+06 2.685834e+06 C44 H78 N O7 P_4.453 1.425648e+06 8.459548e+05 8.644925e+05 7.996373e+05 1.029211e+05 6.655854e+05 1.015200e+06 7.408743e+05 96179.44 7.397036e+05 1.006690e+06 8.804905e+05 100596.83 7.434473e+05 8.335644e+05 7.936489e+05 9.838067e+04 7.989637e+05 7.027950e+05 8.901875e+05 1.020968e+05 7.902959e+05 9.936880e+05 8.397445e+05 29300.869 7.117688e+05 9.118027e+05 7.368338e+05 4.472073e+04 7.432602e+05 9.085743e+05 8.228988e+05 60871.16 9.787456e+05 7.518596e+05 8.016060e+05 8.519052e+04 6.358871e+05 8.465866e+05 8.428452e+05 5.515750e+04 9.896385e+05 7.755901e+05 1.071081e+06 5.105832e+04 5.801626e+05 7.186760e+05 9.138861e+05 9.552113e+05 3.199948e+05 5.622758e+05 1.341847e+06 5.858631e+05 6.296237e+05 9.852254e+05 1.577455e+06 2.681203e+05 7.381949e+05 1.262481e+06 7.084764e+05 6.410620e+05 1.308339e+06 1.324104e+06 5.583059e+05 1.049075e+06 6.806983e+05 5.851228e+05 3.757993e+05 1.229721e+06 6.247134e+05 4.592648e+05 9.977806e+05 7.162615e+05 6.557822e+05 8.970899e+05 9.222186e+05 1.744491e+06 2.572174e+05 9.292976e+05 7.279220e+05 7.753451e+05 6.120718e+05 5.248882e+05 1.186140e+06 6.274057e+05 6.180873e+05 3.130854e+06 6.180112e+05 1.013604e+06 1.930975e+05 8.541893e+05 9.925094e+05 8.199438e+05 2.723474e+05 7.614131e+05 6.946049e+05 2.100898e+05 3.971059e+05 6.962141e+05 2.199499e+05 1.106359e+06 8.505395e+05 3.419896e+05 3.082830e+05 6.175069e+05 5.181492e+05 6.474139e+05 5.452604e+05 5.757819e+05 7.068626e+05 5.082051e+05 9.381423e+05 1.672930e+06 6.114925e+05 6.525537e+05 8.791728e+05 6.063937e+05 7.849181e+05 1.032306e+06 3.279079e+05 8.395741e+05 6.200516e+05 1.040721e+05 1.190817e+06 6.513314e+05 1.298128e+06 2.903892e+05 6.322757e+05 8.649393e+05 9.114511e+05 5.030058e+05 2.404600e+06 5.086830e+05 2.208529e+06 1.087555e+06 9.175183e+05 6.564943e+05 1.069614e+06 7.174196e+05 1.657404e+06 1.086803e+06 3.820501e+05 1.101759e+06 7.747299e+05 1.772696e+06 7.724326e+05 4.857886e+05 9.484038e+05 6.104382e+05 7.520356e+05 6.526766e+05 2.083492e+05 8.883398e+05 6.991374e+05 1.110107e+06 1.262534e+05 6.808923e+05 1.483540e+05 6.463483e+05 6.522175e+05 7.159878e+05 7.058046e+05 8.171406e+05 8.191257e+05 1.417442e+06 4.872992e+05 7.232269e+05 2.083500e+06 5.808367e+05 3.578761e+05 1.307565e+06 7.356238e+05 5.204011e+05 4.058233e+05 2.069528e+05 1.004548e+06 6.621164e+05 9.245383e+05 6.481175e+05 8.030863e+05 4.466263e+05 2.056816e+06 7.399291e+05 6.565407e+05 1.288343e+06 3.975547e+05 2.930129e+05 5.099276e+05 1.017031e+06 8.002512e+05 8.160606e+05 1.377701e+06 5.798578e+05 7.257090e+05 6.085060e+05 5.870136e+05 5.156235e+05 8.415948e+05 6.489189e+05 1.254601e+06 5.635996e+05 7.686103e+05 1.072569e+06 8.235305e+05 1.352657e+06 3.917630e+05 4.514709e+05 1.976167e+05 9.827064e+05 8.355462e+05 7.465979e+05 4.125045e+05 7.877243e+05 1.213695e+06 7.560723e+05 1.022276e+06 5.411259e+05 7.493068e+05 6.058945e+05 8.142435e+05 8.361593e+05 4.696212e+05 7.131760e+05 1.326630e+06 1.128415e+06 5.532113e+05 6.086064e+05 9.356962e+05 6.789250e+05 7.914549e+05 6.796365e+05 5.093920e+05 2.295687e+05 1.107385e+06 4.615557e+05 6.226927e+05 1.671598e+06 1.719210e+06 2.119706e+05 5.430441e+05 8.292877e+05 1.416527e+06 5.660843e+05 8.648958e+05 3.784547e+05 2.883330e+05 9.219186e+05 7.491918e+05 7.475643e+05 1.133669e+06 1.301484e+05 4.400221e+05 6.426938e+05 1.159326e+06 6.893086e+05 6.548121e+05 6.223455e+05 4.207252e+05 1.105913e+06 2.988643e+05 7.888118e+05 7.258691e+05 "3-(Hexadecyloxy)-2-[(5E,8E,11E,14E,17E)-5,8,11,14,17-icosapentaenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate_4.453" 4.757059e+07 3.800007e+07 3.798724e+07 3.902256e+07 1.143875e+05 3.688772e+07 4.085172e+07 3.991302e+07 111127.84 3.787750e+07 3.862986e+07 4.011222e+07 115332.15 3.740965e+07 3.883944e+07 3.909344e+07 1.073014e+05 3.665071e+07 3.647255e+07 3.932057e+07 1.119593e+05 3.704476e+07 4.293426e+07 4.165115e+07 32977.650 3.636957e+07 3.801126e+07 3.954868e+07 5.273084e+04 3.496529e+07 3.764739e+07 4.231282e+07 72150.41 3.654724e+07 4.063453e+07 3.456417e+07 9.553324e+04 3.754701e+07 4.128955e+07 4.286562e+07 5.487191e+04 3.326058e+07 3.987893e+07 4.520541e+07 5.706842e+04 3.289940e+07 3.563520e+07 4.067410e+07 4.154261e+07 3.505622e+07 1.653021e+07 7.226444e+07 2.972724e+07 3.715882e+07 3.586358e+07 5.053773e+07 2.868892e+07 4.659680e+07 5.905468e+07 4.560457e+07 4.194637e+07 6.831113e+07 5.774885e+07 5.403143e+07 5.208448e+07 3.562261e+07 3.193509e+07 2.950923e+07 6.309238e+07 4.739970e+07 3.565505e+07 5.660917e+07 5.362196e+07 3.083701e+07 4.363932e+07 4.866015e+07 4.056326e+07 2.770431e+07 4.354932e+07 4.746749e+07 3.436197e+07 3.605322e+07 2.797819e+07 4.360036e+07 2.958593e+07 3.734074e+07 6.938462e+07 3.510315e+07 2.374950e+07 1.764565e+07 4.224841e+07 4.161487e+07 4.293332e+07 2.248316e+07 3.863577e+07 3.250605e+07 3.118524e+07 3.519978e+07 3.382786e+07 2.620100e+07 3.798443e+07 4.598223e+07 2.305078e+07 2.763254e+07 4.401801e+07 3.988566e+07 3.810782e+07 3.190964e+07 2.887718e+07 4.065452e+07 3.688665e+07 3.600489e+07 4.744600e+07 3.936281e+07 4.058285e+07 4.045887e+07 3.465157e+07 3.428021e+07 3.889506e+07 2.890191e+07 3.290091e+07 3.215165e+07 2.224928e+07 4.340745e+07 4.163977e+07 2.741311e+07 3.283302e+07 3.641055e+07 3.602292e+07 3.540221e+07 4.014557e+07 8.086580e+07 2.453418e+07 6.558848e+07 4.716499e+07 4.798423e+07 2.986094e+07 3.911820e+07 3.022954e+07 5.862073e+07 3.826492e+07 2.259910e+07 6.196309e+07 4.274821e+07 5.209172e+07 4.050184e+07 2.822710e+07 3.825082e+07 3.627245e+07 3.495138e+07 4.086468e+07 2.772115e+07 4.407838e+07 2.755830e+07 4.189176e+07 2.476471e+07 3.977420e+07 2.731872e+07 3.492664e+07 3.694205e+07 2.115675e+07 4.983729e+07 5.299317e+07 2.744205e+07 7.595745e+07 3.924902e+07 4.621446e+07 3.738898e+07 3.527046e+07 2.823576e+07 4.397201e+07 3.476597e+07 3.446255e+07 3.520301e+07 2.112220e+07 4.065607e+07 4.797997e+07 4.264685e+07 2.774743e+07 3.193911e+07 2.749839e+07 4.720850e+07 3.107092e+07 2.490492e+07 4.162981e+07 3.154105e+07 4.267931e+07 2.350717e+07 6.253521e+07 3.765935e+07 2.467164e+07 4.227411e+07 3.510612e+07 2.986021e+07 1.993626e+07 2.574104e+07 2.162496e+07 2.531251e+07 2.691677e+07 3.769202e+07 2.243925e+07 2.928102e+07 2.561287e+07 3.009694e+07 3.962537e+07 1.591493e+07 2.851408e+07 2.465148e+07 3.791914e+07 3.275385e+07 3.568856e+07 3.400409e+07 2.880177e+07 2.842965e+07 3.458988e+07 3.031365e+07 2.493464e+07 3.089018e+07 1.625607e+07 2.203280e+07 3.882261e+07 3.122091e+07 4.972312e+07 4.249082e+07 3.646206e+07 3.075859e+07 3.707400e+07 4.167961e+07 2.990181e+07 4.242312e+07 2.140657e+07 3.562937e+07 2.228198e+07 3.923965e+07 3.861937e+07 4.570676e+07 6.062527e+07 6.578686e+07 1.803548e+07 2.841995e+07 2.614000e+07 4.411877e+07 3.486462e+07 3.493724e+07 2.490923e+07 2.162951e+07 3.061189e+07 4.008284e+07 3.071158e+07 3.596939e+07 1.396999e+07 3.254641e+07 3.684385e+07 5.497752e+07 4.653988e+07 3.276780e+07 3.761640e+07 3.054712e+07 3.954057e+07 2.113594e+07 4.670335e+07 4.801668e+07 SM 40:4;O4 (184 m/z) (1)_4.454 3.804911e+05 1.878480e+06 1.646383e+06 8.123699e+05 8.881587e+04 5.692064e+05 1.959752e+06 1.394625e+06 77603.56 1.520142e+06 1.130010e+06 1.053896e+06 70250.78 1.129024e+06 1.522566e+06 1.442632e+06 5.584273e+04 1.418177e+06 1.264965e+06 1.303093e+06 5.892396e+04 1.911953e+06 1.151196e+06 5.953880e+05 19415.167 1.673812e+06 1.632062e+06 1.175257e+06 2.954059e+04 1.143617e+06 1.546245e+06 1.607223e+06 32522.93 1.121100e+06 1.423668e+06 1.596862e+06 3.912570e+04 6.450484e+05 1.816534e+06 1.390911e+06 2.627182e+04 1.177121e+06 1.401102e+06 1.232262e+06 2.865556e+04 1.496260e+06 1.377167e+06 1.263447e+06 1.119072e+06 2.003995e+06 5.796796e+05 1.243183e+06 1.390856e+06 7.545000e+05 6.447409e+05 1.516643e+06 1.280075e+06 9.388504e+05 2.169191e+06 1.553289e+06 1.031841e+06 1.188735e+06 2.573356e+06 2.442747e+06 1.387952e+06 1.427273e+06 1.289315e+06 1.298977e+06 1.405316e+06 2.976808e+06 6.428640e+05 2.387136e+06 1.824249e+06 1.214439e+06 1.649293e+06 1.990356e+06 2.508250e+06 9.469363e+05 3.569133e+06 1.962642e+06 2.496348e+06 2.076203e+06 2.119335e+05 1.172671e+06 8.772558e+05 1.514922e+06 5.386042e+05 1.865912e+06 1.320400e+06 6.478245e+05 7.214889e+05 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1.101773e+06 5.006686e+05 2.656755e+06 1.927870e+06 1.829291e+06 4.250183e+05 2.488246e+06 1.905999e+06 5.199701e+05 7.441114e+05 1.083633e+06 2.831929e+06 7.658601e+05 1.176658e+06 1.128036e+06 1.270948e+06 2.469603e+06 C16 H41 N9 O2 P2_4.455 6.448595e+06 3.817214e+06 4.004277e+06 3.875571e+06 1.513344e+05 3.449132e+06 3.557475e+06 3.988622e+06 145107.87 3.656449e+06 3.584520e+06 4.793681e+06 144350.44 3.455589e+06 3.525366e+06 4.028912e+06 1.351747e+05 3.456061e+06 3.874811e+06 3.620843e+06 1.412385e+05 3.322398e+06 3.976653e+06 4.652131e+06 38356.892 3.421948e+06 3.587493e+06 3.761468e+06 5.686049e+04 3.806167e+06 3.728772e+06 3.491844e+06 76425.07 4.104086e+06 4.059253e+06 3.528634e+06 1.038031e+05 3.321754e+06 4.360045e+06 4.043880e+06 6.180094e+04 3.190257e+06 4.117506e+06 4.668441e+06 6.504963e+04 2.757809e+06 3.194038e+06 4.337629e+06 1.588385e+06 2.859380e+06 2.054507e+06 4.302800e+06 4.472586e+06 3.336001e+06 4.640652e+06 4.641720e+06 7.688734e+06 7.682861e+06 7.114342e+06 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1.668302e+07 1.969128e+07 2.039739e+07 1.406682e+07 C43 H74 N7 O7 P S_4.456 5.861680e+07 4.821683e+07 5.508406e+07 5.707194e+07 1.429415e+05 5.028050e+07 5.474484e+07 4.820024e+07 138445.95 5.520307e+07 4.954261e+07 5.401330e+07 136472.25 5.615554e+07 5.534217e+07 5.391100e+07 1.262279e+05 5.001910e+07 5.109954e+07 5.235329e+07 1.383416e+05 5.084749e+07 5.505112e+07 5.698966e+07 40868.391 5.126367e+07 5.081709e+07 5.571227e+07 6.208158e+04 4.876913e+07 5.106608e+07 4.907120e+07 81530.02 5.879420e+07 5.261912e+07 4.947421e+07 1.158227e+05 5.476062e+07 5.667755e+07 5.605981e+07 7.098133e+04 4.876647e+07 5.499056e+07 5.670295e+07 8.383223e+04 4.087958e+07 5.325071e+07 5.640754e+07 5.437037e+07 5.427788e+07 3.953036e+07 4.232500e+07 4.100575e+07 5.455530e+07 2.987334e+07 4.384544e+07 5.144307e+07 4.784664e+07 5.047615e+07 5.800054e+07 5.402495e+07 5.008964e+07 5.001960e+07 4.272684e+07 5.197003e+07 5.290542e+07 5.277738e+07 5.712375e+07 4.925766e+07 6.284101e+07 4.549393e+07 5.279989e+07 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1.342337e+07 2.141010e+07 1.547439e+07 16324.353 1.396550e+07 1.630249e+07 1.593919e+07 2.448503e+04 1.882561e+07 1.416805e+07 1.598429e+07 33058.08 1.777336e+07 1.615728e+07 1.590873e+07 4.076837e+04 1.396496e+07 1.724642e+07 1.948964e+07 2.635145e+04 1.379083e+07 1.861298e+07 1.707835e+07 2.741894e+04 1.465058e+07 1.323986e+07 1.855652e+07 1.179486e+07 1.583695e+07 7.668759e+06 1.793214e+07 2.244002e+07 1.730200e+07 1.620990e+07 1.820285e+07 1.387697e+07 1.796392e+07 3.017988e+07 1.838831e+07 1.779791e+07 1.493560e+07 2.102202e+07 2.563158e+07 1.592270e+07 1.435744e+07 1.502384e+07 1.571186e+07 1.641407e+07 2.101488e+07 1.439643e+07 2.135463e+07 2.205172e+07 1.059141e+07 1.961485e+07 1.952333e+07 2.152399e+07 1.078597e+07 2.984917e+07 1.885815e+07 2.870358e+07 2.232751e+07 6.465099e+06 2.447500e+07 1.090207e+07 1.403026e+07 1.022965e+07 1.511378e+07 1.251935e+07 8.288726e+06 1.858670e+07 1.373550e+07 1.472411e+07 1.523019e+07 1.654646e+07 1.447452e+07 1.362997e+07 1.237932e+07 1.209095e+07 1.485632e+07 1.586969e+07 1.432277e+07 9.539496e+06 1.255733e+07 2.224702e+07 2.488599e+07 1.833340e+07 1.201344e+07 1.220268e+07 1.561566e+07 1.571806e+07 1.471630e+07 2.078017e+07 1.223797e+07 1.335618e+07 1.859349e+07 1.280756e+07 9.274539e+06 1.175445e+07 1.301456e+07 1.108444e+07 1.153559e+07 9.179503e+06 1.701204e+07 1.051323e+07 9.818274e+06 1.372730e+07 1.479992e+07 1.541848e+07 1.682905e+07 2.004279e+07 2.276896e+07 1.378042e+07 1.573690e+07 1.733872e+07 1.626398e+07 1.725456e+07 1.352073e+07 1.492524e+07 1.103827e+07 1.383163e+07 1.947904e+07 2.531248e+07 1.315166e+07 2.275623e+07 1.454572e+07 1.157279e+07 1.447765e+07 1.892287e+07 1.018140e+07 1.632042e+07 1.453097e+07 1.428830e+07 1.231734e+07 1.276240e+07 1.485706e+07 1.673162e+07 1.720897e+07 1.696353e+07 1.666703e+07 1.011328e+07 2.350880e+07 1.167399e+07 1.591262e+07 2.435645e+07 2.052315e+07 1.173086e+07 1.678551e+07 1.830601e+07 7.561979e+06 1.891374e+07 1.380799e+07 1.293571e+07 1.723893e+07 1.122583e+07 2.000307e+07 2.904893e+07 1.372241e+07 1.739836e+07 1.640745e+07 9.546470e+06 1.325965e+07 1.333527e+07 1.409643e+07 1.364765e+07 9.131750e+06 1.868368e+07 8.027342e+06 1.713486e+07 1.299210e+07 1.428048e+07 1.680572e+07 1.841503e+07 1.450512e+07 5.249810e+06 1.708621e+07 1.126036e+07 1.567801e+07 1.561842e+07 1.635964e+07 1.262824e+07 1.401064e+07 1.206975e+07 1.041140e+07 1.751318e+07 1.121681e+07 1.235389e+07 1.413997e+07 1.008593e+07 1.086257e+07 1.697558e+07 1.816272e+07 1.752377e+07 1.484845e+07 1.727622e+07 1.171042e+07 1.294708e+07 1.562460e+07 1.111330e+07 7.144257e+06 1.593216e+07 1.863885e+07 1.331592e+07 1.740714e+07 1.196923e+07 1.372677e+07 1.153833e+07 1.312933e+07 1.555595e+07 1.892503e+07 1.675086e+07 1.505562e+07 1.367791e+07 1.365758e+07 1.762191e+07 1.647423e+07 1.498838e+07 2.042111e+07 2.988509e+07 1.888459e+07 1.098497e+07 1.778930e+07 1.768363e+07 1.506558e+07 1.070141e+07 1.128112e+07 1.238951e+07 2.436992e+07 1.983314e+07 1.836639e+07 1.012777e+07 2.365789e+07 2.153223e+07 2.150042e+07 2.323292e+07 1.416458e+07 1.876859e+07 1.359901e+07 1.450897e+07 1.276260e+07 1.346836e+07 2.202110e+07 SHexCer 37:2;O3 (184 m/z)_4.461 2.101491e+06 1.716141e+06 1.598720e+06 2.011673e+06 6.768583e+04 1.459389e+06 2.280570e+06 1.756253e+06 63618.68 1.826779e+06 1.732838e+06 1.890297e+06 68567.07 1.474333e+06 1.768997e+06 1.784312e+06 6.432263e+04 1.868251e+06 1.681494e+06 1.549769e+06 6.433052e+04 1.909514e+06 2.265280e+06 1.584994e+06 18150.082 1.726085e+06 1.840129e+06 1.615634e+06 2.724665e+04 1.843725e+06 1.633252e+06 1.811973e+06 39258.02 2.033338e+06 1.688901e+06 1.575067e+06 4.501163e+04 1.637302e+06 2.244604e+06 2.118182e+06 3.301131e+04 1.280867e+06 1.881754e+06 2.087345e+06 3.932836e+04 1.196891e+06 2.058731e+06 1.706500e+06 1.910041e+06 1.858388e+06 1.732370e+06 1.106065e+06 2.055072e+06 1.752213e+06 1.961229e+06 1.834405e+06 1.408136e+06 1.133478e+06 2.174003e+06 2.632987e+06 2.110248e+06 1.702261e+06 1.908083e+06 1.649705e+06 1.766339e+06 2.099112e+06 1.444372e+06 2.346535e+06 1.819017e+06 1.732523e+06 1.839611e+06 1.595167e+06 2.670261e+06 1.553753e+06 2.066614e+06 1.914219e+06 2.186430e+06 1.618741e+06 1.835254e+06 1.974676e+06 2.266925e+06 1.968599e+06 1.648077e+06 2.272658e+06 1.605178e+06 1.919180e+06 1.446986e+06 1.924504e+06 1.527389e+06 1.566956e+06 1.329890e+06 2.029293e+06 1.586451e+06 2.179240e+06 1.930406e+06 1.952427e+06 1.913888e+06 1.952330e+06 1.761480e+06 1.419208e+06 1.442980e+06 1.556597e+06 1.506057e+06 1.908270e+06 1.888547e+06 1.835030e+06 2.096989e+06 1.182317e+06 1.262076e+06 1.396382e+06 1.711639e+06 2.256836e+06 2.186055e+06 1.671606e+06 2.023057e+06 1.982085e+06 1.368594e+06 1.062149e+06 1.674443e+06 1.539468e+06 1.780373e+06 1.707538e+06 1.568296e+06 1.618825e+06 1.370721e+06 2.017629e+06 1.757745e+06 2.108366e+06 1.384552e+06 2.023816e+06 2.332888e+06 1.543660e+06 1.456698e+06 1.603547e+06 1.515665e+06 1.844532e+06 2.244505e+06 1.426396e+06 1.687163e+06 1.665350e+06 1.667612e+06 2.268843e+06 2.244181e+06 2.088428e+06 1.923576e+06 1.846521e+06 1.375223e+06 2.260224e+06 2.241351e+06 1.272620e+06 1.766362e+06 1.765061e+06 1.803542e+06 1.761166e+06 1.708887e+06 1.742716e+06 1.853408e+06 1.943015e+06 1.943233e+06 1.866161e+06 1.711651e+06 1.973591e+06 1.281852e+06 3.196961e+06 1.943353e+06 1.828454e+06 1.006763e+06 2.134820e+06 1.953678e+06 1.782356e+06 1.573899e+06 1.868623e+06 2.139072e+06 1.822312e+06 1.646774e+06 1.972710e+06 1.916046e+06 1.610230e+06 2.120288e+06 1.702422e+06 1.493597e+06 1.617315e+06 2.067388e+06 1.937920e+06 1.681364e+06 1.239706e+06 1.195489e+06 2.036672e+06 1.573391e+06 1.810662e+06 1.701676e+06 1.849345e+06 1.894227e+06 1.797546e+06 1.575854e+06 2.183169e+06 2.309674e+06 2.171328e+06 2.037747e+06 2.023268e+06 1.925364e+06 1.656815e+06 2.302015e+06 2.153264e+06 1.959782e+06 1.561131e+06 1.315736e+06 1.700007e+06 1.176993e+06 1.385118e+06 1.680575e+06 2.120513e+06 2.035578e+06 1.808262e+06 1.912856e+06 1.704021e+06 1.831450e+06 1.746838e+06 1.868876e+06 1.088551e+06 2.330299e+06 2.047985e+06 2.105324e+06 1.618740e+06 1.732709e+06 2.058104e+06 1.590899e+06 1.753796e+06 1.974131e+06 1.959814e+06 2.420033e+06 1.933188e+06 1.879044e+06 1.599555e+06 1.732101e+06 1.690587e+06 1.898341e+06 1.703124e+06 1.996897e+06 2.157726e+06 2.385249e+06 1.970744e+06 2.028580e+06 1.999374e+06 2.516778e+06 1.751578e+06 1.891974e+06 2.266173e+06 1.767353e+06 1.710903e+06 1.973302e+06 2.103117e+06 1.843469e+06 1.558276e+06 1.731068e+06 1.465340e+06 1.858684e+06 1.547541e+06 1.732618e+06 2.336710e+06 1.414547e+06 1.184854e+06 "1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3- phosphocholine_4.463" 3.309678e+07 2.649499e+07 2.727891e+07 2.539017e+07 2.746444e+05 2.213858e+07 2.682462e+07 3.379360e+07 280508.50 1.847652e+07 2.591344e+07 2.708544e+07 295606.35 2.387851e+07 2.603568e+07 2.573036e+07 2.712916e+05 2.590061e+07 2.559951e+07 2.473035e+07 2.828917e+05 2.464016e+07 2.782356e+07 2.413634e+07 80453.540 2.770631e+07 2.777661e+07 2.617363e+07 1.276342e+05 2.420093e+07 2.383218e+07 2.625455e+07 179198.53 2.378341e+07 2.658556e+07 2.590894e+07 2.327179e+05 2.607269e+07 2.636943e+07 2.919988e+07 1.385227e+05 2.241804e+07 2.481409e+07 3.067231e+07 1.471772e+05 2.195302e+07 2.303796e+07 2.799267e+07 2.592402e+07 2.416825e+07 2.035220e+07 2.302008e+07 3.183884e+07 2.614189e+07 2.371587e+07 3.301926e+07 2.131184e+07 2.977899e+07 3.776152e+07 3.177868e+07 3.405522e+07 3.027008e+07 3.191629e+07 2.362046e+07 3.654620e+07 2.589231e+07 2.262659e+07 2.786743e+07 2.010669e+07 2.700548e+07 3.701264e+07 3.069663e+07 2.972749e+07 2.008638e+07 2.872001e+07 3.263680e+07 2.339124e+07 2.321005e+07 3.718898e+07 2.327208e+07 4.289482e+07 2.843810e+07 2.231238e+07 4.379536e+07 1.649458e+07 2.085861e+07 1.661549e+07 2.520854e+07 2.647600e+07 1.161805e+07 3.284910e+07 2.269025e+07 1.956372e+07 2.269626e+07 2.988989e+07 2.390595e+07 2.267393e+07 3.292434e+07 2.126507e+07 2.064450e+07 2.367004e+07 1.848673e+07 1.779303e+07 1.527980e+07 2.109871e+07 2.401841e+07 2.742471e+07 1.146066e+07 2.087377e+07 2.516829e+07 2.212325e+07 2.837497e+07 2.056871e+07 2.546139e+07 2.389127e+07 3.051334e+07 2.652240e+07 1.143834e+07 2.404639e+07 2.324576e+07 1.855540e+07 1.479676e+07 1.296392e+07 2.187150e+07 2.112425e+07 3.282804e+07 2.818268e+07 1.794450e+07 2.111406e+07 2.024341e+07 2.359823e+07 2.976072e+07 1.830371e+07 2.113608e+07 1.808903e+07 2.289798e+07 2.622298e+07 2.251983e+07 2.385943e+07 1.702314e+07 2.531027e+07 2.614922e+07 2.599067e+07 1.877038e+07 2.169093e+07 2.310530e+07 1.990493e+07 3.150951e+07 2.650725e+07 1.634036e+07 2.146693e+07 2.183079e+07 2.103320e+07 2.282041e+07 2.045914e+07 2.872907e+07 2.546214e+07 2.328990e+07 2.019168e+07 2.236500e+07 2.608437e+07 2.802764e+07 1.448682e+07 3.782941e+07 2.294145e+07 2.296588e+07 2.190991e+07 3.013226e+07 2.216234e+07 2.051448e+07 3.645878e+07 3.843696e+07 2.201916e+07 2.179671e+07 1.495931e+07 3.166520e+07 6.444182e+07 2.227998e+07 3.000597e+07 2.850213e+07 1.681024e+07 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2.272644e+07 1.992072e+07 2.234969e+07 4.295706e+07 C42 H87 N5 O6 P2_4.464 9.522958e+06 6.079222e+06 5.338941e+06 7.323972e+06 1.576631e+05 4.440255e+06 6.599668e+06 4.074856e+06 175256.27 5.966532e+06 7.209035e+06 4.702502e+06 168895.44 7.108190e+06 6.011533e+06 4.779116e+06 1.572676e+05 5.685144e+06 6.275441e+06 6.755778e+06 1.575412e+05 4.211664e+06 6.554372e+06 6.337116e+06 43465.166 5.129741e+06 6.783315e+06 5.423908e+06 6.989598e+04 6.574437e+06 5.223853e+06 4.156425e+06 101991.00 5.987748e+06 6.391315e+06 5.943966e+06 1.266517e+05 6.940131e+06 3.797696e+06 6.471885e+06 7.239342e+04 6.661252e+06 6.444836e+06 6.412280e+06 8.056111e+04 5.053120e+06 3.392948e+06 7.579624e+06 7.231266e+06 4.009572e+06 6.565531e+06 4.853755e+06 4.063865e+06 4.952343e+06 4.977194e+06 9.045311e+06 4.741909e+06 8.342026e+06 8.962766e+06 4.742012e+06 7.933486e+06 9.744305e+06 1.147385e+07 7.080090e+06 6.184296e+06 6.109105e+06 3.843961e+06 6.655287e+06 5.689523e+06 7.353115e+06 8.556138e+06 6.566298e+06 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2.174824e+06 1.556052e+06 1.103561e+06 1.027041e+06 1.529761e+06 1.006733e+06 9.469772e+05 8.016627e+05 1.417772e+06 1.623001e+06 1.710806e+06 9.469316e+05 1.846399e+06 1.394975e+06 2.207400e+06 1.338459e+06 1.071506e+06 1.917100e+06 1.845889e+06 1.912027e+06 1.237790e+06 1.145593e+06 2.181598e+06 C48 H88 N O8 P_4.469 1.903711e+07 1.401792e+07 1.163407e+07 1.518423e+07 2.609936e+05 1.097300e+07 1.510340e+07 1.211912e+07 280113.62 1.267096e+07 1.408216e+07 1.060845e+07 273338.16 1.478224e+07 1.348919e+07 1.282075e+07 2.533426e+05 1.323382e+07 1.325762e+07 1.451119e+07 2.609472e+05 1.128992e+07 1.432018e+07 1.320324e+07 73940.991 1.215143e+07 1.378559e+07 1.353679e+07 1.170786e+05 1.393573e+07 1.175388e+07 1.268323e+07 164979.68 1.320304e+07 1.327219e+07 1.294065e+07 2.062777e+05 1.356416e+07 1.172580e+07 1.432931e+07 1.245359e+05 1.328715e+07 1.410687e+07 1.530334e+07 1.343036e+05 1.110358e+07 1.018065e+07 1.514580e+07 1.209135e+07 9.583311e+06 1.136488e+07 1.232252e+07 1.313299e+07 1.213136e+07 1.168142e+07 1.942388e+07 9.172995e+06 1.604159e+07 1.843755e+07 1.737394e+07 1.885519e+07 1.933332e+07 1.950056e+07 1.316515e+07 1.740615e+07 1.187609e+07 1.123647e+07 1.354148e+07 1.120866e+07 1.381568e+07 1.749396e+07 1.543147e+07 1.450469e+07 9.172617e+06 9.810846e+06 1.434280e+07 1.246110e+07 1.348867e+07 1.528374e+07 9.589647e+06 1.856443e+07 1.475577e+07 7.603916e+06 1.269464e+07 7.077957e+06 1.049812e+07 6.613813e+06 9.024215e+06 1.021432e+07 6.119969e+06 1.383650e+07 8.818171e+06 7.000688e+06 1.005002e+07 1.866133e+07 9.729233e+06 1.163014e+07 1.477329e+07 1.289954e+07 1.297924e+07 9.039801e+06 1.079032e+07 1.434999e+07 6.368248e+06 1.338281e+07 8.946630e+06 1.315569e+07 6.280496e+06 1.369138e+07 1.827508e+07 1.252907e+07 1.526901e+07 1.359274e+07 1.368706e+07 1.147278e+07 1.304369e+07 1.147232e+07 7.815581e+06 1.528722e+07 1.538138e+07 8.904974e+06 7.533777e+06 7.400258e+06 9.704422e+06 1.107759e+07 1.179150e+07 1.444897e+07 7.963752e+06 1.172204e+07 9.427038e+06 1.039674e+07 2.070750e+07 9.186251e+06 1.367913e+07 1.485021e+07 1.049689e+07 1.412973e+07 1.309648e+07 1.257936e+07 1.137764e+07 1.229970e+07 1.724845e+07 1.975483e+07 9.977220e+06 1.585516e+07 9.283740e+06 9.447375e+06 1.377686e+07 1.438509e+07 8.453952e+06 1.309016e+07 9.867998e+06 1.124088e+07 1.130631e+07 1.026993e+07 1.528687e+07 1.498909e+07 8.590245e+06 9.752054e+06 1.329904e+07 9.892267e+06 1.258596e+07 1.235110e+07 1.526903e+07 1.337538e+07 1.268093e+07 1.399495e+07 1.051716e+07 1.119447e+07 1.188016e+07 1.975367e+07 1.709372e+07 1.100418e+07 1.183560e+07 1.049653e+07 1.543839e+07 2.620410e+07 1.120850e+07 1.647203e+07 1.263054e+07 7.636097e+06 1.096858e+07 1.065415e+07 9.262793e+06 6.848590e+06 1.178901e+07 1.577359e+07 9.794543e+06 2.177603e+07 1.305646e+07 8.832457e+06 1.324643e+07 1.105996e+07 1.072825e+07 6.774529e+06 1.663302e+07 1.409521e+07 1.304201e+07 1.297815e+07 1.472874e+07 1.026562e+07 8.215183e+06 1.478430e+07 1.104562e+07 1.558084e+07 8.173220e+06 1.106123e+07 1.439680e+07 6.978534e+06 7.900024e+06 1.335236e+07 1.189770e+07 1.029899e+07 1.348096e+07 1.397877e+07 1.116555e+07 9.808431e+06 1.252757e+07 8.447236e+06 4.912948e+06 1.406996e+07 1.271678e+07 1.403971e+07 1.296535e+07 8.374961e+06 1.005008e+07 1.567532e+07 7.873513e+06 1.268026e+07 1.555538e+07 1.200014e+07 1.193489e+07 1.104747e+07 1.252606e+07 9.428631e+06 1.328378e+07 1.191553e+07 1.580750e+07 1.451596e+07 1.953115e+07 1.114578e+07 1.729667e+07 9.743317e+06 1.512815e+07 9.416199e+06 8.172162e+06 9.079023e+06 1.546797e+07 9.219876e+06 1.366582e+07 1.168657e+07 1.070162e+07 1.600750e+07 2.475155e+07 1.042948e+07 1.415012e+07 1.469972e+07 1.248434e+07 1.200161e+07 1.187780e+07 1.175851e+07 2.035758e+07 PC 38:4_4.471 3.766297e+08 2.746920e+08 2.803233e+08 2.678856e+08 3.801738e+05 2.354960e+08 2.831691e+08 2.695182e+08 353855.16 2.751953e+08 2.869922e+08 2.757024e+08 365941.35 2.452818e+08 2.783593e+08 2.740206e+08 3.572294e+05 2.603548e+08 2.581850e+08 2.853532e+08 3.911503e+05 2.556670e+08 3.542613e+08 1.630275e+08 120929.542 2.679595e+08 2.831018e+08 2.836159e+08 1.752166e+05 2.739592e+08 2.772465e+08 2.877911e+08 233936.27 2.583832e+08 2.487054e+08 2.774293e+08 2.963832e+05 2.556908e+08 2.760827e+08 2.917597e+08 1.824094e+05 2.463153e+08 2.678165e+08 3.278579e+08 1.895760e+05 2.351818e+08 2.426095e+08 2.837029e+08 2.378744e+08 2.349068e+08 1.999224e+08 2.695562e+08 3.049392e+08 2.294724e+08 2.723722e+08 2.935463e+08 2.181630e+08 2.828541e+08 4.076365e+08 2.869862e+08 3.108875e+08 3.058826e+08 3.295269e+08 3.932194e+08 3.009713e+08 2.744383e+08 2.506304e+08 2.880537e+08 2.617750e+08 3.208681e+08 2.701176e+08 3.271920e+08 3.150656e+08 2.014164e+08 2.920195e+08 2.928735e+08 3.496157e+08 2.504960e+08 4.505698e+08 3.147084e+08 3.690321e+08 3.305757e+08 1.688816e+08 3.261182e+08 1.951638e+08 2.383258e+08 2.216128e+08 2.330475e+08 2.573980e+08 1.505862e+08 2.968321e+08 2.315030e+08 2.512169e+08 2.363541e+08 2.750183e+08 2.444770e+08 2.746976e+08 2.556652e+08 2.215160e+08 2.238525e+08 2.777338e+08 2.491287e+08 2.794373e+08 2.076921e+08 3.359395e+08 3.152089e+08 2.743833e+08 1.047430e+08 2.291417e+08 2.632227e+08 2.573685e+08 3.535196e+08 3.519590e+08 2.344425e+08 2.191434e+08 2.884509e+08 2.705773e+08 1.754009e+08 2.598292e+08 2.543049e+08 1.991513e+08 2.046607e+08 1.385517e+08 2.651565e+08 1.885117e+08 1.875262e+08 2.319754e+08 2.318901e+08 2.472547e+08 2.389956e+08 3.222766e+08 3.566472e+08 2.363554e+08 2.879429e+08 2.401004e+08 2.537336e+08 2.474646e+08 2.220408e+08 2.429645e+08 2.314542e+08 2.073104e+08 3.900729e+08 3.450945e+08 2.703945e+08 3.488437e+08 2.587932e+08 1.796626e+08 3.075926e+08 2.596640e+08 1.546862e+08 2.424861e+08 2.363752e+08 2.407332e+08 2.058246e+08 1.343291e+08 2.711210e+08 2.821505e+08 2.472821e+08 2.864355e+08 1.155073e+08 2.336698e+08 3.609064e+08 2.316197e+08 1.456527e+08 1.747473e+08 2.992413e+08 2.230693e+08 3.035916e+08 2.771032e+08 1.859111e+08 3.026760e+08 3.343190e+08 2.412439e+08 3.002758e+08 1.938081e+08 2.946735e+08 4.601313e+08 2.310576e+08 2.989429e+08 2.820860e+08 1.634611e+08 2.489507e+08 2.197923e+08 2.471940e+08 2.213665e+08 1.702270e+08 2.771979e+08 1.771719e+08 3.015316e+08 2.082657e+08 2.567147e+08 2.542019e+08 2.937061e+08 2.490705e+08 1.359569e+08 2.109515e+08 2.721223e+08 2.893383e+08 2.556549e+08 2.795097e+08 2.172342e+08 2.463840e+08 2.778496e+08 1.919531e+08 3.287756e+08 2.026707e+08 2.273409e+08 1.958856e+08 1.804502e+08 2.255805e+08 3.256072e+08 2.903508e+08 2.837948e+08 2.942764e+08 2.682083e+08 2.435003e+08 2.213788e+08 2.649273e+08 1.806852e+08 1.559956e+08 2.449886e+08 2.423443e+08 2.326262e+08 2.609507e+08 2.345393e+08 2.397472e+08 2.189599e+08 2.426945e+08 3.194370e+08 2.697647e+08 3.586100e+08 2.292215e+08 2.260752e+08 2.686335e+08 2.894854e+08 2.614859e+08 2.866765e+08 2.937655e+08 2.216063e+08 3.367708e+08 3.011944e+08 2.861835e+08 2.864579e+08 2.821915e+08 2.405521e+08 2.003058e+08 2.497961e+08 4.061334e+08 2.855389e+08 2.892592e+08 1.900392e+08 3.242618e+08 2.867929e+08 3.931208e+08 3.031756e+08 2.860810e+08 3.015527e+08 2.459752e+08 3.257397e+08 2.681043e+08 2.217394e+08 3.996536e+08 429.74048_4.471 2.199933e+07 1.789964e+07 1.849565e+07 2.133878e+07 1.451320e+05 1.779825e+07 2.101692e+07 1.899607e+07 139964.76 1.898072e+07 1.633639e+07 2.045004e+07 132840.16 2.084291e+07 1.910665e+07 1.975731e+07 1.280890e+05 1.853491e+07 1.823489e+07 1.862880e+07 1.370664e+05 1.803520e+07 2.051907e+07 2.083333e+07 38342.134 1.845698e+07 1.904997e+07 1.982182e+07 6.034323e+04 1.871893e+07 1.622264e+07 2.093768e+07 81088.84 1.993481e+07 1.799242e+07 1.911199e+07 9.748062e+04 1.790268e+07 2.124633e+07 1.921102e+07 7.163284e+04 1.897240e+07 1.924509e+07 2.086524e+07 7.746556e+04 1.728195e+07 1.865226e+07 1.932105e+07 1.676190e+07 2.018635e+07 3.391466e+07 1.105225e+07 1.970675e+07 1.850417e+07 1.566376e+07 1.330969e+07 1.614073e+07 1.417224e+07 1.878835e+07 1.150791e+07 1.631769e+07 1.709371e+07 1.499507e+07 1.487244e+07 1.947838e+07 1.378757e+07 2.033919e+07 2.135145e+07 1.943114e+07 1.601205e+07 8.757041e+06 1.545195e+07 1.766468e+07 2.596890e+07 1.536109e+07 1.713634e+07 2.469456e+07 1.890763e+07 1.578533e+07 1.477633e+07 2.073979e+07 2.003979e+07 3.051916e+07 1.514080e+07 2.233295e+07 2.029051e+07 2.002323e+07 2.308971e+07 2.388296e+07 2.573624e+07 1.758675e+07 2.102442e+07 2.368506e+07 2.041371e+07 1.330034e+07 1.967097e+07 1.484703e+07 2.113104e+07 1.994250e+07 1.926329e+07 1.633047e+07 1.589447e+07 1.790691e+07 2.583010e+07 1.983454e+07 1.667850e+07 1.322266e+07 1.664507e+07 1.384531e+07 2.068687e+07 1.987003e+07 1.881673e+07 1.394535e+07 1.611518e+07 1.884305e+07 6.457455e+06 2.057083e+07 2.292916e+07 2.017740e+07 1.954102e+07 1.962463e+07 2.362125e+07 1.543750e+07 1.334093e+07 1.561614e+07 2.353286e+07 2.663835e+07 2.159863e+07 2.451221e+07 2.359647e+07 1.804780e+07 2.116097e+07 2.507952e+07 1.612310e+07 2.278651e+07 1.571064e+07 2.445789e+07 1.928434e+07 2.689217e+07 1.350615e+07 1.476385e+07 1.649748e+07 1.465800e+07 2.231300e+07 1.509613e+07 1.153509e+07 2.034970e+07 1.843172e+07 1.754286e+07 1.656762e+07 2.519104e+07 1.354011e+07 1.941938e+07 1.857577e+07 1.891362e+07 2.314529e+07 2.037421e+07 2.457899e+07 1.894408e+07 2.110125e+07 3.761126e+07 1.618414e+07 1.470293e+07 1.969407e+07 1.685128e+07 2.157312e+07 1.878363e+07 2.460492e+07 1.516474e+07 2.990933e+07 1.773253e+07 2.247741e+07 1.926298e+07 1.784131e+07 1.581034e+07 2.024268e+07 2.131937e+07 2.018439e+07 1.765788e+07 1.943363e+07 1.298103e+07 2.059181e+07 1.887648e+07 1.967179e+07 2.185544e+07 2.936246e+07 2.077136e+07 2.498972e+07 1.465162e+07 1.872086e+07 2.955075e+07 1.735579e+07 2.274856e+07 2.288693e+07 1.268731e+07 1.834219e+07 1.597648e+07 1.970366e+07 2.248385e+07 1.662637e+07 1.929245e+07 1.910576e+07 1.812757e+07 1.970963e+07 1.532159e+07 3.144950e+07 1.832157e+07 2.357857e+07 1.899389e+07 1.043472e+07 1.431569e+07 1.971154e+07 1.977245e+07 1.654443e+07 1.528062e+07 2.114750e+07 1.548575e+07 1.390727e+07 3.051239e+07 1.662036e+07 2.569690e+07 2.126298e+07 1.938448e+07 1.219378e+07 2.250243e+07 2.095491e+07 1.827760e+07 1.528242e+07 1.874977e+07 2.359860e+07 2.076800e+07 2.607440e+07 2.333679e+07 2.024047e+07 2.354978e+07 2.366495e+07 1.827219e+07 1.951416e+07 1.838185e+07 1.748855e+07 1.939457e+07 1.576598e+07 1.580101e+07 1.937744e+07 1.998497e+07 1.613179e+07 1.801899e+07 1.483692e+07 2.072685e+07 1.847622e+07 2.347010e+07 2.716173e+07 1.466149e+07 8.039965e+06 1.068038e+07 1.540606e+07 1.217642e+07 2.226189e+07 1.731472e+07 1.703614e+07 2.018767e+07 1.840317e+07 C43 H85 N9 O2 P2_4.471 7.586762e+06 5.263766e+06 4.196275e+06 4.993603e+06 1.395181e+05 3.904157e+06 5.668459e+06 4.413835e+06 138707.78 3.756070e+06 4.818623e+06 5.179737e+06 134239.09 4.878621e+06 4.628024e+06 4.582957e+06 1.314866e+05 4.904579e+06 4.700633e+06 4.236388e+06 1.485044e+05 4.379006e+06 4.641873e+06 5.697806e+06 41046.825 4.212850e+06 4.103010e+06 5.010226e+06 6.164484e+04 5.178552e+06 4.693766e+06 4.814021e+06 87982.95 4.146988e+06 4.713419e+06 5.044543e+06 1.095204e+05 3.837162e+06 5.015477e+06 5.193289e+06 7.007192e+04 4.068057e+06 5.101064e+06 5.532698e+06 7.072216e+04 3.637665e+06 4.439606e+06 4.950724e+06 4.818986e+06 5.024922e+06 4.495211e+06 8.943547e+06 2.820020e+06 3.809010e+06 3.793277e+06 5.219451e+06 5.894080e+06 4.564486e+06 4.543487e+06 3.903212e+06 5.584138e+06 6.709541e+06 6.947579e+06 6.975554e+06 4.505683e+06 3.404969e+06 3.914400e+06 5.422654e+06 3.735774e+06 6.128026e+06 5.350324e+06 6.217028e+06 6.313481e+06 4.841041e+06 3.882761e+06 5.785985e+06 3.934608e+06 4.800161e+06 6.121968e+06 5.242826e+06 3.618583e+06 5.289138e+06 3.039203e+06 4.618095e+06 3.728926e+06 5.417011e+06 4.213419e+06 3.206724e+06 4.068147e+06 3.221228e+06 3.776364e+06 3.587046e+06 4.476559e+06 4.100080e+06 5.874228e+06 3.814562e+06 2.784088e+06 4.732769e+06 4.106440e+06 4.739283e+06 5.806216e+06 4.501190e+06 4.129441e+06 2.801309e+06 4.776870e+06 4.313335e+06 4.135378e+06 4.330158e+06 4.978803e+06 5.592889e+06 3.778816e+06 4.341115e+06 2.924502e+06 5.429317e+06 2.872222e+06 4.625527e+06 3.948999e+06 3.316510e+06 3.750652e+06 4.395978e+06 3.333634e+06 4.131110e+06 2.710964e+06 3.330610e+06 3.430083e+06 5.550365e+06 6.122429e+06 3.010709e+06 3.108993e+06 3.016036e+06 3.257028e+06 6.981699e+06 3.659782e+06 4.892122e+06 4.619013e+06 4.600021e+06 4.528962e+06 4.633542e+06 3.115594e+06 4.715886e+06 3.225279e+06 3.643782e+06 5.017883e+06 4.049085e+06 8.205971e+06 6.049669e+06 2.764644e+06 4.594979e+06 3.949263e+06 3.856582e+06 3.376495e+06 3.231007e+06 4.300737e+06 4.030642e+06 4.379864e+06 5.287493e+06 7.173826e+06 4.863707e+06 3.482434e+06 4.616018e+06 4.950163e+06 5.619538e+06 8.107101e+06 3.253294e+06 5.088933e+06 4.813166e+06 7.894461e+06 3.417521e+06 5.029616e+06 5.870075e+06 4.991640e+06 3.271188e+06 6.933336e+06 4.832109e+06 3.742861e+06 3.440020e+06 6.036235e+06 5.409645e+06 3.131926e+06 2.991413e+06 3.099012e+06 5.521432e+06 4.311065e+06 4.391602e+06 3.764837e+06 7.195330e+06 6.638637e+06 4.633959e+06 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2.182593e+06 2.246381e+06 2.497231e+06 1.397552e+05 1.819900e+06 2.452079e+06 2.416665e+06 136894.78 2.168952e+06 2.378654e+06 2.332502e+06 141722.49 1.899800e+06 2.136080e+06 2.247154e+06 1.335496e+05 2.328436e+06 2.338202e+06 2.456305e+06 1.452461e+05 2.063832e+06 2.568200e+06 1.882274e+06 43778.676 1.918918e+06 2.541704e+06 2.151236e+06 6.392676e+04 2.298921e+06 2.195560e+06 2.404318e+06 82860.54 2.261985e+06 2.401518e+06 2.143050e+06 1.020216e+05 1.926326e+06 2.331728e+06 2.319095e+06 6.463498e+04 1.948061e+06 2.640934e+06 2.506078e+06 6.489886e+04 2.028934e+06 2.001406e+06 2.343092e+06 2.107096e+06 3.237394e+06 1.832364e+06 5.286011e+06 1.350788e+06 1.509680e+06 1.914086e+06 2.095922e+06 3.657827e+06 2.517247e+06 1.733039e+06 2.179656e+06 3.184153e+06 2.635776e+06 3.194164e+06 4.992130e+06 1.545779e+06 1.517624e+06 1.330873e+06 2.051018e+06 1.746796e+06 2.252533e+06 3.092181e+06 2.419759e+06 2.311560e+06 2.097563e+06 2.118862e+06 2.539521e+06 1.469526e+06 2.653275e+06 3.527936e+06 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3.025220e+06 1.886284e+06 2.063727e+06 2.929631e+06 2.525528e+06 3.418819e+06 3.249764e+06 1.356463e+06 2.569069e+06 3.465300e+06 2.283418e+06 1.463089e+06 2.687012e+06 1.351594e+06 2.528392e+06 1.988447e+06 1.702935e+06 3.218866e+06 6.550693e+05 2.739506e+06 3.295752e+06 3.368257e+06 1.325727e+06 3.186541e+06 2.604898e+06 2.846418e+06 2.564067e+06 3.741863e+06 2.963627e+06 SM 40:4;O4_4.472 1.624097e+05 3.567211e+06 1.201866e+06 7.204232e+05 6.363829e+04 1.469177e+06 1.650832e+06 4.757492e+05 49524.93 1.415982e+06 2.161508e+06 2.421760e+06 45267.87 1.361942e+06 2.059891e+06 1.454766e+06 4.501093e+04 1.458724e+06 1.539947e+06 1.960393e+06 5.084023e+04 1.504120e+06 2.062365e+06 2.092429e+06 13441.897 1.542411e+06 1.866586e+06 1.265869e+06 2.799507e+04 1.950876e+06 2.218028e+06 2.321403e+06 44650.53 7.104320e+05 1.191571e+06 2.563945e+06 4.718532e+04 1.465261e+06 2.067232e+06 7.075770e+05 2.254196e+04 1.916572e+06 1.048427e+06 4.402345e+06 2.112402e+04 9.772077e+05 1.349540e+06 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2.314103e+06 1.665087e+06 6.780010e+05 2.311813e+06 7.785330e+05 1.795871e+06 1.747631e+06 5.863030e+05 3.255925e+05 2.373055e+06 1.765913e+06 1.044747e+06 3.781683e+06 1.420559e+06 1.331709e+06 1.493287e+06 1.211771e+06 8.767257e+05 1.658747e+05 1.669428e+06 9.283895e+05 2.308931e+06 1.272390e+06 2.307566e+06 2.006153e+06 1.547360e+06 1.707914e+06 2.216866e+06 7.873266e+05 1.688208e+06 1.516143e+06 8.512098e+04 8.599497e+05 1.617328e+06 3.331512e+06 3.072976e+06 2.141186e+06 2.584667e+05 1.409080e+06 3.867483e+05 1.221732e+06 1.118097e+06 4.891712e+05 1.287844e+06 1.467520e+06 1.441055e+06 5.080954e+06 1.872749e+06 1.592321e+06 7.175999e+05 3.285020e+06 1.780915e+06 2.028095e+06 6.190729e+05 9.195346e+05 3.231265e+06 1.420942e+06 4.654884e+04 1.420454e+06 1.108701e+06 2.173714e+06 C8 H10 O5 P2_4.472 7.033720e+05 7.300164e+05 8.301147e+05 6.203683e+05 1.144417e+05 7.548249e+05 8.447589e+05 7.593941e+05 102349.77 5.496635e+05 1.001706e+06 7.717723e+05 103448.90 6.248000e+05 6.926558e+05 7.790505e+05 1.027671e+05 8.545026e+05 6.580261e+05 6.848450e+05 1.116837e+05 6.455702e+05 8.937683e+05 9.434214e+05 31565.783 6.745290e+05 6.481671e+05 7.805571e+05 5.042269e+04 6.260277e+05 7.631347e+05 7.633605e+05 64276.40 7.953818e+05 7.573401e+05 6.787454e+05 7.545480e+04 7.118271e+05 8.377265e+05 7.670815e+05 5.071376e+04 7.963410e+05 6.714208e+05 8.286281e+05 5.975581e+04 6.918754e+05 6.402166e+05 8.301563e+05 1.063302e+06 6.430448e+05 1.124732e+06 2.075856e+06 8.158339e+05 8.250828e+05 6.737567e+05 6.811391e+05 1.005591e+06 1.190461e+06 7.333071e+05 1.338329e+06 1.394256e+06 5.231587e+05 9.320903e+05 7.985198e+05 8.173806e+05 1.218126e+06 3.613590e+05 2.566184e+05 1.959482e+05 2.877189e+05 1.093891e+06 2.587970e+05 8.075726e+05 1.200744e+06 6.784695e+05 9.622495e+05 1.456776e+06 9.522078e+05 4.432010e+05 7.652980e+05 6.513686e+05 9.000102e+05 5.203968e+05 1.247770e+06 5.635177e+05 6.494626e+05 5.745397e+05 1.853249e+05 1.001354e+06 4.254974e+05 7.768403e+05 1.223548e+06 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1.729293e+07 2.288498e+07 2.188745e+07 2.000573e+07 2.564745e+07 2.365283e+07 1.886159e+07 2.382211e+07 2.328434e+07 1.732693e+07 1.808548e+07 2.075339e+07 1.835076e+07 1.930387e+07 1.626891e+07 1.885840e+07 2.234094e+07 2.175821e+07 1.825499e+07 2.207641e+07 1.564718e+07 2.165520e+07 2.120780e+07 2.502336e+07 2.752095e+07 1.568624e+07 2.038682e+07 1.892343e+07 1.841561e+07 1.980768e+07 2.230296e+07 1.765676e+07 1.721614e+07 2.010876e+07 1.536054e+07 C15 H13 N2 O8 P_4.475 2.964961e+06 3.704938e+06 3.257016e+06 3.208515e+06 1.310474e+05 2.626979e+06 3.821922e+06 3.401532e+06 126715.60 3.470114e+06 3.360414e+06 3.100462e+06 142536.79 3.332263e+06 3.667031e+06 2.898804e+06 1.394486e+05 3.208711e+06 2.846679e+06 3.574023e+06 1.337029e+05 3.310085e+06 3.723324e+06 3.855045e+06 35586.401 2.831046e+06 3.392847e+06 3.322976e+06 5.618126e+04 3.045988e+06 3.379054e+06 3.777393e+06 77579.83 2.745512e+06 3.384712e+06 3.136370e+06 1.011837e+05 3.377104e+06 3.826584e+06 2.980892e+06 6.595142e+04 3.335113e+06 3.525260e+06 3.848164e+06 7.415475e+04 2.502761e+06 3.317475e+06 3.468361e+06 4.758046e+06 3.059013e+06 4.735178e+06 1.060708e+07 3.819275e+06 4.046589e+06 2.862341e+06 3.450515e+06 5.402674e+06 5.528009e+06 4.137324e+06 8.362466e+06 6.610052e+06 2.435266e+06 5.987495e+06 3.909430e+06 3.817025e+06 5.402684e+06 2.294110e+06 1.647489e+06 1.829731e+06 1.673502e+06 4.207881e+06 1.650769e+06 3.880357e+06 5.234912e+06 2.119217e+06 4.680463e+06 6.296128e+06 5.298945e+06 1.969596e+06 3.356089e+06 3.845475e+06 4.588237e+06 2.519257e+06 6.943169e+06 2.536451e+06 2.494542e+06 2.079099e+06 2.163310e+06 3.979294e+06 1.729846e+06 3.894590e+06 6.791603e+06 3.843138e+06 1.880689e+06 3.715763e+06 6.149628e+06 3.762338e+06 2.123948e+06 5.817868e+06 4.055684e+06 1.939708e+06 2.605149e+06 1.351123e+06 3.893482e+06 1.708702e+06 2.537664e+06 2.909818e+06 1.158111e+06 3.617025e+06 3.028282e+06 2.895521e+06 4.207788e+06 2.554959e+06 2.660818e+06 8.573945e+06 2.441864e+06 3.272635e+06 2.644312e+06 2.881093e+06 2.072760e+06 3.624684e+06 1.873260e+06 1.573644e+06 1.470959e+06 2.576202e+06 2.197722e+06 2.764200e+06 3.443920e+06 1.286411e+06 6.027498e+06 2.833844e+06 3.273639e+06 1.993235e+06 1.698144e+06 1.871868e+06 3.416954e+06 3.072462e+06 2.677863e+06 3.713913e+06 3.360879e+06 2.505646e+06 3.542403e+06 1.770382e+06 1.563633e+06 2.503630e+06 3.532325e+06 1.855859e+06 3.094955e+06 2.923752e+06 4.007767e+06 4.344866e+06 5.489028e+06 1.365180e+06 3.861239e+06 3.253827e+06 4.104017e+06 2.089341e+06 2.333301e+06 3.553951e+06 2.022438e+06 2.597891e+06 2.571033e+06 2.558877e+06 3.748006e+06 3.751099e+06 2.316166e+06 2.990159e+06 2.546393e+06 2.078785e+06 2.984717e+06 2.709553e+06 4.082605e+06 2.201070e+06 3.915580e+06 4.561345e+06 4.926906e+06 4.320043e+06 2.893584e+06 3.388186e+06 8.105199e+06 5.450129e+06 2.614755e+06 2.031877e+06 3.839371e+06 5.419444e+06 2.749145e+06 4.710018e+06 2.068797e+06 5.494159e+06 3.566132e+06 2.642417e+06 4.232583e+06 3.572838e+06 3.766178e+06 1.755102e+06 3.194587e+06 2.571815e+06 3.943053e+06 2.196091e+06 8.999782e+06 4.123892e+06 1.942299e+06 2.642047e+06 2.007875e+06 2.119349e+06 9.087793e+06 2.413553e+06 2.419245e+06 3.900745e+06 2.357911e+06 5.701917e+06 4.408235e+06 3.650273e+06 1.715901e+06 8.900634e+06 3.486491e+06 1.753149e+06 3.133268e+06 2.304081e+07 3.253573e+06 3.186972e+06 1.643351e+06 3.710801e+06 3.738281e+06 2.618765e+06 3.488795e+06 1.837971e+06 1.493341e+06 2.602752e+06 2.340662e+06 6.235289e+06 4.321752e+06 2.105203e+06 4.506480e+06 2.232225e+06 2.814723e+06 1.506665e+06 3.155856e+06 2.127961e+06 2.266142e+06 3.094738e+06 2.938991e+06 5.231970e+06 3.556004e+06 3.428804e+06 5.496604e+06 2.350146e+06 4.130274e+06 2.138590e+06 4.438062e+06 4.882263e+06 4.192439e+06 3.564925e+06 3.408794e+06 4.044133e+06 6.814228e+06 4.242285e+06 3.780052e+06 2.762875e+06 2.353652e+06 2.493663e+06 2.579954e+06 "1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phosphocholine_4.476" 1.608314e+08 9.825697e+07 1.003172e+08 1.010505e+08 1.568906e+05 5.274872e+07 9.862691e+07 1.026380e+08 145961.89 7.564062e+07 9.352738e+07 9.513232e+07 148414.76 8.721502e+07 9.221746e+07 8.392491e+07 1.382987e+05 9.031515e+07 9.311930e+07 8.900201e+07 1.450253e+05 8.356744e+07 9.924153e+07 1.053052e+08 42884.105 8.151455e+07 8.616982e+07 1.012641e+08 7.415149e+04 9.481092e+07 4.320684e+07 1.081526e+08 99549.12 9.847047e+07 8.939359e+07 9.347570e+07 1.129099e+05 8.700052e+07 9.398768e+07 9.325325e+07 7.399156e+04 8.446666e+07 9.020829e+07 1.044700e+08 7.749783e+04 8.044348e+07 8.398710e+07 9.424181e+07 8.212398e+07 8.746525e+07 7.512639e+07 8.634252e+07 1.083961e+08 9.030132e+07 7.580578e+07 1.066244e+08 5.886897e+07 9.274313e+07 1.396950e+08 1.033056e+08 1.317052e+08 1.073556e+08 1.150016e+08 9.424688e+07 1.114097e+08 9.293765e+07 7.234114e+07 1.099302e+08 8.702096e+07 1.016434e+08 1.064489e+08 9.167681e+07 1.047271e+08 7.370122e+07 1.045900e+08 1.006498e+08 1.107657e+08 9.173741e+07 1.397695e+08 8.931292e+07 1.167990e+08 7.955582e+07 6.457289e+07 1.160743e+08 6.097898e+07 7.471856e+07 7.958318e+07 5.314916e+07 9.340910e+07 5.631489e+07 6.628479e+07 1.097721e+08 1.256107e+08 8.311673e+07 1.003828e+08 8.763739e+07 7.672520e+07 1.017745e+08 8.341405e+07 7.341396e+07 9.502764e+07 9.013735e+07 6.686234e+07 7.201556e+07 6.731004e+07 8.970633e+07 9.553467e+07 4.084374e+07 7.644546e+07 1.113827e+08 8.868830e+07 1.206406e+08 1.460676e+08 8.012584e+07 8.213851e+07 7.981271e+07 9.313720e+07 5.736639e+07 8.627399e+07 7.825532e+07 7.185196e+07 4.960306e+07 4.557116e+07 1.077731e+08 7.446544e+07 6.804255e+07 8.249759e+07 7.118484e+07 8.815412e+07 9.069523e+07 1.266528e+08 1.213915e+08 7.645592e+07 1.816248e+08 7.822998e+07 6.784910e+07 9.103393e+07 6.231656e+07 7.040315e+07 8.808064e+07 7.312865e+07 1.158627e+08 1.077093e+08 5.792137e+07 1.088571e+08 1.009263e+08 6.540326e+07 1.097139e+08 1.048487e+08 4.852518e+07 7.511693e+07 8.448753e+07 7.859775e+07 7.346387e+07 7.435091e+07 9.903830e+07 9.931508e+07 9.353143e+07 8.334179e+07 8.465056e+07 8.504873e+07 1.079605e+08 6.750147e+07 1.108712e+08 1.050306e+08 9.225014e+07 7.110687e+07 1.053454e+08 7.943769e+07 8.780173e+07 9.907546e+07 1.044669e+08 9.578977e+07 1.073505e+08 6.304927e+07 1.066186e+08 1.568523e+08 8.577728e+07 1.078145e+08 1.001430e+08 5.078982e+07 8.316670e+07 1.032176e+08 8.536803e+07 6.155081e+07 6.256650e+07 8.955865e+07 7.170375e+07 1.024925e+08 7.496970e+07 1.087024e+08 1.067785e+08 8.326374e+07 7.738802e+07 5.850462e+07 9.361416e+07 1.019645e+08 1.279166e+08 9.469536e+07 9.119844e+07 5.431286e+07 7.128209e+07 1.000345e+08 8.168305e+07 1.132909e+08 6.110639e+07 7.854216e+07 7.773429e+07 5.136843e+07 6.706969e+07 1.176698e+08 7.563497e+07 9.480551e+07 9.725863e+07 5.786277e+07 8.296085e+07 8.229453e+07 9.035586e+07 7.289770e+07 5.087293e+07 9.921607e+07 9.097601e+07 1.134806e+08 8.343208e+07 8.351146e+07 9.000160e+07 8.302724e+07 7.510204e+07 7.436779e+07 1.065210e+08 6.934752e+07 8.377233e+07 6.137116e+07 8.307251e+07 7.696693e+07 6.771558e+07 9.944138e+07 1.105496e+08 8.504561e+07 1.113119e+08 1.064363e+08 1.028641e+08 1.021699e+08 4.163021e+07 6.195716e+07 6.527431e+07 1.019087e+08 1.282469e+08 9.114937e+07 9.746434e+07 8.703459e+07 1.098254e+08 1.103230e+08 1.475648e+08 9.624562e+07 9.709252e+07 1.024733e+08 8.553955e+07 1.065068e+08 1.012376e+08 8.464212e+07 1.253793e+08 URIDINE 3.599586e+06 3.693965e+06 2.992425e+06 3.681277e+06 1.295393e+05 3.392120e+06 3.825166e+06 3.881960e+06 125947.93 2.907554e+06 3.523854e+06 3.835207e+06 133339.07 3.221330e+06 3.456899e+06 3.747842e+06 1.265696e+05 3.270282e+06 3.361346e+06 3.647571e+06 1.323314e+05 2.990281e+06 3.664757e+06 4.415572e+06 37475.818 3.086529e+06 3.494595e+06 3.606134e+06 6.371835e+04 2.872461e+06 3.846618e+06 3.079027e+06 92161.43 3.666485e+06 3.556575e+06 3.360720e+06 1.111012e+05 3.298325e+06 3.744039e+06 3.755744e+06 7.186172e+04 3.184193e+06 3.699785e+06 3.907103e+06 8.169847e+04 3.112691e+06 3.042651e+06 3.786029e+06 5.503989e+06 2.759047e+06 3.963426e+06 1.176771e+07 4.245993e+06 4.747585e+06 3.855451e+06 3.955285e+06 5.081278e+06 5.960183e+06 4.851338e+06 7.972517e+06 8.444596e+06 2.264284e+06 6.382962e+06 3.870354e+06 4.155965e+06 5.740518e+06 1.884742e+06 1.586641e+06 1.701191e+06 1.793276e+06 6.609319e+06 1.660898e+06 4.246740e+06 4.805386e+06 2.595682e+06 5.086756e+06 6.310603e+06 5.327560e+06 2.862846e+06 3.987369e+06 4.026915e+06 3.923328e+06 2.285368e+06 6.847877e+06 2.506927e+06 2.522094e+06 2.826494e+06 1.590689e+06 3.806339e+06 2.471590e+06 4.486113e+06 6.996545e+06 4.074022e+06 1.718360e+06 4.004436e+06 6.084762e+06 3.653018e+06 2.484991e+06 5.275807e+06 3.767718e+06 1.852734e+06 2.043336e+06 1.381016e+06 4.279365e+06 1.849492e+06 2.687120e+06 3.129748e+06 1.277047e+06 3.084009e+06 3.782907e+06 3.216466e+06 4.277882e+06 2.788370e+06 3.052531e+06 9.661360e+06 2.751598e+06 3.537481e+06 2.622127e+06 4.094661e+06 2.516606e+06 3.571302e+06 1.663630e+06 1.474365e+06 1.787943e+06 2.514699e+06 2.312614e+06 3.110125e+06 3.618667e+06 1.541436e+06 6.238160e+06 3.846871e+06 4.274026e+06 2.518029e+06 2.085588e+06 1.699559e+06 3.030300e+06 3.521249e+06 3.513083e+06 3.824370e+06 3.135383e+06 2.216357e+06 3.927972e+06 1.622486e+06 1.716789e+06 2.825710e+06 4.219035e+06 1.906000e+06 3.643233e+06 3.115709e+06 3.650369e+06 4.105455e+06 5.775655e+06 1.348767e+06 4.303881e+06 3.299241e+06 4.098654e+06 2.394236e+06 2.288406e+06 4.165858e+06 2.878429e+06 3.887636e+06 5.200204e+06 2.695786e+06 3.817020e+06 4.656518e+06 1.738033e+06 3.484541e+06 2.283778e+06 1.976120e+06 2.989795e+06 3.060848e+06 3.805342e+06 2.290243e+06 4.263508e+06 4.305848e+06 5.494050e+06 5.353342e+06 3.098954e+06 2.989989e+06 8.244043e+06 7.403081e+06 2.665490e+06 1.935315e+06 3.704396e+06 5.123819e+06 2.775109e+06 5.231036e+06 2.021379e+06 6.324013e+06 4.025699e+06 2.722156e+06 4.711892e+06 3.935834e+06 2.513190e+06 1.806400e+06 2.922797e+06 1.741707e+06 3.985627e+06 2.277700e+06 6.980404e+06 4.071986e+06 2.288849e+06 4.227139e+06 1.947022e+06 2.127240e+06 9.146573e+06 2.594166e+06 2.564741e+06 3.853883e+06 2.950782e+06 6.484459e+06 3.125061e+06 3.760363e+06 1.973220e+06 9.282043e+06 3.187868e+06 1.837015e+06 3.085927e+06 2.849569e+07 2.413584e+06 3.101855e+06 1.704285e+06 3.772289e+06 4.010744e+06 2.413303e+06 3.463818e+06 2.196626e+06 1.525995e+06 2.862767e+06 2.553261e+06 6.841624e+06 4.916124e+06 2.359361e+06 4.232330e+06 2.413613e+06 3.035934e+06 1.674328e+06 3.739704e+06 1.932719e+06 2.654754e+06 3.435663e+06 3.338281e+06 5.039295e+06 3.641872e+06 2.833166e+06 6.036987e+06 2.981824e+06 4.873229e+06 2.145250e+06 3.972807e+06 4.418902e+06 4.844999e+06 4.096419e+06 5.442106e+06 4.425884e+06 7.829076e+06 4.425108e+06 3.681137e+06 2.079932e+06 2.421814e+06 2.465675e+06 3.616349e+06 1-Palmitoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine_4.481 1.413963e+08 1.014202e+08 9.790182e+07 9.789597e+07 1.173960e+05 7.785642e+07 1.116313e+08 5.547480e+07 120177.43 1.038375e+08 1.018516e+08 1.001331e+08 118674.43 9.239362e+07 8.897186e+07 1.048274e+08 1.042398e+05 9.129422e+07 9.131896e+07 9.493174e+07 1.075202e+05 8.649083e+07 1.049713e+08 1.180649e+08 35169.179 9.095088e+07 4.744450e+07 1.063591e+08 5.665821e+04 9.569841e+07 9.386045e+07 1.049123e+08 72351.19 9.449625e+07 9.015157e+07 9.556351e+07 8.713542e+04 8.932923e+07 9.520729e+07 9.881149e+07 5.758360e+04 8.735153e+07 9.500426e+07 1.096604e+08 6.001830e+04 8.564133e+07 8.612964e+07 9.776011e+07 6.883656e+07 9.296196e+07 1.377143e+08 7.703103e+07 1.228296e+08 7.122202e+07 7.430172e+07 8.271744e+07 6.314790e+07 7.579540e+07 1.588309e+08 8.419594e+07 9.691521e+07 9.347676e+07 9.171225e+07 1.249736e+08 1.218493e+08 9.469089e+07 8.814941e+07 1.060516e+08 8.709341e+07 1.014428e+08 1.169020e+08 8.307155e+07 9.114425e+07 1.017314e+08 8.588453e+07 9.669081e+07 1.410877e+08 8.243757e+07 1.513368e+08 9.024954e+07 1.385680e+08 1.019539e+08 9.412113e+07 1.005656e+08 8.381008e+07 9.255993e+07 9.470427e+07 8.638868e+07 1.002302e+08 8.906903e+07 9.904449e+07 4.463290e+07 1.182262e+08 4.250123e+07 1.203193e+08 1.142310e+08 2.905488e+07 1.094492e+08 7.214001e+07 8.026979e+07 8.205929e+07 7.559182e+07 7.210326e+07 9.532248e+07 1.037495e+08 1.113582e+08 6.972399e+07 6.658952e+07 5.754046e+07 1.070373e+08 7.345688e+07 8.658410e+07 1.004932e+08 8.163165e+07 7.965582e+07 8.559841e+07 1.088505e+08 7.845174e+07 9.189621e+07 9.785484e+07 7.154472e+07 9.888489e+07 4.326056e+07 9.417542e+07 7.830515e+07 1.140961e+08 1.330510e+08 9.437069e+07 1.374341e+08 1.447055e+08 1.008861e+08 1.528208e+08 1.163350e+08 9.138201e+07 1.065688e+08 6.740350e+07 1.218015e+08 9.325598e+07 1.106739e+08 6.847431e+07 6.130492e+07 9.995229e+07 1.126535e+08 9.819499e+07 8.889412e+07 9.088578e+07 8.925295e+07 9.756299e+07 4.102817e+07 5.272933e+07 1.207428e+08 7.327109e+07 8.517608e+07 6.928141e+07 7.455785e+07 9.958586e+07 9.439628e+07 1.085047e+08 9.685861e+07 1.086650e+08 1.564259e+08 1.096662e+08 5.929630e+07 1.079145e+08 1.041824e+08 1.144179e+08 8.193103e+07 1.327791e+08 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2.105967e+06 2.515249e+06 1.995819e+06 1.802219e+06 2.145068e+06 2.585839e+06 1.477596e+06 1.898128e+06 2.038793e+06 1.515315e+06 2.236881e+06 2.666531e+06 2.150500e+06 2.552419e+06 2.191656e+06 2.215538e+06 1.940507e+06 2.372042e+06 2.461146e+06 2.210759e+06 2.352574e+06 2.077140e+06 2.527905e+06 2.334875e+06 2.416273e+06 2.183833e+06 1.674730e+06 2.360932e+06 2.080163e+06 1.435620e+06 2.251812e+06 1.844451e+06 2.597252e+06 2.119237e+06 2.132036e+06 2.471855e+06 1.826085e+06 1.838638e+06 C46 H77 N6 O P3_4.485 4.192202e+06 3.172291e+06 3.129840e+06 3.365133e+06 9.698916e+04 2.550911e+06 3.756480e+06 2.848093e+06 88969.61 3.541700e+06 2.964954e+06 3.144840e+06 94276.81 3.156980e+06 3.034887e+06 3.595741e+06 8.557645e+04 2.852704e+06 3.014969e+06 3.224951e+06 8.643443e+04 3.014587e+06 3.452482e+06 3.793070e+06 26750.823 2.743989e+06 2.860874e+06 3.414727e+06 4.350126e+04 2.776610e+06 3.144601e+06 3.217423e+06 57529.34 3.153100e+06 3.063831e+06 3.359625e+06 6.854317e+04 2.982744e+06 3.683515e+06 3.307913e+06 4.961343e+04 3.015348e+06 2.558572e+06 3.401025e+06 5.527812e+04 3.127383e+06 2.925262e+06 3.431131e+06 3.640687e+06 2.658936e+06 2.214983e+06 2.814835e+06 3.218789e+06 2.998147e+06 3.497031e+06 2.727132e+06 2.469004e+06 2.725085e+06 3.582607e+06 3.127619e+06 3.411804e+06 2.588605e+06 2.923572e+06 2.622980e+06 3.127659e+06 3.285906e+06 2.952051e+06 3.720923e+06 3.299782e+06 3.017312e+06 2.835108e+06 3.190180e+06 2.504969e+06 3.034342e+06 3.288597e+06 3.043201e+06 3.179044e+06 2.884788e+06 2.295033e+06 2.928734e+06 3.481727e+06 4.145288e+06 3.502002e+06 2.764064e+06 3.018574e+06 3.109477e+06 2.674738e+06 3.620677e+06 4.193578e+06 2.793796e+06 3.259345e+06 2.775507e+06 3.196880e+06 3.663523e+06 3.920656e+06 2.603751e+06 3.163600e+06 3.267909e+06 3.009378e+06 3.365705e+06 3.321376e+06 3.014804e+06 3.063787e+06 3.280305e+06 3.340433e+06 3.019341e+06 3.689159e+06 2.761690e+06 3.040922e+06 3.221616e+06 3.608572e+06 3.501573e+06 3.615641e+06 2.795066e+06 3.243405e+06 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3.251692e+06 2.832791e+06 2.517132e+06 4.109660e+06 3.169581e+06 4.315095e+06 4.286949e+06 3.041010e+06 3.855203e+06 3.169179e+06 3.093953e+06 3.992077e+06 3.979869e+06 2.786976e+06 2.758839e+06 3.361487e+06 2.758165e+06 1.881977e+06 3.797801e+06 3.063101e+06 3.155359e+06 3.689537e+06 3.270067e+06 2.897829e+06 3.005648e+06 3.372970e+06 2.327812e+06 2.426659e+06 3.301886e+06 2.995721e+06 3.279548e+06 2.980560e+06 2.998091e+06 3.467989e+06 2.839116e+06 2.940058e+06 2.948333e+06 3.203644e+06 4.295371e+06 3.357474e+06 2.984676e+06 2.973028e+06 3.059196e+06 3.193080e+06 3.035513e+06 3.369674e+06 3.019170e+06 2.685974e+06 3.322902e+06 3.810469e+06 3.467345e+06 3.274549e+06 3.626550e+06 2.807570e+06 3.139958e+06 3.357177e+06 3.965874e+06 2.775717e+06 2.774147e+06 3.637042e+06 2.725658e+06 2.134335e+06 3.305476e+06 2.883169e+06 2.929728e+06 3.261287e+06 2.737998e+06 3.227504e+06 2.778928e+06 2.360261e+06 C39 H77 N10 O5 P_4.485 5.365220e+06 3.598927e+06 3.941227e+06 3.516518e+06 1.128012e+05 1.685040e+06 3.371054e+06 3.851556e+06 102704.44 3.158988e+06 3.239454e+06 3.497948e+06 106711.61 3.072714e+06 3.010957e+06 3.698724e+06 9.817184e+04 2.877544e+06 3.413985e+06 3.482413e+06 1.027004e+05 3.352311e+06 3.023753e+06 3.957519e+06 32583.088 2.374240e+06 3.831375e+06 2.911913e+06 5.026229e+04 3.371929e+06 2.872184e+06 3.797231e+06 64845.29 3.473312e+06 2.877017e+06 3.176975e+06 7.515532e+04 3.382017e+06 3.457010e+06 3.113271e+06 4.759232e+04 2.926183e+06 3.835935e+06 3.587260e+06 4.950202e+04 3.172311e+06 2.932760e+06 3.335359e+06 3.705512e+06 2.333068e+06 1.505455e+06 3.973032e+06 2.968894e+06 3.187600e+06 4.934967e+06 2.761974e+06 1.833790e+06 3.208155e+06 4.545895e+06 3.099084e+06 6.738461e+06 4.665211e+06 3.756828e+06 3.342591e+06 3.490098e+06 3.129318e+06 2.617848e+06 2.671167e+06 3.230406e+06 3.571772e+06 3.642993e+06 4.281781e+06 3.996870e+06 2.883903e+06 2.959451e+06 3.764232e+06 5.519647e+06 2.686025e+06 4.192224e+06 2.471736e+06 2.688044e+06 2.973989e+06 1.352163e+06 3.251487e+06 3.002306e+06 1.890130e+06 3.321595e+06 2.085435e+06 4.010770e+06 1.832206e+06 2.110639e+06 2.980325e+06 3.274365e+06 2.766887e+06 1.954710e+06 2.076680e+06 1.788366e+06 3.627367e+06 3.450175e+06 3.251766e+06 4.814387e+06 3.554414e+06 1.771701e+06 2.723473e+06 2.863319e+06 2.822494e+06 2.772123e+06 2.389771e+06 2.802441e+06 2.795738e+06 3.170994e+06 4.540893e+06 5.488271e+06 1.926606e+06 3.640472e+06 2.747147e+06 3.113090e+06 2.081953e+06 3.650064e+06 2.144449e+06 1.681188e+06 1.982981e+06 1.219875e+06 3.280934e+06 1.841565e+06 2.327652e+06 2.798652e+06 1.858452e+06 3.146622e+06 2.606361e+06 4.126760e+06 4.347418e+06 1.842919e+06 2.823113e+06 3.374883e+06 4.164295e+06 4.431087e+06 2.826753e+06 2.079787e+06 2.726571e+06 2.800552e+06 3.677392e+06 5.107959e+06 3.002733e+06 6.522844e+06 4.408990e+06 1.868767e+06 4.254738e+06 3.140258e+06 2.013555e+06 3.346836e+06 2.781266e+06 4.303683e+06 3.723962e+06 3.813223e+06 3.493094e+06 3.667731e+06 2.692639e+06 3.795384e+06 3.505463e+06 2.012428e+06 3.656341e+06 2.828834e+06 3.258071e+06 3.565025e+06 3.392784e+06 2.226347e+06 3.159506e+06 2.376016e+06 1.684137e+06 3.902132e+06 3.231019e+06 2.921924e+06 3.247461e+06 2.379058e+06 4.039471e+06 3.631617e+06 2.777009e+06 2.285256e+06 4.067158e+06 2.188523e+06 3.120934e+06 3.333999e+06 2.991252e+06 3.316424e+06 3.601944e+06 2.766378e+06 2.684483e+06 3.190336e+06 2.078574e+06 3.468712e+06 6.750424e+06 3.435658e+06 2.424574e+06 1.333985e+06 4.527153e+06 3.012796e+06 4.827573e+06 3.357802e+06 4.391635e+06 1.274032e+06 2.812079e+06 3.861773e+06 3.329675e+06 3.414060e+06 2.819677e+06 2.625705e+06 1.998171e+06 2.562982e+06 4.081782e+06 5.241362e+06 2.977785e+06 2.633639e+06 3.110493e+06 2.303887e+06 2.475552e+06 2.594324e+06 2.579671e+06 2.272690e+06 3.477907e+06 4.623809e+06 2.600067e+06 3.253685e+06 4.092000e+06 3.565963e+06 3.476493e+06 2.377308e+06 4.031404e+06 3.749696e+06 3.251662e+06 2.232665e+06 2.687941e+06 1.839420e+06 3.567874e+06 3.700543e+06 3.624784e+06 4.347095e+06 3.082956e+06 2.985983e+06 4.477458e+06 3.308203e+06 3.700432e+06 4.341065e+06 4.248882e+06 2.580237e+06 2.622393e+06 3.034734e+06 4.518886e+06 4.075575e+06 4.115585e+06 2.013842e+06 3.433916e+06 4.059896e+06 4.279196e+06 3.441992e+06 4.113860e+06 3.494980e+06 2.952304e+06 3.582397e+06 2.922909e+06 2.845685e+06 3.884501e+06 C32 H73 N9 O12 P2_4.486 1.601362e+06 1.846612e+06 2.303507e+06 1.848405e+06 6.958383e+04 1.161089e+06 2.161416e+06 1.622914e+06 72265.03 1.521921e+06 1.506139e+06 1.782405e+06 69503.40 2.225068e+06 1.891960e+06 1.917712e+06 6.157387e+04 1.767364e+06 1.805544e+06 1.440458e+06 6.673504e+04 1.994696e+06 1.810126e+06 1.834088e+06 20001.827 1.709244e+06 1.915015e+06 1.872798e+06 2.953346e+04 1.742250e+06 1.719173e+06 1.732823e+06 38919.36 1.853550e+06 1.910224e+06 1.654732e+06 4.778779e+04 1.854760e+06 1.962676e+06 1.691586e+06 3.488640e+04 2.071739e+06 1.389839e+06 1.949736e+06 3.987118e+04 1.794981e+06 1.770804e+06 1.858212e+06 1.580972e+06 2.198783e+06 6.281165e+05 1.960914e+06 1.820106e+06 1.780322e+06 1.962916e+06 1.909639e+06 2.176662e+06 1.783860e+06 1.671409e+06 1.474383e+06 1.946069e+06 1.531399e+06 2.057402e+06 1.427696e+06 1.760940e+06 1.760597e+06 1.858763e+06 2.568171e+06 2.446759e+06 2.380529e+06 1.189615e+06 1.981506e+06 2.032159e+06 2.431293e+06 1.121755e+06 2.203712e+06 1.863296e+06 9.074460e+05 1.365203e+06 2.043614e+06 2.586360e+06 2.501790e+06 1.892113e+06 1.002922e+06 2.127787e+06 2.145675e+06 1.571119e+06 2.257628e+06 1.903107e+06 2.021859e+06 2.326618e+06 1.444575e+06 2.177198e+06 1.782764e+06 2.556444e+06 1.476273e+06 1.892459e+06 1.811029e+06 1.589480e+06 1.964363e+06 2.449682e+06 1.344680e+06 1.867286e+06 3.093625e+06 2.432262e+06 3.168937e+06 2.277024e+06 2.119617e+06 1.402548e+06 1.897755e+06 2.088001e+06 2.001615e+06 1.529141e+06 1.899244e+06 1.790310e+06 1.475396e+06 2.474767e+06 1.869405e+06 1.889402e+06 1.430768e+06 1.922006e+06 2.857645e+06 2.670521e+06 1.915119e+06 1.921870e+06 1.215099e+06 1.936607e+06 2.347230e+06 1.954980e+06 3.934268e+06 3.199902e+06 1.706937e+06 2.019527e+06 1.448603e+06 2.041463e+06 1.667572e+06 2.044794e+06 1.220231e+06 1.734548e+06 1.120356e+06 1.681801e+06 1.809112e+06 2.339512e+06 2.559764e+06 1.753145e+06 2.263387e+06 1.749777e+06 1.888725e+06 2.551445e+06 1.764923e+06 1.925830e+06 2.362309e+06 2.348227e+06 1.641154e+06 1.969809e+06 2.128686e+06 1.444740e+06 3.258745e+06 3.976941e+06 1.854212e+06 6.886411e+05 2.263575e+06 2.085356e+06 1.538023e+06 1.861310e+06 1.836156e+06 1.713497e+06 2.750165e+06 2.562843e+06 1.203295e+06 1.663384e+06 1.458754e+06 2.079574e+06 2.317784e+06 2.248107e+06 1.616747e+06 1.176221e+06 2.062044e+06 1.916909e+06 2.459300e+06 2.123172e+06 2.173469e+06 1.837492e+06 2.858428e+06 3.030292e+06 2.504164e+06 2.145582e+06 1.515464e+06 2.320062e+06 1.658859e+06 1.384912e+06 1.520147e+06 2.496090e+06 1.608667e+06 8.393907e+05 1.948824e+06 1.190925e+06 2.071727e+06 1.574563e+06 1.598064e+06 2.571091e+06 2.157735e+06 1.367030e+06 1.560621e+06 1.719881e+06 1.269403e+06 1.722726e+06 2.670700e+06 1.801744e+06 1.063127e+06 1.688455e+06 3.200580e+06 1.766843e+06 1.456826e+06 1.782002e+06 1.368987e+06 1.941257e+06 1.713074e+06 1.160429e+06 1.969391e+06 2.111795e+06 1.398648e+06 1.740870e+06 2.101532e+06 2.009894e+06 2.111979e+06 1.545355e+06 2.091683e+06 1.472025e+06 1.916026e+06 2.640701e+06 2.057090e+06 1.180495e+06 1.538699e+06 1.683519e+06 2.531702e+06 1.772305e+06 1.768616e+06 1.417878e+06 1.692459e+06 1.515694e+06 1.727445e+06 2.101584e+06 2.055297e+06 2.007966e+06 1.962386e+06 1.640647e+06 1.824475e+06 2.116148e+06 1.671663e+06 1.016442e+06 2.563249e+06 1.570466e+06 9.396250e+05 1.195626e+06 1.389487e+06 2.477671e+06 1.762098e+06 1.118097e+06 1.352500e+06 1.771501e+06 8.860761e+05 "(2R)-2-[(7Z,10Z,13Z,16Z)-7,10,13,16-Docosatetraenoyloxy]-3-(pentadecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate_4.487" 8.269184e+06 6.739049e+06 6.556518e+06 6.656875e+06 1.133067e+05 5.293676e+06 5.740387e+06 7.502204e+06 99766.82 7.083741e+06 6.639747e+06 5.319561e+06 107926.02 6.251804e+06 6.789030e+06 6.618492e+06 1.005256e+05 6.643870e+06 5.693471e+06 7.381198e+06 1.066859e+05 5.510010e+06 6.146019e+06 8.347244e+06 32881.161 5.525001e+06 5.901395e+06 6.903265e+06 5.380319e+04 6.086091e+06 6.073960e+06 7.324139e+06 78207.98 5.695238e+06 5.913288e+06 7.793080e+06 9.197444e+04 6.176188e+06 5.497157e+06 6.386281e+06 6.002546e+04 6.256583e+06 6.384998e+06 8.324578e+06 6.049731e+04 5.644410e+06 5.918819e+06 6.396281e+06 6.658191e+06 4.497080e+06 3.381853e+06 9.341150e+06 6.893226e+06 7.553408e+06 5.462784e+06 6.638591e+06 5.914892e+06 6.495317e+06 1.239000e+07 6.737470e+06 1.303459e+07 1.101806e+07 6.670658e+06 8.537087e+06 7.581348e+06 6.463108e+06 4.888577e+06 9.647008e+06 7.391809e+06 7.658607e+06 5.343302e+06 9.487161e+06 8.977013e+06 5.018834e+06 4.537476e+06 8.311609e+06 9.543913e+06 5.238171e+06 8.534734e+06 6.590551e+06 4.773094e+06 5.670632e+06 3.449761e+06 5.345098e+06 5.891783e+06 4.236554e+06 7.413148e+06 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8.215100e+06 7.534300e+06 5.686387e+06 8.136075e+06 6.223425e+06 4.892545e+06 6.301834e+06 5.355682e+06 5.680087e+06 5.372381e+06 4.779477e+06 7.585417e+06 6.974679e+06 7.611817e+06 4.439803e+06 6.573552e+06 5.862410e+06 7.319880e+06 7.352530e+06 4.858325e+06 5.964361e+06 5.406149e+06 4.689029e+06 4.857406e+06 4.772129e+06 4.525740e+06 6.494148e+06 8.581633e+06 8.358685e+06 5.835392e+06 3.279359e+06 4.793835e+06 6.854287e+06 1.100241e+07 8.447000e+06 5.467872e+06 2.209565e+06 5.996334e+06 6.111713e+06 4.792419e+06 5.580856e+06 3.864638e+06 5.561582e+06 4.139445e+06 5.194198e+06 9.018427e+06 1.088463e+07 6.061650e+06 5.070276e+06 5.756470e+06 2.974463e+06 4.768635e+06 7.165355e+06 4.973058e+06 3.082924e+06 4.324965e+06 8.638222e+06 5.695546e+06 7.031851e+06 1.049227e+07 7.550431e+06 6.426183e+06 5.959891e+06 8.399628e+06 4.678481e+06 6.042126e+06 4.040853e+06 5.596382e+06 4.119407e+06 5.925978e+06 8.596712e+06 8.553608e+06 7.648772e+06 9.897707e+06 5.311452e+06 7.678676e+06 4.881109e+06 6.215918e+06 7.883747e+06 6.857019e+06 3.893555e+06 5.437635e+06 5.308784e+06 9.590543e+06 8.419574e+06 5.028118e+06 1.339647e+06 6.501592e+06 4.766715e+06 8.469934e+06 9.303492e+06 4.529504e+06 5.533139e+06 6.238056e+06 9.101754e+06 4.892616e+06 5.569872e+06 7.017112e+06 C87 H154 N8 O15 P2 S_4.488 5.592574e+06 4.880194e+06 4.879927e+06 5.324926e+06 7.709443e+04 3.626029e+06 5.369262e+06 5.359147e+06 80217.78 2.770154e+06 5.105818e+06 4.537569e+06 80205.22 4.981966e+06 4.482759e+06 5.303900e+06 6.816693e+04 4.282889e+06 4.762564e+06 4.799587e+06 6.956438e+04 4.423867e+06 4.866494e+06 5.957082e+06 23637.918 4.414251e+06 5.109153e+06 1.647535e+06 4.365832e+04 5.035959e+06 5.086854e+06 4.967063e+06 51986.48 4.917712e+06 4.440646e+06 4.849611e+06 5.597236e+04 4.673440e+06 5.136240e+06 5.128751e+06 3.839534e+04 4.560290e+06 3.767486e+06 4.848121e+06 4.395558e+04 5.103984e+06 4.461879e+06 4.759098e+06 5.504508e+06 3.978718e+06 3.085005e+06 3.643077e+06 5.662295e+06 4.743311e+06 5.179043e+06 4.270218e+06 3.903687e+06 4.305077e+06 4.152567e+06 3.744012e+06 7.405357e+06 4.084450e+06 4.334790e+06 3.512203e+06 6.087244e+06 5.010232e+06 4.420389e+06 4.781984e+06 4.684523e+06 5.527035e+06 4.595469e+06 4.755642e+06 4.127549e+06 4.461424e+06 5.832597e+06 5.431321e+06 4.010370e+06 4.551974e+06 3.901087e+06 4.590101e+06 5.513415e+06 5.331034e+06 5.180499e+06 4.136401e+06 4.716168e+06 4.582579e+06 3.948112e+06 4.928921e+06 4.711306e+06 4.422394e+06 5.254069e+06 4.811940e+06 6.021209e+06 6.113899e+06 5.060608e+06 3.808981e+06 4.720856e+06 4.625741e+06 4.453368e+06 5.049705e+06 4.857017e+06 5.273287e+06 5.210026e+06 5.827231e+06 3.318681e+06 5.504039e+06 4.444126e+06 4.573519e+06 4.875647e+06 5.847260e+06 6.059295e+06 5.579835e+06 6.001067e+06 3.968466e+06 5.457031e+06 5.894991e+06 4.481341e+06 3.840674e+06 6.128389e+06 4.032326e+06 4.208682e+06 4.278912e+06 3.935133e+06 6.092988e+06 4.724801e+06 4.353758e+06 4.471027e+06 4.451685e+06 4.647915e+06 5.826988e+06 6.164323e+06 3.897920e+06 4.416938e+06 5.343429e+06 5.074909e+06 4.684071e+06 4.349697e+06 4.960374e+06 5.118081e+06 3.906928e+06 4.404831e+06 6.046843e+06 5.006306e+06 6.096753e+06 6.295811e+06 6.033873e+06 4.210820e+06 6.449441e+06 4.891672e+06 3.813946e+06 4.948487e+06 4.963829e+06 4.113828e+06 4.972361e+06 3.361604e+06 6.002088e+06 5.093041e+06 5.621360e+06 4.977908e+06 4.341644e+06 4.330255e+06 3.261203e+06 4.503178e+06 4.817097e+06 4.889033e+06 4.508770e+06 3.737298e+06 4.380690e+06 4.213277e+06 4.711199e+06 4.938392e+06 4.312727e+06 4.271951e+06 4.085981e+06 5.181581e+06 5.148884e+06 4.858912e+06 4.918129e+06 4.578517e+06 5.425405e+06 3.835013e+06 3.666032e+06 4.447252e+06 5.690979e+06 4.444809e+06 4.255653e+06 5.099863e+06 4.630218e+06 4.964688e+06 4.128895e+06 5.552361e+06 5.196069e+06 5.732184e+06 4.247579e+06 3.590841e+06 6.258721e+06 4.355587e+06 3.742251e+06 6.768032e+06 4.609956e+06 6.407415e+06 4.894444e+06 4.605250e+06 5.991496e+06 5.309867e+06 4.243289e+06 4.965249e+06 5.231540e+06 2.778002e+06 3.628262e+06 2.468864e+06 5.207630e+06 5.139505e+06 5.785131e+06 5.075085e+06 4.185957e+06 4.522684e+06 4.978240e+06 4.051493e+06 3.311576e+06 9.542284e+06 4.723857e+06 6.355565e+06 4.281978e+06 4.384561e+06 5.804677e+06 4.106047e+06 3.985396e+06 4.044549e+06 4.927228e+06 2.013915e+06 4.651624e+06 5.128285e+06 4.279172e+06 5.586859e+06 3.039358e+06 4.775542e+06 4.941059e+06 4.893948e+06 5.046252e+06 4.443891e+06 5.152247e+06 5.906351e+06 5.225178e+06 5.574490e+06 3.981464e+06 6.059692e+06 6.031329e+06 4.801617e+06 3.838744e+06 3.996700e+06 6.070193e+06 4.214900e+06 2.823625e+06 4.687770e+06 4.054657e+06 5.708317e+06 4.300933e+06 4.212273e+06 5.118670e+06 4.710626e+06 3.642017e+06 C64 H77 N3 O12_4.489 4.461622e+05 4.760776e+05 4.589317e+05 4.366009e+05 1.092034e+05 4.197506e+05 4.240349e+05 4.992046e+05 94365.21 3.723828e+05 4.883553e+05 4.585556e+05 95354.30 5.119052e+05 4.200596e+05 4.225256e+05 8.844867e+04 4.154140e+05 4.292484e+05 4.029056e+05 8.707589e+04 4.587104e+05 5.558442e+05 5.147589e+05 26935.426 4.559526e+05 3.056787e+05 3.611572e+05 4.542055e+04 4.810602e+05 5.453691e+05 4.127970e+05 64924.32 4.905383e+05 4.323612e+05 5.134091e+05 8.294995e+04 3.558345e+05 3.701308e+05 5.308735e+05 5.678383e+04 5.018899e+05 3.674457e+05 5.951874e+05 6.270971e+04 3.707280e+05 3.526792e+05 5.079520e+05 7.079415e+05 2.478833e+05 5.240687e+05 1.603541e+06 5.592806e+05 4.130013e+05 4.958808e+05 4.153044e+05 9.628912e+05 8.646558e+05 3.763873e+05 7.287758e+05 9.062449e+05 1.311499e+05 6.692337e+05 2.173781e+05 5.330555e+05 7.102599e+05 1.236154e+05 4.125056e+05 1.070193e+05 1.003807e+05 8.524726e+05 1.393361e+05 4.554475e+05 8.852865e+05 2.329113e+05 5.800798e+05 8.247347e+05 6.829148e+05 9.295163e+04 4.800147e+05 5.276397e+05 5.547380e+05 3.313316e+05 5.165395e+05 2.559426e+05 1.152843e+05 4.759812e+05 8.781647e+04 5.497991e+05 5.256558e+05 4.667457e+05 1.078479e+06 7.300980e+05 1.908308e+05 8.916946e+05 8.338671e+05 5.228845e+05 1.142590e+05 6.122832e+05 4.176843e+05 2.073601e+05 2.817101e+05 9.601215e+04 7.617229e+05 2.028183e+05 2.894109e+05 3.374326e+05 9.287446e+04 2.663339e+05 4.881038e+05 3.549327e+05 5.510724e+05 1.715283e+05 2.967730e+05 1.656642e+06 4.520091e+05 4.573655e+05 4.419969e+05 4.383492e+05 9.962836e+04 5.291254e+05 3.526336e+05 3.043843e+05 1.354720e+05 2.043866e+05 1.096653e+05 3.665885e+05 6.796955e+05 9.112824e+04 1.283754e+06 6.184330e+05 1.991102e+05 3.680040e+05 1.532664e+05 1.425004e+05 3.050526e+05 3.974530e+05 4.625820e+05 4.273451e+05 3.123662e+05 2.259076e+05 4.551480e+05 1.159912e+05 1.837817e+05 3.853969e+05 6.559547e+05 1.921925e+05 3.418943e+05 3.626167e+05 4.927217e+05 4.551854e+05 9.654148e+05 1.981149e+05 8.081239e+05 4.217530e+05 6.195665e+05 2.214357e+05 5.784732e+05 7.008743e+05 3.378014e+05 1.484174e+05 7.349530e+05 4.034786e+05 4.873507e+05 6.264284e+05 3.447322e+05 6.397997e+05 1.571477e+05 1.198995e+05 4.411233e+05 2.867233e+05 3.988649e+05 1.163097e+05 5.578630e+05 1.024993e+06 8.930487e+05 3.456550e+05 5.401911e+05 3.787906e+05 1.182339e+06 1.269524e+06 1.903765e+05 1.996367e+05 5.551184e+05 9.031547e+05 4.642912e+05 7.137217e+05 1.015480e+05 8.738153e+05 5.164060e+05 1.033980e+05 4.254817e+05 3.796881e+05 2.409747e+05 9.998421e+04 3.695606e+05 1.834197e+05 4.770031e+05 3.716069e+05 1.118985e+06 9.709577e+05 4.462506e+05 2.804696e+05 1.834680e+05 1.147083e+05 1.024218e+06 3.853578e+05 3.690516e+05 8.203336e+05 4.514876e+05 8.211960e+05 6.871092e+05 6.542135e+05 3.664693e+05 1.379459e+06 3.504835e+05 5.122259e+05 4.393596e+05 3.380195e+06 3.237535e+05 3.251183e+05 9.570370e+04 6.427801e+05 6.226037e+05 3.157479e+05 4.992552e+05 1.435186e+05 9.900943e+04 2.739557e+05 3.535636e+05 1.202740e+06 8.010977e+05 1.889745e+05 5.265735e+05 1.695860e+05 3.768004e+05 2.530706e+05 5.077225e+05 9.618548e+04 2.219859e+05 4.087018e+05 2.975717e+05 9.216560e+05 5.624366e+05 5.367582e+05 1.000093e+06 5.226889e+05 6.466478e+05 1.464833e+05 3.724666e+05 6.482562e+05 6.341733e+05 4.069110e+05 4.091147e+05 5.415842e+05 7.628622e+05 6.827483e+05 3.504446e+05 2.125831e+05 3.196793e+05 2.698823e+05 1.030629e+05 C41 H71 N9 O10_4.493 1.206367e+06 1.413360e+06 1.291514e+06 1.867581e+06 1.056957e+05 1.207163e+06 1.765957e+06 1.523422e+06 105280.41 1.425819e+06 1.321193e+06 1.217352e+06 111265.05 1.502328e+06 1.525419e+06 1.859471e+06 9.284402e+04 1.438014e+06 1.438327e+06 1.381255e+06 9.730732e+04 1.299808e+06 1.662299e+06 1.501336e+06 29247.395 1.419490e+06 1.374791e+06 1.746532e+06 4.813936e+04 1.304105e+06 1.444598e+06 1.607161e+06 65396.26 1.457786e+06 1.383160e+06 1.437209e+06 8.225255e+04 1.564071e+06 1.314108e+06 1.607852e+06 5.692040e+04 1.439178e+06 1.468712e+06 1.867927e+06 6.291474e+04 1.269891e+06 1.167865e+06 1.649189e+06 1.704250e+06 2.277505e+06 1.220832e+06 3.243386e+06 8.024704e+05 2.251878e+06 1.285188e+06 1.723788e+06 2.947045e+06 1.843470e+06 5.315615e+05 1.180657e+06 2.021974e+06 1.585469e+06 1.454233e+06 1.490289e+06 1.413121e+06 1.253341e+06 1.366416e+06 1.558861e+06 1.270914e+06 1.252402e+06 1.072904e+06 1.492206e+06 1.239373e+06 1.676395e+06 1.281203e+06 1.711905e+06 7.201082e+05 1.425828e+06 7.075380e+05 1.738863e+06 8.753641e+05 1.054555e+06 1.946656e+06 8.948305e+05 2.005108e+06 1.545107e+06 1.484163e+06 1.257536e+06 1.295146e+06 1.761676e+06 1.067917e+06 1.407831e+06 1.594234e+06 1.360309e+06 9.898184e+05 9.571775e+05 1.759580e+06 1.593501e+06 1.859743e+06 1.214564e+06 1.881471e+06 1.602196e+06 1.400913e+06 8.134223e+05 1.350050e+06 1.128857e+06 1.677130e+06 1.588564e+06 2.932145e+06 1.671547e+06 1.155386e+06 9.688520e+05 9.090296e+05 1.371412e+06 1.539554e+06 1.626646e+06 1.636024e+06 2.087175e+06 1.386106e+06 1.937156e+06 1.207451e+06 2.277789e+06 2.900761e+06 7.597504e+05 1.684072e+06 1.906732e+06 1.495237e+06 8.411557e+05 1.023375e+06 7.955961e+05 1.214696e+06 1.384809e+06 1.247607e+06 1.808265e+06 1.903244e+06 1.407094e+06 1.601635e+06 1.331054e+06 1.479485e+06 2.535012e+06 1.007503e+06 6.098687e+05 1.328217e+06 1.676487e+06 2.336641e+06 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C50 H71 N7 O4 S_4.51 4.259275e+06 3.955888e+06 4.871258e+06 4.445553e+06 1.027682e+05 3.359741e+06 5.222032e+06 3.266379e+06 103120.35 4.626890e+06 3.926537e+06 4.195364e+06 99569.43 4.800738e+06 3.652427e+06 4.617227e+06 8.940178e+04 4.244661e+06 4.578227e+06 4.000850e+06 8.659066e+04 4.325007e+06 4.427141e+06 3.548160e+06 33502.848 4.277917e+06 4.796571e+06 4.526090e+06 5.084694e+04 3.859564e+06 4.288935e+06 3.481069e+06 59358.20 5.043891e+06 3.627147e+06 4.168341e+06 6.418960e+04 4.695596e+06 4.807327e+06 4.449437e+06 5.127538e+04 4.130191e+06 3.427221e+06 3.936068e+06 6.154638e+04 4.681519e+06 4.270051e+06 4.362370e+06 6.132024e+06 2.953576e+06 5.650928e+06 3.029377e+06 5.548687e+06 6.064645e+06 4.960532e+06 3.236370e+06 2.072486e+06 2.561628e+06 2.613866e+06 5.279235e+06 4.999767e+06 4.135121e+06 2.419764e+06 2.718805e+06 3.966956e+06 4.948278e+06 3.256731e+06 4.779510e+06 3.136675e+06 2.398506e+06 4.652376e+06 3.321048e+06 2.741208e+06 2.592074e+06 3.224004e+06 3.370308e+06 3.414409e+06 4.943578e+06 2.418552e+06 2.409213e+06 4.643492e+06 3.891618e+06 7.929403e+06 5.076764e+06 3.925070e+06 4.135104e+06 3.794019e+06 4.557432e+06 2.609918e+06 3.684293e+06 3.819397e+06 4.145906e+06 2.669142e+06 6.478197e+06 3.075581e+06 3.899146e+06 4.662425e+06 6.072343e+06 4.384992e+06 4.497312e+06 2.806050e+06 3.902048e+06 7.722121e+06 2.591467e+06 2.337227e+06 1.784678e+06 4.246549e+06 3.039271e+06 3.975071e+06 4.239755e+06 4.672903e+06 4.903273e+06 3.513182e+06 3.659409e+06 3.857720e+06 5.215617e+06 3.738564e+06 3.306541e+06 6.078057e+06 4.440258e+06 6.101127e+06 2.506947e+06 2.365698e+06 2.528282e+06 4.435765e+06 4.915494e+06 3.756175e+06 4.244186e+06 2.986289e+06 3.934420e+06 1.984484e+06 2.016724e+06 3.415142e+06 4.608562e+06 4.089770e+06 4.202351e+06 5.454275e+06 4.523865e+06 6.090411e+06 1.885028e+06 5.206296e+06 6.622683e+06 4.315593e+06 5.029580e+06 2.663583e+06 3.672626e+06 4.789906e+06 5.665901e+06 4.094477e+06 3.576241e+06 3.430477e+06 3.927973e+06 2.819538e+06 6.308331e+06 3.670832e+06 4.849266e+06 4.034791e+06 2.564248e+06 4.183630e+06 4.090128e+06 5.102582e+06 3.528771e+06 3.245472e+06 5.738775e+06 3.110660e+06 2.948039e+06 3.880401e+06 3.904787e+06 3.563460e+06 6.295702e+06 4.808820e+06 4.822929e+06 2.992824e+06 5.526259e+06 3.773926e+06 4.394147e+06 3.237477e+06 3.031981e+06 4.608126e+06 4.371328e+06 2.579420e+06 2.309347e+06 3.289155e+06 4.423094e+06 4.213214e+06 3.094043e+06 2.536590e+06 5.034789e+06 5.785199e+06 5.481583e+06 6.122796e+06 3.574627e+06 3.585019e+06 4.863741e+06 5.790467e+06 1.215930e+07 7.608750e+06 4.772978e+06 4.287422e+06 6.337936e+06 4.780030e+06 3.483254e+06 6.123256e+06 5.308168e+06 6.958251e+06 5.923804e+06 3.235018e+06 2.701035e+06 2.544017e+06 2.177627e+06 4.432505e+06 2.649325e+06 5.645201e+06 6.278980e+06 7.501554e+06 5.597919e+06 4.612158e+06 5.302275e+06 3.704308e+06 3.829268e+06 4.345934e+06 3.698405e+06 2.999084e+06 4.516264e+06 2.406972e+06 2.783145e+06 4.390059e+06 2.896410e+06 4.758117e+06 4.581958e+06 5.804280e+06 2.415432e+06 3.629252e+06 5.194143e+06 3.796997e+06 2.578275e+06 3.199537e+06 2.511586e+06 5.572772e+06 3.633688e+06 5.220188e+06 5.204079e+06 3.958316e+06 5.541601e+06 5.820730e+06 5.095610e+06 3.278313e+06 4.655123e+06 3.130515e+06 4.046383e+06 3.898248e+06 2.601367e+06 3.738587e+06 3.528582e+06 2.655760e+06 8.184085e+06 2.814167e+06 5.109765e+06 3.578174e+06 5.322063e+06 4.129165e+06 2.093366e+06 "1-(9Z)-hexadecenoyl-2-(13Z,16Z)-docosadienoyl-sn-glycero-3-phosphocholine_4.511" 7.964848e+07 3.805266e+07 4.583846e+07 5.025259e+07 1.136277e+05 3.182445e+07 4.696039e+07 5.314334e+07 109451.91 4.850259e+07 2.877854e+07 4.585049e+07 115771.94 4.794241e+07 2.914285e+07 4.241325e+07 1.033312e+05 4.832769e+07 4.588526e+07 4.266953e+07 9.258228e+04 4.531077e+07 4.854983e+07 4.226067e+07 36813.511 3.516582e+07 5.107842e+07 4.793571e+07 5.889352e+04 2.552511e+07 4.580024e+07 4.433275e+07 66257.11 4.950371e+07 4.383713e+07 4.440094e+07 8.018097e+04 4.759583e+07 2.893663e+07 3.643373e+07 5.683263e+04 4.759615e+07 4.964973e+07 5.084099e+07 5.782296e+04 4.240565e+07 3.131054e+07 4.876755e+07 4.896131e+07 2.925668e+07 5.078204e+07 3.767491e+07 6.077122e+07 5.110947e+07 5.805613e+07 4.511138e+07 1.978974e+07 2.189062e+07 6.636175e+07 7.107430e+07 6.093236e+07 5.834517e+07 3.579835e+07 3.204145e+07 4.907951e+07 2.836703e+07 3.121589e+07 4.899535e+07 3.068477e+07 2.698273e+07 6.181530e+07 4.070112e+07 2.480297e+07 2.900393e+07 3.804462e+07 3.892842e+07 4.552177e+07 6.884757e+07 4.862978e+07 3.362639e+07 6.136784e+07 2.636245e+07 5.911553e+07 8.741114e+07 2.820923e+07 3.718533e+07 4.053295e+07 3.866296e+07 4.842806e+07 2.505233e+07 5.316122e+07 3.647841e+07 2.929870e+07 5.391013e+07 4.600198e+07 4.125577e+07 5.614029e+07 6.289559e+07 3.813375e+07 4.012141e+07 2.339976e+07 2.139784e+07 6.817585e+07 2.402620e+07 2.148748e+07 2.388617e+07 3.043300e+07 2.998910e+07 2.536620e+07 4.674332e+07 3.737790e+07 6.139088e+07 5.770392e+07 3.636122e+07 2.300733e+07 2.939574e+07 4.007664e+07 2.337007e+07 5.865163e+07 3.593262e+07 4.439296e+07 1.323678e+07 1.086066e+07 3.458556e+07 3.873694e+07 4.240549e+07 3.825189e+07 2.748941e+07 4.257731e+07 4.329021e+07 1.897983e+07 3.850211e+07 3.234209e+07 5.611843e+07 4.675281e+07 3.613532e+07 5.363576e+07 4.637496e+07 3.876425e+07 2.145684e+07 5.231318e+07 8.718942e+07 5.539801e+07 2.442617e+07 4.570251e+07 3.406287e+07 3.709776e+07 7.774820e+07 4.931325e+07 2.886865e+07 2.221503e+07 3.185685e+07 1.939814e+07 4.919100e+07 3.669425e+07 5.801753e+07 3.337750e+07 2.171277e+07 3.322434e+07 4.902131e+07 4.874668e+07 4.196645e+07 2.979850e+07 3.104151e+07 4.570732e+07 3.022285e+07 3.563097e+07 2.977706e+07 3.191100e+07 5.900021e+07 4.782038e+07 5.896624e+07 3.443071e+07 5.580694e+07 3.357920e+07 5.718163e+07 3.719276e+07 2.951272e+07 5.789516e+07 5.145271e+07 1.536470e+07 2.895705e+07 4.184289e+07 2.826968e+07 2.396879e+07 3.067139e+07 2.929299e+07 4.398189e+07 5.477075e+07 4.222592e+07 5.596600e+07 5.598746e+07 2.436866e+07 5.988869e+07 3.589536e+07 9.283938e+07 7.950255e+07 4.608577e+07 2.415858e+07 5.659498e+07 4.857432e+07 1.826472e+07 7.200882e+07 4.802318e+07 7.268090e+07 4.636849e+07 1.847892e+07 2.398143e+07 1.766384e+07 3.774521e+07 5.180954e+07 2.258116e+07 6.167700e+07 4.222142e+07 6.826454e+07 2.998604e+07 3.172716e+07 5.202748e+07 2.981720e+07 2.523114e+07 4.206367e+07 2.599197e+07 1.545766e+07 3.867753e+07 2.661832e+07 2.943315e+07 2.327855e+07 2.879995e+07 6.266483e+07 4.333253e+07 4.066994e+07 2.501749e+07 2.100083e+07 3.435134e+07 4.041881e+07 1.747899e+07 2.651541e+07 3.215555e+07 3.670979e+07 6.053775e+07 6.458986e+07 5.387839e+07 5.028699e+07 5.160705e+07 4.755972e+07 2.890344e+07 3.368842e+07 4.150045e+07 3.501491e+07 5.264321e+07 4.428887e+07 3.689941e+07 5.432647e+07 7.950626e+07 3.528263e+07 1.026279e+08 3.134694e+07 6.053533e+07 5.926963e+07 3.360292e+07 3.327449e+07 3.382772e+07 C39 H85 N6 O9 P_4.511 2.976173e+07 2.130758e+07 1.957705e+07 2.303078e+07 1.097238e+05 1.501285e+07 1.980748e+07 2.110963e+07 110253.19 2.003984e+07 2.000724e+07 2.026118e+07 111051.17 1.882070e+07 1.893356e+07 2.160125e+07 1.040192e+05 1.976108e+07 1.974585e+07 2.054785e+07 1.025961e+05 1.973217e+07 2.100692e+07 1.792630e+07 44433.115 1.863615e+07 2.171068e+07 2.180634e+07 6.179059e+04 1.942381e+07 1.679176e+07 2.134070e+07 71490.07 2.017262e+07 2.025498e+07 1.982965e+07 7.969751e+04 1.865526e+07 1.945763e+07 2.120577e+07 5.736901e+04 2.119569e+07 2.145886e+07 1.772909e+07 6.371810e+04 1.838961e+07 1.985510e+07 2.102517e+07 2.283354e+07 1.363510e+07 2.213088e+07 1.844134e+07 2.606337e+07 2.205239e+07 2.564577e+07 2.264627e+07 9.985497e+06 1.563015e+07 2.674243e+07 2.655884e+07 2.702477e+07 2.508767e+07 1.926607e+07 2.132504e+07 2.044005e+07 2.099062e+07 1.422189e+07 1.932086e+07 1.333808e+07 1.328883e+07 2.778298e+07 1.784730e+07 1.809922e+07 1.281453e+07 1.910415e+07 1.609553e+07 1.881706e+07 2.619815e+07 2.241426e+07 1.443271e+07 2.131768e+07 1.899945e+07 2.287368e+07 3.213035e+07 1.377262e+07 1.501677e+07 1.612112e+07 1.493644e+07 2.147577e+07 1.220266e+07 2.224359e+07 1.901147e+07 1.412093e+07 2.203674e+07 1.899329e+07 1.711540e+07 2.091628e+07 2.602782e+07 1.679801e+07 1.845809e+07 1.605109e+07 1.671674e+07 2.915849e+07 1.128481e+07 1.260853e+07 1.129333e+07 1.503397e+07 1.438885e+07 1.622345e+07 1.915847e+07 1.736734e+07 2.587824e+07 2.355153e+07 1.645037e+07 1.464571e+07 1.880205e+07 1.794246e+07 8.784887e+06 2.484277e+07 1.828012e+07 1.988014e+07 1.004916e+07 5.953075e+06 1.527079e+07 1.632543e+07 1.897319e+07 1.661658e+07 1.509886e+07 1.415124e+07 1.550000e+07 1.111905e+07 1.789283e+07 1.513287e+07 2.359660e+07 1.794104e+07 1.637897e+07 2.368044e+07 1.891993e+07 2.053357e+07 9.770220e+06 2.407311e+07 3.718359e+07 2.484743e+07 1.776953e+07 1.757887e+07 1.457886e+07 1.512141e+07 3.149360e+07 1.993888e+07 1.183301e+07 1.524014e+07 1.520296e+07 1.583296e+07 2.147915e+07 1.678741e+07 5.343784e+06 1.728151e+07 1.014737e+07 1.608563e+07 1.796929e+07 1.770252e+07 1.886651e+07 1.313110e+07 3.132109e+07 1.976128e+07 1.527223e+07 1.722445e+07 1.945301e+07 1.433710e+07 2.385241e+07 2.692104e+07 2.343160e+07 1.319741e+07 2.274737e+07 1.416599e+07 2.230790e+07 2.414782e+07 1.201183e+07 2.449306e+07 2.160258e+07 7.912582e+06 1.369374e+07 1.644927e+07 1.753908e+07 1.199222e+07 1.395635e+07 1.353404e+07 2.052274e+07 2.563059e+07 2.081246e+07 2.584839e+07 2.281149e+07 1.720277e+07 2.444393e+07 1.382810e+07 3.735075e+07 3.305191e+07 2.228698e+07 1.488600e+07 2.580059e+07 1.652600e+07 1.348219e+07 2.574208e+07 2.010419e+07 2.220902e+07 1.354813e+07 1.268001e+07 1.128111e+07 9.072739e+06 1.400923e+07 2.127853e+07 1.140708e+07 2.516618e+07 2.777292e+07 3.277524e+07 1.914836e+07 1.548451e+07 2.161777e+07 1.252178e+07 1.292220e+07 2.002839e+07 1.470081e+07 1.185150e+07 1.806743e+07 1.156464e+07 1.300561e+07 1.725329e+07 1.495238e+07 2.684843e+07 2.171371e+07 2.588484e+07 1.204325e+07 1.422162e+07 2.303138e+07 1.825515e+07 1.162317e+07 1.808838e+07 1.457236e+07 2.159504e+07 2.372950e+07 2.727749e+07 2.316736e+07 2.203991e+07 1.755644e+07 1.826299e+07 1.480707e+07 1.793710e+07 2.900380e+07 1.449095e+07 2.313448e+07 1.773397e+07 1.635577e+07 2.330911e+07 2.852762e+07 1.430064e+07 4.399811e+07 1.397606e+07 2.093636e+07 2.242775e+07 1.755986e+07 1.514299e+07 2.374204e+07 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine_4.512 6.449010e+08 4.522021e+08 4.787530e+08 4.389693e+08 2.076940e+05 3.351561e+08 3.998321e+08 5.695434e+08 165747.79 3.346670e+08 3.125280e+08 4.348100e+08 142586.29 5.590892e+08 2.759972e+08 5.566389e+08 1.303811e+05 5.139772e+08 4.421843e+08 3.641923e+08 1.588537e+05 3.423204e+08 4.177229e+08 4.454781e+08 64699.835 3.470970e+08 3.504555e+08 6.683353e+08 8.580853e+04 4.140625e+08 3.064385e+08 3.236811e+08 94713.52 6.063227e+08 3.771085e+08 4.620768e+08 1.106702e+05 4.115697e+08 4.681907e+08 3.889739e+08 9.029702e+04 3.926547e+08 5.168942e+08 4.319114e+08 1.034021e+05 3.419656e+08 3.593310e+08 5.112890e+08 5.040855e+08 2.741919e+08 2.173749e+08 5.416432e+08 4.666970e+08 2.318020e+08 3.095276e+08 5.591458e+08 4.531581e+08 3.821152e+08 6.747194e+08 2.747112e+08 8.106325e+08 4.055378e+08 4.774540e+08 5.330197e+08 5.981042e+08 4.732385e+08 2.976785e+08 6.146808e+08 3.687549e+08 6.045368e+08 6.081596e+08 4.671075e+08 5.531807e+08 7.413804e+08 3.278946e+08 5.705182e+08 7.147086e+08 6.028323e+08 5.551944e+08 3.804251e+08 5.218193e+08 4.254965e+08 4.200147e+08 2.936971e+08 3.886368e+08 4.709928e+08 3.909057e+08 2.429523e+08 4.041395e+08 3.131010e+08 6.376589e+08 3.317003e+08 3.889805e+08 2.803882e+08 6.029566e+08 3.829573e+08 4.315145e+08 5.499490e+08 2.690418e+08 5.438005e+08 3.130322e+08 3.169151e+08 5.319737e+08 1.615790e+08 6.293657e+08 5.168616e+08 2.671333e+08 3.159963e+08 4.235359e+08 6.929604e+08 6.059974e+08 4.031138e+08 6.762865e+08 5.466040e+08 2.898801e+08 3.383289e+08 5.869562e+08 2.766990e+08 2.664354e+08 2.629991e+08 2.649544e+08 4.524174e+08 4.129712e+08 4.857583e+08 4.328385e+08 2.394872e+08 3.155062e+08 3.432586e+08 4.701061e+08 5.343317e+08 6.576839e+08 5.681768e+08 4.344920e+08 4.727191e+08 3.067564e+08 3.069437e+08 4.814575e+08 4.880509e+08 2.848378e+08 3.445787e+08 5.767882e+08 3.961287e+08 4.728963e+08 4.411951e+08 4.573973e+08 5.779199e+08 4.607522e+08 3.447087e+08 3.081131e+08 3.000030e+08 2.787113e+08 4.310481e+08 3.972101e+08 4.168126e+08 3.712189e+08 3.846919e+08 4.172141e+08 4.829220e+08 7.402081e+08 3.892651e+08 2.016506e+08 6.942636e+08 3.731054e+08 3.849587e+08 3.892776e+08 3.034365e+08 4.386211e+08 7.474739e+08 3.762539e+08 2.878423e+08 4.435553e+08 3.691186e+08 3.038486e+08 5.413549e+08 4.871782e+08 3.715350e+08 4.845248e+08 3.396371e+08 4.583345e+08 4.637135e+08 4.651974e+08 5.273044e+08 3.395834e+08 4.941948e+08 4.254608e+08 3.063364e+08 3.802432e+08 5.141596e+08 7.817000e+08 2.878060e+08 2.645889e+08 3.392939e+08 4.713686e+08 3.198091e+08 2.659946e+08 2.737020e+08 3.445757e+08 5.995112e+08 6.083603e+08 3.897472e+08 2.785327e+08 4.576836e+08 3.037177e+08 2.409056e+08 5.774224e+08 2.984974e+08 4.046262e+08 1.597659e+08 4.082131e+08 3.115415e+08 6.752257e+08 4.583199e+08 3.686508e+08 4.065004e+08 4.041508e+08 2.735491e+08 4.836143e+08 4.812728e+08 1.866726e+08 2.547709e+08 3.366048e+08 2.597597e+08 5.271753e+08 5.145017e+08 5.196591e+08 3.712319e+08 5.269114e+08 3.593117e+08 3.286052e+08 4.094505e+08 9.533243e+08 4.823295e+08 2.419347e+08 4.537702e+08 5.819844e+08 4.673172e+08 7.399079e+08 6.595621e+08 5.430991e+08 4.418377e+08 3.850008e+08 3.230685e+08 6.114855e+08 3.515438e+08 2.453957e+08 4.889304e+08 7.146178e+08 4.023196e+08 3.300597e+08 1.408907e+08 2.324682e+08 6.791492e+08 3.457577e+08 6.066221e+08 6.004330e+08 2.824120e+08 5.091561e+08 5.375615e+08 3.466693e+08 2.412111e+08 2.846205e+08 3.102494e+08 C33 H78 N9 O6 P3 S_4.515 2.899690e+06 3.387705e+06 3.466137e+06 3.068803e+06 1.025488e+05 1.637918e+06 3.601735e+06 3.047989e+06 107652.98 2.764323e+06 2.669381e+06 3.007139e+06 107593.49 3.190946e+06 2.589100e+06 3.206712e+06 9.646689e+04 3.265843e+06 2.980927e+06 3.006148e+06 9.277987e+04 3.006308e+06 2.496288e+06 2.485765e+06 37781.783 3.718848e+06 3.567187e+06 2.750501e+06 5.469020e+04 2.650545e+06 3.061885e+06 3.321239e+06 67162.59 2.434742e+06 2.910895e+06 2.766143e+06 7.386340e+04 3.283435e+06 2.847812e+06 3.392891e+06 5.373256e+04 3.390050e+06 2.361865e+06 2.750008e+06 6.166206e+04 3.020028e+06 3.408313e+06 2.785515e+06 4.040736e+06 3.848491e+06 1.783046e+06 3.821438e+06 2.789593e+06 5.307712e+06 3.593372e+06 2.419589e+06 3.126553e+06 4.126204e+06 2.077764e+06 2.527963e+06 3.093066e+06 3.698568e+06 2.681363e+06 2.816961e+06 3.512929e+06 2.835914e+06 2.627228e+06 3.745449e+06 4.772229e+06 3.707207e+06 3.538635e+06 4.445270e+06 2.537993e+06 4.113727e+06 2.831451e+06 3.611800e+06 2.271883e+06 3.749190e+06 1.754803e+06 3.114848e+06 2.297617e+06 2.450451e+06 3.361302e+06 2.204659e+06 3.381804e+06 3.714118e+06 4.040145e+06 3.665842e+06 2.259119e+06 3.167825e+06 3.191680e+06 3.240175e+06 4.757837e+06 2.742112e+06 3.117616e+06 3.006703e+06 2.768439e+06 2.902074e+06 3.672173e+06 3.198859e+06 4.888142e+06 3.878343e+06 2.236680e+06 2.535412e+06 3.426048e+06 3.092260e+06 4.435241e+06 3.204688e+06 5.988226e+06 2.191671e+06 3.273452e+06 2.874966e+06 3.151557e+06 2.792749e+06 2.718756e+06 3.958780e+06 2.311818e+06 5.478944e+06 4.534125e+06 2.916251e+06 3.686911e+06 3.078279e+06 3.715765e+06 2.538696e+06 2.640748e+06 2.650298e+06 2.444482e+06 2.872629e+06 2.396948e+06 2.261478e+06 2.364044e+06 2.188878e+06 2.611053e+06 5.794844e+06 3.357558e+06 2.779516e+06 2.326226e+06 2.568670e+06 3.025895e+06 5.252818e+06 3.455905e+06 2.193682e+06 3.286955e+06 4.478834e+06 2.312731e+06 3.209561e+06 3.646731e+06 2.731224e+06 2.143621e+06 4.262661e+06 3.063945e+06 3.256425e+06 3.986962e+06 4.773470e+06 2.837096e+06 2.309334e+06 4.496346e+06 3.018743e+06 3.834497e+06 3.368957e+06 3.068164e+06 3.204124e+06 4.248099e+06 2.354307e+06 4.394108e+06 2.346142e+06 3.724503e+06 2.368326e+06 3.459233e+06 2.450584e+06 2.869237e+06 2.573496e+06 3.448448e+06 3.343862e+06 3.756355e+06 2.826847e+06 2.439053e+06 3.668433e+06 2.398113e+06 2.260381e+06 4.410043e+06 2.718630e+06 2.844388e+06 3.142578e+06 3.706621e+06 3.903136e+06 2.507861e+06 3.394218e+06 8.407770e+06 3.924128e+06 2.930011e+06 4.070429e+06 2.731898e+06 2.362351e+06 4.029529e+06 3.081527e+06 2.752039e+06 2.085755e+06 2.751382e+06 4.562875e+06 3.211455e+06 5.505914e+06 2.835731e+06 3.297411e+06 3.001663e+06 1.711050e+06 4.595815e+06 3.730892e+06 4.579729e+06 2.709011e+06 3.579780e+06 3.164941e+06 2.335814e+06 3.497070e+06 4.749369e+06 4.020926e+06 4.515161e+06 2.766836e+06 2.800537e+06 3.444356e+06 4.189400e+06 2.706666e+06 4.759950e+06 4.386629e+06 3.773298e+06 3.531943e+06 2.543534e+06 2.933839e+06 2.391231e+06 2.129961e+06 1.990288e+06 4.554684e+06 3.378301e+06 3.281810e+06 2.386070e+06 3.335729e+06 3.304230e+06 4.182060e+06 2.851663e+06 2.430060e+06 2.551430e+06 4.071310e+06 2.136183e+06 4.075926e+06 3.899305e+06 3.001531e+06 2.933883e+06 3.128793e+06 2.412955e+06 2.485725e+06 2.586647e+06 2.553338e+06 3.673019e+06 2.882644e+06 2.772014e+06 1.660447e+06 3.188866e+06 4.198402e+06 2.597612e+06 2.621799e+06 4.490075e+06 3.053006e+06 "PC(P-16:0/20:3(5Z,8Z,11Z))_4.517" 4.740912e+07 3.977583e+07 4.520362e+07 4.011153e+07 1.377656e+05 3.248974e+07 3.705070e+07 3.649759e+07 119460.56 4.581249e+07 3.530406e+07 4.382527e+07 110884.18 3.975264e+07 3.730776e+07 4.616983e+07 1.080060e+05 4.196173e+07 3.415748e+07 3.510234e+07 1.187178e+05 3.413656e+07 5.007707e+07 3.417147e+07 46126.707 3.563627e+07 4.375053e+07 4.388451e+07 6.063694e+04 4.013377e+07 3.482441e+07 4.229434e+07 72577.20 3.650703e+07 4.403655e+07 3.436490e+07 8.511520e+04 3.751859e+07 4.666715e+07 3.553059e+07 6.177795e+04 3.500822e+07 4.280001e+07 4.212845e+07 6.459617e+04 4.099771e+07 3.749955e+07 3.886709e+07 4.490235e+07 4.050487e+07 2.670436e+07 6.472158e+07 3.048291e+07 3.400338e+07 3.811861e+07 4.934091e+07 3.181050e+07 4.743536e+07 3.929926e+07 3.165802e+07 4.031752e+07 7.199224e+07 5.477538e+07 5.853802e+07 4.482991e+07 4.381460e+07 3.196446e+07 3.597027e+07 5.310262e+07 4.483231e+07 4.622434e+07 5.485813e+07 5.188896e+07 3.971118e+07 4.015698e+07 3.799229e+07 3.294959e+07 6.000129e+07 3.334392e+07 3.976076e+07 2.861022e+07 3.027194e+07 2.382213e+07 3.426359e+07 3.105361e+07 3.641584e+07 6.055328e+07 2.548669e+07 2.373716e+07 3.568527e+07 3.228637e+07 5.213367e+07 4.414795e+07 2.967349e+07 2.825892e+07 2.752489e+07 4.130315e+07 3.640535e+07 3.752895e+07 2.178561e+07 4.061705e+07 4.474627e+07 2.238159e+07 3.001521e+07 3.493052e+07 3.617782e+07 3.166897e+07 2.436522e+07 4.858227e+07 3.604631e+07 2.684982e+07 3.889683e+07 4.652591e+07 3.502263e+07 4.178790e+07 4.569681e+07 2.765315e+07 5.601189e+07 3.095351e+07 3.830257e+07 3.447612e+07 2.847063e+07 1.663713e+07 3.807536e+07 3.717167e+07 2.542672e+07 4.380075e+07 3.569702e+07 3.440370e+07 2.737806e+07 3.041171e+07 6.391386e+07 2.314854e+07 7.080689e+07 3.375339e+07 2.946367e+07 2.794426e+07 2.941315e+07 2.834690e+07 5.034906e+07 4.659340e+07 2.537893e+07 4.389126e+07 3.237649e+07 6.005212e+07 3.019213e+07 3.594016e+07 3.223231e+07 2.821573e+07 2.267719e+07 4.128111e+07 2.934196e+07 4.129802e+07 3.227306e+07 5.434740e+07 4.326721e+07 5.283204e+07 2.376995e+07 4.206991e+07 4.518007e+07 2.886124e+07 3.913308e+07 4.936651e+07 3.231483e+07 5.266461e+07 3.903774e+07 3.606824e+07 3.359074e+07 4.726272e+07 3.481006e+07 3.423068e+07 3.971776e+07 3.641444e+07 3.706926e+07 3.579484e+07 2.800469e+07 4.578276e+07 4.099199e+07 3.463071e+07 3.557180e+07 3.171488e+07 4.266903e+07 3.672542e+07 2.820606e+07 3.259382e+07 4.129140e+07 3.392314e+07 3.471909e+07 1.237328e+08 4.762563e+07 3.646298e+07 3.236556e+07 3.746867e+07 3.126827e+07 3.002165e+07 2.329480e+07 3.854016e+07 3.762539e+07 3.236048e+07 4.448446e+07 2.571297e+07 3.944135e+07 2.844153e+07 2.322660e+07 3.440315e+07 2.989450e+07 2.402556e+07 2.769497e+07 4.402132e+07 3.579975e+07 3.444944e+07 3.607260e+07 3.694342e+07 2.899765e+07 5.920294e+07 2.675503e+07 3.138624e+07 3.747846e+07 2.528376e+07 3.663957e+07 4.163296e+07 2.757625e+07 4.358919e+07 4.434371e+07 3.227754e+07 2.731331e+07 3.019592e+07 3.793122e+07 3.896520e+07 4.300548e+07 2.245246e+07 3.395240e+07 3.216099e+07 4.217073e+07 2.347293e+07 3.101555e+07 4.834683e+07 4.695389e+07 3.902888e+07 5.584052e+07 3.870623e+07 5.923550e+07 3.968215e+07 5.059756e+07 3.052087e+07 2.606750e+07 3.040740e+07 4.032801e+07 2.895036e+07 3.471544e+07 3.104461e+07 2.241302e+07 4.460739e+07 6.499369e+07 4.919134e+07 2.058015e+07 4.890322e+07 3.264486e+07 4.078131e+07 3.775444e+07 4.813447e+07 5.876357e+07 "1-pentadecanoyl-2-[(5Z,8Z,11Z,14Z)-eicosatetraenoyl]-sn-glycero-3-phosphocholine_4.517" 3.173605e+06 2.195925e+06 2.357007e+06 2.130677e+06 8.700247e+04 1.895445e+06 1.876171e+06 2.319523e+06 88171.14 2.228687e+06 1.943410e+06 2.193038e+06 90293.94 2.302216e+06 2.140574e+06 2.108750e+06 9.048183e+04 2.075903e+06 2.466187e+06 1.400529e+06 9.024439e+04 2.078671e+06 2.523036e+06 2.509527e+06 35032.400 1.722139e+06 2.191565e+06 2.412867e+06 4.718797e+04 1.904124e+06 2.037070e+06 2.273038e+06 55402.48 2.271632e+06 1.922947e+06 1.900629e+06 6.279197e+04 2.014115e+06 2.109396e+06 2.792531e+06 4.532879e+04 2.305521e+06 1.862348e+06 1.677251e+06 5.615312e+04 2.576054e+06 1.351113e+06 2.695886e+06 2.553471e+06 1.221214e+06 1.035437e+06 1.767311e+06 2.450332e+06 1.824503e+06 2.804868e+06 2.553062e+06 1.193743e+06 2.305480e+06 3.535714e+06 1.569290e+06 3.294856e+06 7.497731e+05 2.373194e+06 1.733320e+06 2.505513e+06 2.795650e+06 2.479296e+06 2.722184e+06 1.545251e+06 2.408702e+06 1.233776e+06 2.450083e+06 2.368096e+06 2.118118e+06 1.193708e+06 2.267144e+06 2.924736e+06 1.889774e+06 2.854218e+06 1.773491e+06 2.176537e+06 1.724907e+06 9.664250e+05 2.443759e+06 2.595842e+06 2.648144e+06 3.310908e+06 1.648260e+06 2.246067e+06 1.753919e+06 1.576381e+06 2.798210e+06 1.588082e+06 1.460227e+06 2.538129e+06 1.840936e+06 1.267224e+06 2.145581e+06 2.648724e+06 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3.943718e+06 4.978762e+06 3.839846e+06 4.285992e+06 3.802455e+06 3.601607e+06 4.082075e+06 4.145259e+06 4.015502e+06 3.330842e+06 4.123229e+06 3.535998e+06 2.997019e+06 3.483173e+06 3.332396e+06 3.303736e+06 4.157000e+06 2.663502e+06 3.308368e+06 2.662984e+06 3.112727e+06 3.577269e+06 4.847171e+06 3.659090e+06 4.332647e+06 2.312431e+06 4.275336e+06 3.127720e+06 C40 H79 N9 O5 S_4.524 2.855244e+06 1.805923e+06 1.722625e+06 1.747522e+06 1.146994e+05 1.425785e+06 1.650447e+06 1.792309e+06 106378.77 1.848933e+06 1.644221e+06 1.673321e+06 106578.27 1.759324e+06 1.578640e+06 1.851431e+06 1.008854e+05 1.496040e+06 1.737286e+06 1.812975e+06 9.956638e+04 1.617141e+06 1.843272e+06 1.663220e+06 41220.645 1.543328e+06 1.851486e+06 1.625202e+06 5.961208e+04 1.707378e+06 1.649361e+06 1.730785e+06 71353.11 1.718453e+06 1.717206e+06 1.829477e+06 8.615208e+04 1.394229e+06 1.816565e+06 1.783975e+06 5.672903e+04 1.559719e+06 1.637522e+06 1.867989e+06 5.817934e+04 1.736584e+06 1.710632e+06 1.611321e+06 2.630521e+06 1.014563e+06 1.358598e+06 2.381835e+06 1.663107e+06 2.080047e+06 2.135210e+06 1.741614e+06 9.498904e+05 1.355167e+06 2.343145e+06 2.060203e+06 4.038541e+06 2.736342e+06 1.604946e+06 1.725283e+06 1.933004e+06 1.578608e+06 1.280482e+06 2.197875e+06 1.264020e+06 1.094806e+06 2.108944e+06 1.897137e+06 2.169954e+06 1.384583e+06 1.601140e+06 1.388789e+06 2.207116e+06 1.818007e+06 1.895659e+06 1.162096e+06 1.047672e+06 1.286186e+06 1.408555e+06 1.913726e+06 1.486690e+06 7.653632e+05 1.884430e+06 9.102191e+05 1.863824e+06 1.318050e+06 1.051867e+06 1.574680e+06 1.354774e+06 1.390272e+06 1.213705e+06 1.248952e+06 1.052436e+06 2.365010e+06 1.851524e+06 1.806237e+06 2.174033e+06 1.608941e+06 1.055828e+06 1.216416e+06 1.045077e+06 9.101213e+05 1.415496e+06 1.025254e+06 1.734537e+06 1.451092e+06 1.548290e+06 2.441645e+06 2.560012e+06 9.811040e+05 9.908436e+05 1.378196e+06 1.313585e+06 1.066295e+06 2.588395e+06 1.747820e+06 1.106277e+06 8.304476e+05 3.875961e+05 1.542139e+06 1.244182e+06 1.627886e+06 1.434708e+06 9.543768e+05 1.379824e+06 1.618129e+06 1.289530e+06 1.915715e+06 9.136032e+05 1.609821e+06 1.714578e+06 1.938496e+06 1.771561e+06 1.729232e+06 1.014391e+06 1.088951e+06 1.460752e+06 2.050471e+06 2.161389e+06 1.259660e+06 2.396910e+06 2.399472e+06 1.533456e+06 2.960251e+06 1.901967e+06 1.288724e+06 1.404214e+06 1.213494e+06 1.635571e+06 2.386239e+06 1.944950e+06 2.201516e+06 1.764359e+06 8.290614e+05 1.672670e+06 1.537823e+06 1.592936e+06 1.406153e+06 1.127371e+06 1.726603e+06 1.502997e+06 1.470030e+06 1.488675e+06 1.680431e+06 1.250384e+06 1.501745e+06 1.921261e+06 1.684119e+06 1.591327e+06 1.771519e+06 1.352522e+06 1.702976e+06 2.073997e+06 1.321223e+06 1.143785e+06 2.126545e+06 9.639732e+05 1.492285e+06 1.567500e+06 1.216432e+06 1.042584e+06 1.872381e+06 9.993903e+05 1.868093e+06 1.487114e+06 1.452752e+06 1.884087e+06 2.782167e+06 1.711336e+06 1.767275e+06 9.767643e+05 3.500746e+06 2.222589e+06 2.830197e+06 1.297161e+06 2.741711e+06 8.314722e+05 1.230530e+06 2.086112e+06 1.768539e+06 1.827834e+06 1.717677e+06 1.194686e+06 1.086740e+06 1.167021e+06 2.035115e+06 2.659357e+06 1.122382e+06 1.749336e+06 1.610841e+06 1.386033e+06 1.413105e+06 1.692585e+06 1.714888e+06 1.225638e+06 1.773370e+06 2.611110e+06 1.380619e+06 1.492549e+06 2.027329e+06 1.237498e+06 1.604605e+06 1.503053e+06 1.801432e+06 2.610846e+06 1.661277e+06 1.100117e+06 1.004318e+06 8.446799e+05 2.033899e+06 1.104753e+06 1.242837e+06 2.120061e+06 1.710745e+06 1.361411e+06 2.014469e+06 2.042239e+06 2.008047e+06 1.882927e+06 2.424750e+06 1.316694e+06 1.303689e+06 1.283280e+06 2.508665e+06 1.511163e+06 1.798106e+06 1.093843e+06 1.333326e+06 1.993254e+06 2.504198e+06 1.318978e+06 2.616337e+06 1.220966e+06 1.662575e+06 2.468855e+06 1.653222e+06 1.548767e+06 1.888743e+06 "1-(1Z-hexadecenyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine_4.527" 1.715215e+07 1.778802e+07 1.950531e+07 1.789385e+07 1.567113e+05 1.342851e+07 1.866958e+07 1.818890e+07 112161.31 1.782037e+07 1.674497e+07 1.892254e+07 112782.35 1.713075e+07 1.508171e+07 1.922982e+07 1.500767e+05 1.656694e+07 1.770611e+07 1.847277e+07 1.052777e+05 1.688587e+07 1.853992e+07 1.828775e+07 45910.948 1.724170e+07 2.038909e+07 8.984543e+06 7.026815e+04 1.909550e+07 1.631461e+07 2.021356e+07 73889.42 1.856244e+07 1.776486e+07 1.796618e+07 8.483874e+04 1.582922e+07 1.820947e+07 1.944258e+07 5.818346e+04 1.496549e+07 1.769327e+07 1.933485e+07 6.197580e+04 1.645350e+07 1.614143e+07 1.841706e+07 2.292361e+07 1.585581e+07 1.167093e+07 2.705968e+07 1.311179e+07 1.457466e+07 2.107225e+07 2.200340e+07 1.681596e+07 1.394285e+07 1.898623e+07 2.121928e+07 1.835665e+07 2.954464e+07 2.354110e+07 2.369004e+07 1.691109e+07 1.823387e+07 1.596750e+07 1.292477e+07 1.720577e+07 1.825436e+07 2.024550e+07 1.857802e+07 1.814611e+07 9.782700e+06 2.796558e+07 1.963371e+07 1.673710e+07 1.473308e+07 1.532962e+07 1.715265e+07 1.223185e+07 1.153473e+07 1.234489e+07 1.837129e+07 1.600399e+07 1.641684e+07 4.257329e+07 1.463978e+07 1.212638e+07 1.724949e+07 1.796073e+07 2.097175e+07 2.236850e+07 1.233409e+07 1.736042e+07 1.514783e+07 1.394592e+07 1.379696e+07 1.684740e+07 1.363592e+07 1.417924e+07 2.857157e+07 1.385745e+07 1.592930e+07 1.750948e+07 1.917830e+07 1.697192e+07 1.800406e+07 1.227888e+07 2.028295e+07 1.921441e+07 1.429023e+07 1.760148e+07 1.695321e+07 1.927420e+07 2.409030e+07 1.498617e+07 2.189669e+07 2.357198e+07 1.459463e+07 1.503721e+07 2.239013e+07 1.146789e+07 2.901129e+07 2.307061e+07 1.796571e+07 1.854837e+07 1.792235e+07 1.364776e+07 1.145373e+07 2.090527e+07 3.050955e+07 2.036536e+07 2.910805e+07 1.601050e+07 2.200567e+07 1.540851e+07 2.688525e+07 2.088803e+07 2.379548e+07 1.795229e+07 1.087596e+07 1.739605e+07 1.790068e+07 2.135051e+07 2.218051e+07 1.313435e+07 2.294925e+07 1.638256e+07 1.468624e+07 1.865174e+07 1.722016e+07 2.079628e+07 1.623550e+07 2.254655e+07 1.832028e+07 2.053297e+07 1.285871e+07 1.661822e+07 1.995311e+07 1.224710e+07 1.757356e+07 2.388270e+07 1.107334e+07 2.546493e+07 1.643738e+07 3.149798e+07 1.427917e+07 1.365595e+07 1.560318e+07 2.469605e+07 1.496587e+07 1.573614e+07 1.564902e+07 1.331129e+07 1.452839e+07 1.869175e+07 1.537780e+07 1.339011e+07 1.245654e+07 1.485491e+07 2.358619e+07 1.234033e+07 1.114001e+07 1.451287e+07 1.497939e+07 1.851402e+07 1.046355e+07 2.389600e+07 2.372028e+07 1.725569e+07 2.284539e+07 1.795199e+07 1.751264e+07 1.111044e+07 1.549325e+07 1.197515e+07 1.326382e+07 1.568410e+07 1.861120e+07 8.975973e+06 1.475550e+07 1.255588e+07 1.552979e+07 1.596848e+07 8.282302e+06 1.982536e+07 1.482868e+07 1.598668e+07 1.615478e+07 1.610013e+07 1.489714e+07 1.151394e+07 1.345300e+07 1.437845e+07 1.592228e+07 1.268090e+07 1.719998e+07 9.804405e+06 2.142513e+07 1.883307e+07 1.658327e+07 1.956398e+07 1.618256e+07 1.774274e+07 1.877136e+07 1.568131e+07 2.127269e+07 1.748259e+07 1.695699e+07 5.745143e+06 1.847687e+07 1.951676e+07 1.891365e+07 1.274262e+07 2.085944e+07 2.913054e+07 1.998971e+07 1.188086e+07 1.703613e+07 1.221872e+07 2.546049e+07 1.686464e+07 1.427212e+07 9.782068e+06 9.701567e+06 1.503860e+07 2.082775e+07 1.209888e+07 1.441796e+07 9.736970e+06 1.343760e+07 1.972302e+07 1.730308e+07 2.625584e+07 1.540038e+07 1.886354e+07 1.259801e+07 2.278908e+07 1.389196e+07 3.480884e+07 2.184285e+07 "1-hexadecyl-2-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphocholine (2)_4.527" 5.081310e+05 1.068766e+06 1.062591e+06 1.018736e+06 4.074647e+04 3.714646e+05 8.179559e+05 8.522323e+05 36594.06 1.346111e+06 9.540742e+05 1.055883e+06 36897.10 8.070776e+05 4.786342e+05 6.187556e+05 4.262438e+04 1.402187e+06 8.803814e+05 9.197718e+05 4.024739e+04 1.035404e+06 6.589832e+05 8.786102e+05 16081.047 1.299416e+06 6.364580e+05 8.991997e+05 2.198749e+04 1.014216e+06 7.682732e+05 1.183168e+06 22412.04 1.062254e+06 7.739761e+05 7.536934e+05 3.715262e+04 8.522906e+05 1.322203e+06 9.743410e+05 2.711778e+04 1.097433e+06 6.318060e+05 1.009858e+06 2.512763e+04 8.713288e+05 1.016249e+06 8.906378e+05 1.083702e+06 1.280356e+06 8.348819e+05 2.975550e+06 9.407032e+05 7.346009e+05 9.537464e+05 1.281446e+06 6.334047e+05 9.101417e+05 8.776078e+05 5.610305e+05 1.634517e+06 1.924223e+06 1.996739e+06 1.723345e+06 1.284097e+06 1.133086e+06 9.270109e+05 6.064444e+05 1.254885e+06 1.008199e+06 5.177242e+05 1.225474e+06 8.549099e+05 6.497290e+05 1.295116e+06 7.330189e+05 1.185415e+06 1.059581e+06 1.788610e+06 1.366453e+06 9.134963e+05 9.158394e+05 5.913596e+05 1.173746e+06 1.003715e+06 1.276846e+06 1.059921e+06 8.781794e+05 3.936099e+05 4.524094e+05 8.988720e+05 7.558179e+05 8.881629e+05 7.052015e+05 9.088245e+05 9.921103e+05 9.627671e+05 1.175708e+06 1.025887e+06 9.918794e+05 8.898487e+05 1.636469e+06 5.543553e+05 6.458374e+05 1.825997e+06 9.070236e+05 7.343483e+05 6.046905e+05 6.876062e+05 8.789340e+05 7.824864e+05 6.943975e+05 1.130068e+06 1.823168e+06 1.507927e+06 1.459753e+06 6.847624e+05 1.241187e+06 1.283942e+06 1.411118e+06 4.933826e+05 1.111008e+05 5.631209e+05 5.003490e+05 1.164662e+06 1.287981e+06 7.316389e+05 9.175164e+05 4.909251e+05 3.169876e+05 8.222055e+05 1.201024e+06 1.535574e+06 1.346106e+06 1.107457e+06 7.045216e+05 6.223021e+05 1.129887e+06 1.117339e+06 1.266616e+06 8.592368e+05 5.865761e+05 9.903798e+05 6.051471e+05 1.522558e+06 1.433561e+06 6.868010e+05 8.925431e+05 5.651173e+05 4.594295e+05 9.587438e+05 6.915065e+05 1.362623e+06 5.932235e+05 9.390071e+05 9.587183e+05 1.548594e+06 6.673041e+05 8.074842e+05 6.135186e+05 5.065991e+05 1.165507e+06 1.364389e+06 6.675324e+05 1.631558e+06 8.124014e+05 2.074412e+06 8.894931e+05 1.027574e+06 1.309560e+06 4.523464e+05 4.323275e+05 6.484216e+05 7.446991e+05 5.705943e+05 3.255779e+05 1.106617e+06 1.210447e+06 7.779891e+05 6.885848e+05 9.225826e+05 1.048540e+06 1.119990e+06 2.329336e+05 5.823653e+05 1.322331e+06 9.119245e+05 7.766682e+05 8.820721e+05 1.895121e+06 9.872168e+05 8.356350e+05 1.398515e+06 1.162385e+06 7.381387e+05 4.321315e+05 7.402949e+05 8.188072e+05 8.825057e+05 4.962986e+05 3.146177e+05 5.371383e+05 7.166347e+05 1.175847e+06 4.611651e+05 4.688077e+05 1.251543e+06 6.116388e+05 6.512807e+05 6.045646e+05 1.320592e+06 7.698287e+05 1.129806e+06 4.691045e+05 1.173909e+06 3.859516e+05 6.639706e+05 7.929353e+05 5.379079e+05 1.045863e+06 6.881314e+05 1.034448e+06 1.564436e+06 8.381766e+05 5.107418e+05 8.747719e+05 2.359284e+06 1.078669e+06 6.012474e+05 1.088613e+06 3.003136e+05 9.973323e+05 9.636583e+05 1.418965e+06 4.996175e+05 1.818801e+06 1.218368e+06 1.125372e+06 9.458562e+05 6.408902e+05 3.915712e+05 8.741244e+05 6.170753e+05 8.795628e+05 8.400084e+05 6.676254e+05 4.718904e+05 9.388681e+05 7.502397e+05 4.908863e+05 4.376763e+05 5.280236e+05 1.013188e+06 1.888131e+06 1.588815e+06 4.907106e+05 7.087138e+05 1.641967e+06 2.126462e+06 9.597093e+05 5.405812e+05 1.430916e+06 769.59134_4.528 8.063228e+05 7.823613e+05 7.165076e+05 8.395216e+05 5.862762e+04 2.251067e+05 3.524985e+05 5.714627e+05 58077.86 4.737117e+05 8.037593e+05 5.859940e+05 41421.76 6.434741e+05 4.860079e+05 5.919410e+05 3.781587e+04 7.570753e+05 5.314204e+05 7.830880e+05 3.845966e+04 5.816809e+05 6.488159e+05 2.548671e+05 19636.485 2.595802e+05 2.796789e+05 1.425298e+06 2.413949e+04 3.353962e+05 5.894701e+05 8.527708e+05 22802.66 3.071684e+05 4.979225e+05 5.363704e+05 2.927923e+04 1.263932e+06 6.993218e+05 2.301689e+05 3.351614e+04 2.228198e+05 5.178938e+05 4.135558e+05 4.058038e+04 8.876191e+05 1.157907e+06 2.068086e+05 8.822266e+05 6.678850e+05 5.227659e+05 1.533167e+06 7.664323e+05 1.051841e+06 1.599834e+06 5.514423e+05 6.293294e+05 1.438558e+06 2.626138e+06 1.319672e+06 5.012006e+05 6.443236e+05 2.205462e+06 1.536235e+06 2.140093e+06 1.916869e+05 6.677133e+05 8.203837e+05 2.549352e+06 1.402171e+06 7.662220e+05 1.036078e+06 6.218164e+05 2.649670e+05 9.682143e+05 1.881378e+06 5.818841e+05 1.359193e+06 2.092620e+06 9.743617e+05 1.477069e+06 1.344743e+06 5.787630e+05 1.621392e+05 1.624032e+06 2.101614e+05 2.752424e+06 7.829309e+05 7.488534e+05 3.271435e+05 8.795561e+05 5.368533e+05 2.014527e+06 1.004820e+05 2.092448e+06 9.790798e+05 2.257970e+05 2.008778e+06 8.244074e+05 1.288831e+06 1.090444e+06 1.959609e+05 4.010911e+05 4.698350e+05 8.528828e+05 1.490987e+06 6.225241e+05 9.477848e+04 2.131351e+06 3.842476e+05 1.011528e+06 2.008005e+06 1.535233e+06 2.190338e+05 7.841297e+05 1.444285e+06 6.181347e+05 1.285326e+06 1.711129e+06 4.961693e+05 6.747938e+05 3.430750e+05 5.168635e+05 1.436819e+05 1.695919e+06 1.947187e+05 1.912362e+06 8.344542e+05 2.882582e+05 1.401151e+06 9.774164e+05 1.686289e+06 1.278294e+06 1.665116e+06 1.095935e+06 1.559875e+06 5.410885e+05 1.277012e+06 2.424097e+05 7.665239e+05 2.003089e+06 1.064152e+06 8.528272e+05 6.364184e+05 4.357727e+05 2.644810e+06 3.320596e+05 2.759650e+05 2.577550e+05 6.077179e+05 2.237674e+05 2.962976e+05 2.258708e+05 1.353499e+06 3.059713e+05 2.153593e+06 1.015287e+06 3.586551e+05 2.208715e+05 2.028177e+06 4.719330e+05 1.043278e+06 3.248107e+05 6.525726e+05 1.961854e+06 1.562047e+05 1.253169e+06 1.303148e+06 1.407538e+06 1.710074e+05 5.457231e+05 5.193528e+05 1.310028e+06 8.132648e+05 1.556760e+06 1.140377e+06 1.436237e+06 1.064898e+06 1.026025e+06 1.349239e+06 5.832631e+05 5.719041e+05 1.952652e+05 1.009347e+06 4.729409e+05 2.430669e+05 2.005357e+05 1.002297e+06 4.937633e+06 5.639135e+05 2.638689e+05 1.723204e+05 1.750628e+05 1.316631e+06 1.612014e+05 7.982057e+04 9.185893e+05 4.549887e+05 9.629374e+05 8.606793e+05 8.676004e+05 1.263724e+06 1.496544e+06 2.867657e+05 6.999057e+05 3.120823e+05 1.446511e+05 8.058207e+05 8.196431e+05 3.382414e+05 1.122717e+06 1.997712e+06 7.560218e+05 3.711778e+05 4.783585e+06 1.142745e+05 2.726689e+05 1.291138e+06 1.214901e+06 1.704894e+06 1.817635e+06 3.557640e+05 7.788567e+05 1.316675e+06 1.398845e+05 2.284834e+05 1.780352e+05 5.042222e+05 1.428226e+05 6.829021e+05 6.347904e+05 8.751152e+05 1.478705e+05 1.228904e+06 9.116194e+05 6.335022e+05 2.996581e+06 2.515996e+06 1.013060e+06 6.671276e+05 8.790603e+05 5.235684e+05 1.163112e+06 4.878581e+05 1.354852e+06 7.488608e+05 1.844064e+06 6.838026e+05 8.210400e+05 2.653518e+05 3.362447e+05 5.178238e+05 1.824341e+06 4.558682e+06 6.466931e+05 1.068133e+06 2.264378e+06 8.108969e+05 9.604656e+04 3.959868e+05 1.183400e+05 1.257722e+06 814.62853_4.53 1.329019e+06 9.130444e+05 6.131196e+05 9.477726e+05 1.204032e+05 6.317864e+05 7.094617e+05 8.910768e+05 116949.41 6.189200e+05 6.931841e+05 6.937885e+05 111276.99 1.029834e+06 6.298356e+05 6.306536e+05 1.021087e+05 7.939013e+05 1.099307e+06 7.763837e+05 1.157277e+05 9.194098e+05 4.484846e+05 2.298434e+05 54916.854 9.120669e+05 9.917580e+05 1.015319e+06 6.527956e+04 6.480357e+05 6.676658e+05 8.418083e+05 71308.13 6.838723e+05 8.000927e+05 7.293685e+05 9.347753e+04 7.795861e+05 8.646215e+05 7.923851e+05 6.046040e+04 7.328695e+05 6.887643e+05 8.473527e+05 6.595976e+04 6.749186e+05 6.814145e+05 8.701305e+05 7.903659e+05 1.473230e+06 1.486041e+06 8.698008e+05 4.940832e+05 4.695738e+05 6.455434e+05 7.204422e+05 6.034590e+05 2.136332e+05 1.084641e+06 9.658519e+05 7.412355e+05 1.218896e+06 7.483029e+05 6.122267e+05 7.195864e+05 4.642775e+05 5.467745e+05 4.287665e+05 5.329218e+05 4.309639e+05 6.702213e+05 9.024688e+05 8.031421e+05 7.376506e+05 5.454127e+05 5.877005e+05 5.063631e+05 1.480652e+06 6.121226e+05 4.113835e+05 7.125058e+05 9.776857e+05 6.226790e+05 6.845241e+05 5.530725e+05 5.583684e+05 5.985916e+05 7.474391e+05 4.782695e+05 6.023834e+05 7.688480e+05 5.965009e+05 7.217906e+05 8.052566e+05 6.737909e+05 8.863122e+05 1.398872e+06 2.803264e+05 6.960367e+05 7.605790e+05 4.509860e+05 1.185614e+06 1.413546e+06 6.804882e+05 5.793168e+05 5.977359e+05 9.582359e+05 8.345639e+05 8.792361e+05 7.856794e+05 7.709099e+05 9.750409e+05 5.530134e+05 9.991602e+05 3.474619e+05 2.742505e+05 7.267909e+05 3.860453e+05 5.224121e+05 1.050426e+06 8.157209e+05 6.225238e+05 4.967245e+05 7.934679e+05 6.357115e+05 1.304190e+06 1.408290e+06 7.389835e+05 5.352891e+05 5.381082e+05 7.919138e+05 1.068787e+06 1.051671e+06 6.164219e+05 6.392356e+05 6.855129e+05 6.276249e+05 8.859203e+05 9.941173e+05 6.585573e+05 1.209256e+06 7.132321e+05 5.550185e+05 3.357569e+05 9.715728e+05 4.516904e+05 2.657500e+05 9.709973e+05 6.761479e+05 2.860188e+05 7.288388e+05 6.937337e+05 5.840331e+05 9.188042e+05 4.622288e+05 2.862703e+05 8.472729e+05 5.994379e+05 7.287810e+05 5.949299e+05 7.187742e+05 4.701713e+05 9.143179e+05 5.602787e+05 5.946721e+05 4.064060e+05 1.267880e+06 7.260554e+05 4.835028e+05 1.193315e+06 6.022440e+05 4.868690e+05 4.465441e+05 8.670751e+05 6.032766e+05 6.610357e+05 1.033632e+06 4.777638e+05 6.247054e+05 4.602317e+05 3.579260e+05 6.852053e+05 5.119368e+05 5.925517e+05 5.611714e+05 7.940671e+05 1.003438e+06 6.358983e+05 8.805375e+05 1.025101e+06 8.236034e+05 6.364922e+05 7.523829e+05 8.985011e+05 6.422661e+05 8.453574e+05 1.155638e+06 5.539307e+05 4.155220e+05 7.218097e+05 2.119451e+05 5.739662e+05 8.822257e+05 6.722094e+05 8.769164e+05 7.220123e+05 6.983250e+05 8.868674e+05 2.492664e+05 6.130649e+05 6.434781e+05 4.754356e+05 8.137327e+05 7.618059e+05 9.629229e+05 7.809813e+05 4.620113e+05 7.482716e+05 4.221471e+05 7.892309e+05 5.997068e+05 4.070184e+05 6.819698e+05 8.363008e+05 3.506238e+05 5.877035e+05 6.291335e+05 8.341568e+05 7.587956e+05 1.227899e+06 1.472251e+05 5.656922e+05 8.271953e+05 1.028481e+06 5.565562e+05 5.812575e+05 1.266079e+06 4.073781e+05 7.927581e+05 7.709750e+05 7.744462e+05 1.392036e+06 3.450114e+05 8.854043e+05 7.449061e+05 4.751859e+05 5.848928e+05 8.805837e+05 4.176072e+05 1.051751e+06 6.328813e+05 6.204022e+05 1.034984e+06 1.943804e+06 7.172770e+05 4.873275e+05 8.585121e+05 9.227562e+05 5.872990e+05 8.821523e+05 1.256281e+06 1.086556e+06 C40 H73 N9 O4 P2 S_4.533 1.877146e+07 1.736113e+07 1.715075e+07 1.949494e+07 1.323680e+05 1.560406e+07 1.854181e+07 1.878243e+07 115420.16 1.907189e+07 1.592840e+07 1.651762e+07 105352.45 1.814772e+07 1.718510e+07 1.839543e+07 1.027893e+05 1.812865e+07 1.741352e+07 1.735004e+07 1.034594e+05 2.101371e+07 1.627129e+07 1.489757e+07 42898.858 1.771745e+07 1.956887e+07 1.826045e+07 5.660885e+04 1.711479e+07 1.647783e+07 1.660541e+07 53618.31 1.952264e+07 1.762816e+07 1.808570e+07 8.473015e+04 1.919348e+07 1.783612e+07 1.450989e+07 5.810425e+04 1.931586e+07 1.524916e+07 1.965664e+07 6.699446e+04 1.909593e+07 1.811434e+07 1.649001e+07 2.173793e+07 1.839678e+07 2.409568e+07 1.417314e+07 1.703040e+07 1.897949e+07 1.548087e+07 1.297220e+07 1.619545e+07 1.662995e+07 9.343212e+06 1.568761e+07 1.791099e+07 1.528010e+07 1.240292e+07 1.589000e+07 1.609993e+07 1.806666e+07 1.953772e+07 1.881420e+07 1.914468e+07 1.654116e+07 1.512498e+07 1.585374e+07 1.576749e+07 2.163848e+07 1.956857e+07 1.644323e+07 1.656349e+07 8.233689e+06 1.039636e+07 1.578094e+07 1.359881e+07 1.609828e+07 2.613223e+07 1.344480e+07 1.964244e+07 1.738973e+07 1.748287e+07 1.997727e+07 2.220569e+07 2.580533e+07 1.240672e+07 2.241008e+07 1.913098e+07 2.149687e+07 1.516417e+07 1.867169e+07 1.745718e+07 2.245835e+07 1.921515e+07 1.894891e+07 1.493220e+07 1.586729e+07 2.142269e+07 6.197247e+06 1.505258e+07 1.065004e+07 1.773646e+07 1.519903e+07 2.185108e+07 1.729598e+07 1.773583e+07 2.448065e+07 1.550107e+07 1.382383e+07 1.941194e+07 2.106201e+07 1.808775e+07 2.148066e+07 1.765813e+07 1.589790e+07 2.094841e+07 1.636004e+07 1.966540e+07 1.364832e+07 1.717758e+07 1.849529e+07 1.631175e+07 1.915359e+07 2.061454e+07 2.162015e+07 1.350615e+07 1.256067e+07 1.701952e+07 1.661453e+07 1.913602e+07 2.085476e+07 1.868428e+07 1.888244e+07 2.140311e+07 2.310761e+07 1.790767e+07 1.485489e+07 1.402895e+07 2.077615e+07 1.410298e+07 1.539739e+07 1.713846e+07 1.952430e+07 1.834528e+07 1.976350e+07 1.581927e+07 1.864296e+07 1.810636e+07 2.010182e+07 2.216570e+07 2.029877e+07 1.899879e+07 1.987275e+07 2.116746e+07 1.780389e+07 2.360343e+07 1.352525e+07 1.790309e+07 1.746934e+07 1.408649e+07 1.686132e+07 1.758897e+07 1.850496e+07 1.805346e+07 2.191740e+07 1.500036e+07 1.676320e+07 1.846552e+07 2.324709e+07 1.858398e+07 1.357974e+07 1.188778e+07 2.076745e+07 1.620895e+07 1.743836e+07 2.079205e+07 1.426537e+07 2.102942e+07 2.101724e+07 1.924145e+07 2.139054e+07 1.336727e+07 2.251623e+07 1.637541e+07 1.863939e+07 2.265867e+07 1.642437e+07 1.780648e+07 1.614782e+07 2.683777e+07 2.334242e+07 1.819191e+07 1.820945e+07 1.605246e+07 2.294335e+07 2.013704e+07 2.238062e+07 1.832248e+07 2.378255e+07 1.678927e+07 2.524622e+07 2.319374e+07 2.346952e+07 2.064545e+07 1.193964e+07 2.041459e+07 1.579403e+07 2.065316e+07 1.835386e+07 1.874038e+07 2.100135e+07 2.364639e+07 2.230472e+07 2.172150e+07 2.372827e+07 1.913152e+07 2.123265e+07 2.440084e+07 1.892035e+07 1.810423e+07 2.409977e+07 1.697406e+07 1.739591e+07 1.597534e+07 2.006140e+07 2.049145e+07 2.003992e+07 1.962090e+07 1.879570e+07 1.526154e+07 1.749725e+07 1.890042e+07 1.647580e+07 1.684039e+07 1.241914e+07 1.933037e+07 1.789127e+07 2.226894e+07 1.896366e+07 2.507153e+07 2.210103e+07 1.608866e+07 1.292300e+07 1.956344e+07 1.420748e+07 2.038747e+07 1.407630e+07 1.440664e+07 1.362433e+07 1.324545e+07 2.032301e+07 2.031434e+07 2.078770e+07 1.498382e+07 2.159578e+07 1.667880e+07 1.183535e+07 HexCer 38:5;O6_4.533 2.567000e+06 2.125214e+06 2.782721e+06 2.553232e+06 6.936014e+04 2.188520e+06 2.324593e+06 2.480689e+06 67083.31 2.505269e+06 1.968576e+06 2.564984e+06 58740.53 2.576367e+06 2.413407e+06 2.507703e+06 5.874656e+04 2.280788e+06 2.279884e+06 2.382126e+06 5.876795e+04 2.547386e+06 2.636738e+06 2.248238e+06 24421.682 2.180136e+06 2.526554e+06 2.629593e+06 3.249658e+04 2.223415e+06 2.154779e+06 2.214004e+06 33223.67 3.144618e+06 1.799208e+06 2.417007e+06 4.513933e+04 2.593518e+06 2.301018e+06 2.520978e+06 3.146406e+04 2.636454e+06 2.011620e+06 2.827646e+06 3.753300e+04 2.349969e+06 2.168650e+06 2.443616e+06 2.765372e+06 2.737518e+06 2.917105e+06 1.693414e+06 2.356371e+06 2.758877e+06 2.238970e+06 2.415173e+06 1.489692e+06 1.896136e+06 1.585127e+06 2.595426e+06 1.903560e+06 2.053931e+06 1.705362e+06 1.907088e+06 1.913703e+06 2.242638e+06 2.574791e+06 2.545125e+06 2.158755e+06 2.139249e+06 2.067384e+06 2.305116e+06 1.927910e+06 2.347774e+06 2.895818e+06 2.369518e+06 1.816017e+06 1.953796e+06 1.542223e+06 2.284666e+06 1.788796e+06 2.424473e+06 2.844383e+06 2.131846e+06 2.506957e+06 2.262906e+06 2.111081e+06 2.686440e+06 2.826562e+06 2.912952e+06 1.757936e+06 2.481963e+06 2.581160e+06 3.289382e+06 2.246465e+06 2.332845e+06 2.570195e+06 2.010535e+06 2.274830e+06 2.505338e+06 2.018298e+06 3.022469e+06 2.126382e+06 2.704687e+06 2.368982e+06 1.706598e+06 2.918751e+06 2.539154e+06 2.987742e+06 2.479025e+06 2.328487e+06 1.991346e+06 1.518354e+06 2.359862e+06 3.237118e+06 3.039331e+06 1.858506e+06 2.622289e+06 2.594412e+06 2.705394e+06 3.280173e+06 2.248313e+06 2.439911e+06 2.122794e+06 2.387210e+06 1.853888e+06 2.673926e+06 2.511792e+06 2.175672e+06 1.740290e+06 2.054858e+06 2.017810e+06 3.043865e+06 2.595313e+06 2.910878e+06 2.712380e+06 2.579227e+06 2.761985e+06 2.943037e+06 2.382636e+06 2.481968e+06 2.233968e+06 1.938992e+06 2.635045e+06 2.189333e+06 2.107999e+06 2.527956e+06 1.598120e+06 2.230037e+06 2.668738e+06 1.757298e+06 2.642905e+06 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2.728112e+07 2.293737e+07 4.201929e+07 3.527237e+07 2.427325e+07 3.971921e+07 3.715233e+07 2.046089e+07 C35 H78 N10 O7 P2_4.537 1.430577e+06 1.308344e+06 1.696825e+06 1.557379e+06 7.358467e+04 1.286349e+06 1.349115e+06 1.492424e+06 71735.68 1.461780e+06 1.153389e+06 1.510010e+06 59092.99 1.492956e+06 1.378609e+06 1.707277e+06 5.486607e+04 1.352763e+06 1.395820e+06 1.492315e+06 5.677144e+04 1.590489e+06 1.416859e+06 1.118960e+06 25291.697 1.493908e+06 1.489460e+06 1.420002e+06 3.172395e+04 1.367218e+06 1.214257e+06 1.200342e+06 29608.15 2.319528e+06 1.193069e+06 1.333948e+06 4.445363e+04 1.510348e+06 1.337548e+06 1.380710e+06 3.407377e+04 1.552187e+06 1.322523e+06 1.674007e+06 3.916911e+04 1.354084e+06 1.390103e+06 1.446813e+06 1.367590e+06 1.510780e+06 1.782324e+06 9.940015e+05 1.298945e+06 2.070025e+06 1.056806e+06 1.344908e+06 1.268997e+06 9.374309e+05 7.788981e+05 1.520128e+06 9.094560e+05 1.135269e+06 9.106894e+05 1.359163e+06 1.353112e+06 1.378275e+06 1.187561e+06 9.852751e+05 1.095305e+06 1.309515e+06 1.418608e+06 1.521598e+06 1.014799e+06 1.333213e+06 1.531988e+06 1.294970e+06 8.556948e+05 1.069068e+06 7.348053e+05 1.415818e+06 1.131807e+06 1.351138e+06 1.699811e+06 1.533474e+06 1.205610e+06 1.507212e+06 1.379533e+06 1.372924e+06 1.611688e+06 1.466828e+06 9.399998e+05 1.489775e+06 1.519850e+06 1.839698e+06 1.273608e+06 1.170435e+06 1.706079e+06 1.099764e+06 1.202275e+06 1.534419e+06 1.174827e+06 1.789011e+06 1.188925e+06 1.335530e+06 1.395637e+06 9.187536e+05 1.989457e+06 1.651943e+06 1.662699e+06 1.172530e+06 1.125245e+06 1.281699e+06 7.431767e+05 1.526738e+06 2.034264e+06 2.087622e+06 1.028319e+06 1.486165e+06 1.454608e+06 1.424736e+06 2.123596e+06 1.310665e+06 1.547058e+06 1.284079e+06 1.553356e+06 3.244682e+06 1.612602e+06 1.564911e+06 1.364681e+06 8.592611e+05 1.026137e+06 1.083966e+06 1.791134e+06 1.123734e+06 1.450252e+06 1.293233e+06 1.409879e+06 1.768893e+06 1.936353e+06 1.529251e+06 1.356737e+06 1.293967e+06 1.086831e+06 1.625306e+06 1.458011e+06 1.282105e+06 1.540350e+06 1.522489e+06 1.058836e+06 1.335187e+06 1.248581e+06 1.329015e+06 1.244236e+06 1.741209e+06 1.674024e+06 1.705730e+06 1.446404e+06 1.371551e+06 1.430628e+06 1.209016e+06 1.449037e+06 9.993792e+05 1.115211e+06 1.058256e+06 1.270881e+06 1.039613e+06 1.604610e+06 1.276181e+06 1.236456e+06 1.411932e+06 1.370487e+06 1.288024e+06 1.062598e+06 1.263782e+06 1.343707e+06 9.190511e+05 1.247617e+06 1.389660e+06 1.110856e+06 1.158610e+06 1.372811e+06 1.126323e+06 1.157793e+06 1.708689e+06 1.242636e+06 9.732609e+05 1.878113e+06 1.368415e+06 1.321877e+06 1.396485e+06 1.350401e+06 1.312278e+06 1.538970e+06 1.365294e+06 1.865924e+06 1.726577e+06 1.256573e+06 1.256476e+06 1.165682e+06 1.409515e+06 2.014507e+06 1.833131e+06 1.732500e+06 1.731386e+06 1.867750e+06 6.276454e+05 2.062101e+06 1.934736e+06 1.443985e+06 1.085848e+06 1.073305e+06 1.207929e+06 1.508093e+06 1.545903e+06 1.840525e+06 1.710106e+06 1.659726e+06 2.647809e+06 1.568801e+06 1.618422e+06 1.341947e+06 1.497965e+06 1.006962e+06 1.283279e+06 9.959476e+05 1.158922e+06 1.414078e+06 1.682242e+06 1.823084e+06 1.596320e+06 8.871637e+05 1.224594e+06 3.284148e+06 1.663115e+06 1.790644e+06 2.362519e+06 1.663838e+06 1.107668e+06 1.929211e+06 1.572902e+06 1.178630e+06 1.978962e+06 1.074113e+06 1.774679e+06 2.172254e+06 1.496893e+06 1.160606e+06 1.113762e+06 1.113968e+06 9.570906e+05 1.603192e+06 1.288568e+06 1.232898e+06 1.211927e+06 1.192235e+06 9.329164e+05 2.227742e+06 1.902961e+06 8.714773e+05 1.938662e+06 2.206086e+06 1.062085e+06 "PC(16:1(9Z)/20:2(11Z,14Z))_4.537" 1.490381e+08 2.046880e+08 1.948849e+08 7.431682e+07 1.463563e+05 1.660710e+08 1.895327e+08 1.634835e+08 114683.31 1.718129e+08 1.692405e+08 1.743619e+08 115878.14 1.604825e+08 1.509413e+08 1.730695e+08 1.063644e+05 1.548178e+08 1.791199e+08 1.770506e+08 1.151662e+05 1.702445e+08 1.874860e+08 9.384939e+07 48676.855 1.674997e+08 1.862125e+08 1.823491e+08 6.506577e+04 1.686551e+08 1.561021e+08 1.925211e+08 67575.22 1.887201e+08 8.645240e+07 1.823299e+08 1.044678e+05 1.633694e+08 1.785013e+08 1.771410e+08 5.921143e+04 1.624423e+08 1.646406e+08 1.789838e+08 6.054477e+04 1.557612e+08 1.596663e+08 1.698138e+08 1.625946e+08 1.523016e+08 2.124706e+08 1.639281e+08 1.932905e+08 1.644735e+08 1.816653e+08 1.706814e+08 1.348766e+08 1.564561e+08 2.015264e+08 1.802461e+08 2.295992e+08 1.964517e+08 1.802927e+08 2.386854e+08 1.736554e+08 1.523870e+08 8.406058e+07 1.884187e+08 1.309272e+08 1.506679e+08 2.286570e+08 1.508236e+08 1.460117e+08 1.579203e+08 2.145811e+08 1.102823e+08 1.447034e+08 7.849736e+07 2.084504e+08 1.344290e+08 5.530740e+07 1.418466e+08 1.535609e+08 7.804655e+07 1.356343e+08 1.313436e+08 7.869125e+07 1.319510e+08 1.493493e+08 2.065677e+08 1.431538e+08 2.107427e+08 1.594261e+08 1.879729e+08 1.584862e+08 1.690784e+08 1.555573e+08 9.255293e+07 1.354374e+08 1.454792e+08 1.588694e+08 1.860511e+08 1.777526e+08 1.305305e+08 1.322093e+08 1.468561e+08 1.275825e+08 1.209478e+08 1.412653e+08 1.825731e+08 1.602735e+08 2.360251e+08 2.412655e+08 8.385769e+07 9.216793e+07 6.513800e+07 1.674342e+08 1.251004e+08 1.739982e+08 1.951290e+08 1.342349e+08 1.089712e+08 7.589233e+07 1.854124e+08 1.410741e+08 1.688071e+08 1.560177e+08 1.246052e+08 1.878009e+08 1.497991e+08 1.799513e+08 2.105787e+08 1.277581e+08 7.785780e+07 1.565105e+08 8.573233e+07 5.899564e+07 1.729681e+08 1.605409e+08 2.008047e+08 6.239471e+07 2.120026e+08 1.693526e+08 1.379198e+08 1.855081e+08 1.791431e+08 1.155504e+08 2.259463e+08 7.455516e+07 1.202904e+08 1.188961e+08 1.431079e+08 1.780197e+08 1.686883e+08 1.871909e+08 2.318603e+08 1.793294e+08 1.295982e+08 1.630413e+08 1.736146e+08 1.982488e+08 1.711228e+08 1.681324e+08 1.714400e+08 1.991054e+08 1.581095e+08 1.806285e+08 1.531482e+08 1.420759e+08 8.769762e+07 7.309130e+07 1.862872e+08 1.374988e+08 2.035621e+08 1.343530e+08 1.512024e+08 1.613261e+08 1.831902e+08 1.459784e+08 1.614673e+08 1.139793e+08 1.430298e+08 2.174487e+08 1.657390e+08 1.091479e+08 2.161245e+08 5.982918e+07 5.747604e+07 1.767917e+08 1.554817e+08 2.051014e+08 7.335302e+07 1.786829e+08 2.142432e+08 5.092256e+07 7.243193e+07 2.068087e+08 1.817099e+08 1.217682e+08 1.894405e+08 6.421551e+07 1.480881e+08 1.977632e+08 1.864844e+08 1.878063e+08 1.629035e+08 1.547784e+08 1.614033e+08 1.310972e+08 1.138690e+08 2.097261e+08 1.523581e+08 1.845965e+08 1.542954e+08 1.587329e+08 1.879834e+08 1.692657e+08 1.704552e+08 1.283328e+08 1.568571e+08 1.651407e+08 1.772092e+08 1.930635e+08 1.343438e+08 1.465782e+08 1.497046e+08 1.603635e+08 6.724493e+07 6.986278e+07 2.019424e+08 2.032830e+08 1.434380e+08 1.608189e+08 1.753820e+08 1.358912e+08 1.473556e+08 2.330001e+08 1.913006e+08 1.765901e+08 8.423372e+07 2.523184e+08 7.413611e+07 1.962282e+08 1.796677e+08 1.572226e+08 1.227698e+08 1.809779e+08 1.981492e+08 1.489904e+08 1.468574e+08 1.871816e+08 1.492278e+08 1.996579e+08 2.455914e+08 1.644343e+08 2.441982e+08 1.597081e+08 1.692688e+08 2.431482e+08 1.770214e+08 1.770654e+08 2.380270e+08 C32 H15 N9 O18_4.541 8.353241e+05 9.649615e+05 1.184025e+06 1.190275e+06 7.069888e+04 9.040152e+05 1.005952e+06 9.858778e+05 69528.89 1.238713e+06 8.215544e+05 9.568536e+05 60962.19 1.149623e+06 9.279322e+05 1.251341e+06 5.493771e+04 1.124539e+06 9.237622e+05 9.717209e+05 5.588391e+04 1.263754e+06 1.212421e+06 8.554095e+05 26013.935 8.665907e+05 1.149080e+06 9.969181e+05 3.486352e+04 1.036256e+06 8.891249e+05 1.215859e+06 32813.03 1.161671e+06 1.086681e+06 9.082281e+05 4.487308e+04 9.270366e+05 1.200453e+06 9.806288e+05 3.153053e+04 1.234312e+06 8.284650e+05 1.320227e+06 3.677160e+04 8.953613e+05 1.050406e+06 1.028045e+06 9.854851e+05 1.063422e+06 1.113053e+06 6.377958e+05 1.009646e+06 1.242462e+06 8.071740e+05 8.367531e+05 1.104541e+06 7.481378e+05 7.121416e+05 1.307243e+06 9.934351e+05 1.012051e+06 6.754153e+05 1.187831e+06 6.932654e+05 8.276668e+05 1.004827e+06 6.971253e+05 8.178905e+05 1.016857e+06 1.112472e+06 1.002275e+06 8.120522e+05 8.064965e+05 1.371353e+06 9.905964e+05 5.925505e+05 8.432430e+05 5.707424e+05 1.074210e+06 8.184136e+05 9.280364e+05 1.032760e+06 9.958547e+05 1.131540e+06 1.005349e+06 8.506823e+05 1.285311e+06 1.016159e+06 1.031010e+06 8.589016e+05 9.570110e+05 1.122211e+06 1.358396e+06 9.392648e+05 1.059142e+06 1.648198e+06 6.917867e+05 1.034594e+06 9.628997e+05 8.387888e+05 1.251197e+06 1.442130e+06 1.016163e+06 1.236482e+06 6.405398e+05 1.427567e+06 1.563721e+06 1.188704e+06 9.194438e+05 9.138513e+05 8.976701e+05 5.472361e+05 9.194126e+05 1.384363e+06 1.476391e+06 7.236467e+05 1.219525e+06 1.443635e+06 1.332258e+06 1.494404e+06 9.072781e+05 9.692978e+05 1.111841e+06 1.237687e+06 1.595869e+06 1.329296e+06 1.107894e+06 1.218147e+06 4.472438e+05 7.722131e+05 9.751087e+05 1.345294e+06 9.284111e+05 1.077824e+06 1.064876e+06 7.246288e+05 1.282526e+06 1.640337e+06 7.192442e+05 1.285086e+06 1.147651e+06 8.025355e+05 1.295918e+06 1.136047e+06 1.032248e+06 1.156540e+06 1.198729e+06 9.028282e+05 1.619037e+06 1.167903e+06 1.135781e+06 1.017940e+06 1.157856e+06 1.271186e+06 9.817452e+05 1.191335e+06 9.902287e+05 9.083299e+05 8.521553e+05 1.312063e+06 8.944623e+05 7.229603e+05 8.985551e+05 9.209330e+05 7.594204e+05 1.235714e+06 8.516065e+05 8.738952e+05 1.035794e+06 1.051033e+06 1.056814e+06 9.580214e+05 1.204497e+06 8.151054e+05 7.502105e+05 1.306183e+06 7.574374e+05 7.430165e+05 5.805522e+05 6.585049e+05 9.931073e+05 6.029667e+05 9.216884e+05 1.010211e+06 5.864961e+05 1.349037e+06 9.545325e+05 1.086524e+06 9.433344e+05 1.498722e+06 1.101007e+06 1.269008e+06 1.076058e+06 1.297128e+06 1.280141e+06 8.250391e+05 1.082553e+06 9.737069e+05 9.435992e+05 1.416289e+06 1.182247e+06 1.217205e+06 1.514862e+06 1.462154e+06 1.348248e+06 2.312960e+06 1.576730e+06 8.011454e+05 7.018523e+05 8.749699e+05 9.266545e+05 1.056716e+06 1.420003e+06 1.310011e+06 1.134500e+06 9.980769e+05 1.157984e+06 1.186788e+06 1.263880e+06 7.921015e+05 9.890819e+05 7.417330e+05 6.994116e+05 6.911704e+05 9.714272e+05 9.828732e+05 1.121626e+06 1.083156e+06 1.309148e+06 6.117976e+05 8.814860e+05 1.856597e+06 1.188398e+06 1.060660e+06 1.091083e+06 1.205414e+06 1.004189e+06 1.252240e+06 8.534832e+05 8.297030e+05 1.266104e+06 1.064714e+06 1.314062e+06 1.433241e+06 8.519544e+05 7.380518e+05 7.830624e+05 8.245840e+05 8.787359e+05 1.229920e+06 1.079594e+06 1.066332e+06 9.654884e+05 8.170262e+05 7.730387e+05 1.577745e+06 1.147561e+06 8.282127e+05 1.451871e+06 1.197615e+06 7.406447e+05 SM 38:2;O4_4.542 8.273379e+06 1.056229e+07 1.063202e+07 8.442452e+06 1.089751e+05 8.330964e+06 1.048186e+07 7.829965e+06 97296.96 1.084605e+07 8.772652e+06 1.124595e+07 92444.98 1.013784e+07 8.620353e+06 1.123109e+07 9.023030e+04 6.708940e+06 1.027693e+07 1.070243e+07 9.397798e+04 9.480675e+06 1.120700e+07 6.372631e+06 38698.191 9.854835e+06 1.128381e+07 7.781308e+06 4.979083e+04 9.967582e+06 9.229728e+06 1.135011e+07 48807.82 9.861162e+06 8.632602e+06 1.050944e+07 7.654520e+04 8.436243e+06 9.836759e+06 9.658716e+06 4.719927e+04 9.581914e+06 9.698344e+06 1.041911e+07 4.838906e+04 8.763071e+06 9.512166e+06 9.781843e+06 5.827326e+06 9.749672e+06 8.373568e+06 8.656004e+06 7.521317e+06 6.568313e+06 7.891054e+06 8.210937e+06 7.229122e+06 5.790628e+06 1.042845e+07 1.225382e+07 3.733837e+06 1.055928e+07 8.040055e+06 7.310947e+06 5.191122e+06 6.570650e+06 6.043848e+06 7.160845e+06 5.253811e+06 5.594431e+06 1.065684e+07 1.092697e+07 3.205561e+06 5.469396e+06 9.659823e+06 7.496057e+06 4.202745e+06 8.691423e+06 1.099576e+07 8.272088e+06 1.024035e+07 7.587963e+06 7.839843e+06 1.090108e+07 9.230822e+06 5.660125e+06 7.888946e+06 7.443890e+06 8.172765e+06 3.392116e+06 5.986975e+06 7.743392e+06 6.311561e+06 7.163761e+06 7.147772e+06 1.019274e+07 9.283394e+06 8.331684e+06 6.050936e+06 9.294056e+06 5.366602e+06 1.279601e+07 8.053142e+06 5.382687e+06 7.252902e+06 8.548549e+06 6.154619e+06 4.719263e+06 5.007400e+06 8.156716e+06 7.641685e+06 4.584819e+06 5.687921e+06 9.046539e+06 7.013382e+06 9.716539e+06 8.494537e+06 2.122721e+06 1.097606e+07 1.078473e+07 8.580092e+06 5.522218e+06 5.347252e+06 4.627994e+06 5.926316e+06 8.693094e+06 8.651233e+06 4.603749e+06 6.678003e+06 5.683685e+06 6.799185e+06 1.037185e+07 8.547741e+06 1.010547e+07 7.624537e+06 7.310833e+06 7.583211e+06 9.730363e+06 1.105270e+07 6.936263e+06 6.201518e+06 2.717951e+06 1.019856e+07 6.334244e+06 1.120535e+07 7.788796e+06 8.157415e+06 8.726196e+06 8.150036e+06 4.243459e+06 7.916816e+06 6.337236e+06 8.559111e+06 6.456275e+06 6.306485e+06 1.058599e+07 7.273007e+06 7.215101e+06 6.608999e+06 8.743917e+06 8.310320e+06 5.819953e+06 4.873636e+06 5.473382e+06 9.243532e+06 1.061538e+07 9.493433e+06 8.585812e+06 5.184910e+06 3.265224e+06 4.611022e+06 6.932564e+06 5.527050e+06 5.677960e+06 5.620277e+06 3.819440e+06 9.795148e+06 7.543446e+06 9.664421e+06 3.488923e+06 4.531448e+06 6.435351e+06 9.171061e+06 7.993584e+06 2.600164e+06 4.925960e+06 3.891885e+06 3.642317e+06 4.097506e+06 4.078094e+06 7.575281e+06 8.823341e+06 8.721205e+06 5.235817e+06 7.589033e+06 4.544527e+06 1.172477e+07 5.509959e+06 5.580122e+06 8.464115e+06 7.023728e+06 6.596065e+06 1.615808e+07 5.968252e+06 1.612347e+07 7.165974e+06 7.619918e+06 7.334581e+06 4.769303e+06 4.916633e+06 5.676632e+06 5.876658e+06 7.588876e+06 5.632029e+06 1.111704e+07 5.544893e+06 6.439790e+06 5.951851e+06 7.604225e+06 7.691496e+06 5.591541e+06 5.881896e+06 5.489301e+06 7.457418e+06 4.805237e+06 5.796204e+06 1.289559e+07 1.018853e+07 1.394831e+07 9.896018e+06 7.968673e+06 5.930020e+06 5.728628e+06 8.875865e+06 9.839118e+06 6.233426e+06 1.531870e+07 5.966823e+06 1.098777e+07 1.126994e+07 1.409010e+07 1.064906e+07 7.877177e+06 1.206404e+07 9.184482e+06 6.209915e+06 6.707286e+06 8.994898e+06 5.372943e+06 3.309755e+06 8.343641e+06 6.937724e+06 7.368221e+06 4.283111e+06 5.059514e+06 5.586808e+06 7.756014e+06 5.311999e+06 8.162551e+06 8.878206e+06 7.389837e+06 1.159139e+07 Dioleoylphosphatidylcholine_4.543 5.080400e+08 3.867190e+08 4.241337e+08 4.092383e+08 2.561753e+05 3.711254e+08 4.324027e+08 4.398219e+08 247090.44 4.494945e+08 1.777755e+08 4.704314e+08 250030.21 4.198764e+08 4.057920e+08 4.354666e+08 2.100050e+05 3.913425e+08 4.088091e+08 3.958868e+08 2.188303e+05 3.937861e+08 4.383507e+08 3.618217e+08 87853.823 3.745464e+08 4.093559e+08 4.270158e+08 1.213964e+05 3.888421e+08 3.782395e+08 4.310030e+08 126526.57 4.298911e+08 4.344744e+08 4.325347e+08 2.238106e+05 2.404398e+08 5.016404e+08 2.498310e+08 1.354681e+05 4.437974e+08 4.312022e+08 4.603977e+08 1.263591e+05 3.922156e+08 3.879971e+08 3.927314e+08 3.532773e+08 4.146825e+08 3.956274e+08 4.355621e+08 2.228237e+08 3.831957e+08 3.583999e+08 4.480756e+08 3.420968e+08 3.261434e+08 5.307410e+08 5.033592e+08 3.940552e+08 4.888427e+08 2.298871e+08 7.034899e+08 4.050747e+08 3.905463e+08 3.881720e+08 3.444463e+08 3.108382e+08 3.878048e+08 5.080421e+08 4.037088e+08 3.647570e+08 3.024587e+08 4.367649e+08 3.459320e+08 2.795640e+08 3.713311e+08 4.740093e+08 5.044747e+08 4.083401e+08 3.688927e+08 3.137617e+08 4.833798e+08 2.988886e+08 3.989282e+08 4.468341e+08 3.488701e+08 3.439419e+08 3.227694e+08 2.613868e+08 4.369573e+08 3.633263e+08 4.952090e+08 4.124223e+08 3.817479e+08 5.420039e+08 3.582739e+08 1.884914e+08 3.439653e+08 3.687385e+08 4.642466e+08 3.492016e+08 3.632230e+08 4.471956e+08 3.728784e+08 4.122538e+08 1.967916e+08 3.273648e+08 3.979730e+08 3.506400e+08 3.740160e+08 4.158438e+08 4.316125e+08 4.481302e+08 3.866292e+08 3.321644e+08 4.268817e+08 4.076472e+08 5.647307e+08 4.171567e+08 3.440759e+08 2.312311e+08 2.386789e+08 3.998952e+08 5.483265e+08 4.586601e+08 2.909114e+08 4.068021e+08 2.370454e+08 3.234587e+08 6.039409e+08 3.979983e+08 2.200788e+08 3.912415e+08 3.693816e+08 3.382666e+08 4.139778e+08 4.279172e+08 3.525789e+08 4.057424e+08 4.473575e+08 4.131258e+08 3.224273e+08 5.230328e+08 3.860535e+08 3.747561e+08 4.550090e+08 4.129027e+08 3.531225e+08 4.196825e+08 3.178873e+08 3.617576e+08 3.998900e+08 3.904819e+08 5.098574e+08 4.515254e+08 3.546873e+08 3.308692e+08 4.619680e+08 3.944780e+08 4.049127e+08 3.347122e+08 3.693181e+08 5.116309e+08 3.815665e+08 5.355329e+08 3.973965e+08 4.100741e+08 4.715736e+08 4.910788e+08 3.868491e+08 3.935699e+08 3.451593e+08 3.103398e+08 3.323357e+08 5.436462e+08 3.973329e+08 3.898122e+08 3.067202e+08 3.260713e+08 4.043235e+08 3.644818e+08 3.597674e+08 2.557448e+08 3.487773e+08 4.441346e+08 2.676633e+08 4.666029e+08 2.126622e+08 4.602351e+08 4.479067e+08 4.583634e+08 5.122274e+08 3.098797e+08 4.181280e+08 4.346885e+08 3.518197e+08 2.936279e+08 3.605724e+08 4.161446e+08 3.572565e+08 5.163020e+08 4.082062e+08 4.165016e+08 3.763084e+08 3.633321e+08 3.841158e+08 2.909965e+08 3.181281e+08 3.880584e+08 3.061190e+08 4.111524e+08 3.682438e+08 4.697729e+08 3.976122e+08 3.412748e+08 4.420142e+08 3.050280e+08 3.362137e+08 3.809717e+08 4.534241e+08 2.772579e+08 3.392467e+08 2.788239e+08 3.541317e+08 4.720175e+08 4.421222e+08 5.118844e+08 4.833347e+08 2.777302e+08 3.229796e+08 5.292858e+08 3.987528e+08 4.086611e+08 4.328788e+08 4.949559e+08 4.228604e+08 5.067718e+08 2.808926e+08 4.240731e+08 4.887969e+08 3.259626e+08 4.545349e+08 3.723610e+08 2.708435e+08 3.490597e+08 4.018679e+08 3.465645e+08 3.940719e+08 4.417187e+08 3.631885e+08 5.002177e+08 5.601916e+08 4.441698e+08 3.930607e+08 4.822019e+08 4.466962e+08 3.416706e+08 4.761373e+08 4.197305e+08 5.425576e+08 C38 H81 N10 O5 P_4.543 2.381039e+07 1.468470e+07 1.481589e+07 1.343825e+07 3.235996e+05 1.167345e+07 1.422165e+07 1.416523e+07 281306.34 1.448260e+07 1.242499e+07 1.606261e+07 291661.22 1.399458e+07 1.244536e+07 1.575342e+07 2.850674e+05 1.067963e+07 1.472535e+07 1.495575e+07 2.856619e+05 1.398193e+07 1.536903e+07 1.023454e+07 114159.302 1.339532e+07 1.518746e+07 1.520316e+07 1.515275e+05 1.312902e+07 1.329733e+07 1.577849e+07 150588.64 1.301142e+07 1.273800e+07 1.471068e+07 2.353206e+05 1.261339e+07 1.459579e+07 1.398482e+07 1.435128e+05 1.341650e+07 1.403614e+07 1.531528e+07 1.520552e+05 1.264940e+07 1.415437e+07 1.350775e+07 1.082962e+07 1.437115e+07 1.465812e+07 1.509798e+07 1.063210e+07 1.356456e+07 1.108840e+07 1.333308e+07 1.159429e+07 9.406931e+06 1.416466e+07 1.839764e+07 2.474386e+07 1.859382e+07 1.336384e+07 9.576561e+06 1.484017e+07 1.060632e+07 9.289318e+06 1.079148e+07 9.012624e+06 7.782227e+06 1.373597e+07 1.587590e+07 1.742548e+07 1.242396e+07 1.331539e+07 1.063320e+07 1.300241e+07 1.519518e+07 1.495615e+07 1.058380e+07 1.239991e+07 1.037987e+07 1.060300e+07 1.636460e+07 1.308981e+07 8.818872e+06 1.661566e+07 1.179873e+07 1.313267e+07 6.765818e+06 9.566521e+06 1.333382e+07 9.711138e+06 1.029153e+07 1.065326e+07 1.367446e+07 1.332037e+07 1.149745e+07 9.769434e+06 1.256714e+07 1.602340e+07 1.910478e+07 1.687976e+07 7.724292e+06 1.150364e+07 1.257336e+07 9.222966e+06 8.123278e+06 1.351780e+07 1.174756e+07 1.117290e+07 8.686714e+06 1.909255e+07 1.195850e+07 1.083848e+07 1.353266e+07 1.164400e+07 5.735097e+06 1.568030e+07 1.398547e+07 1.208262e+07 8.333693e+06 6.993062e+06 7.511642e+06 1.089726e+07 1.240753e+07 1.627891e+07 7.667860e+06 1.043259e+07 7.439298e+06 1.187982e+07 1.884749e+07 1.210686e+07 1.589233e+07 1.083751e+07 1.118317e+07 1.191215e+07 1.786024e+07 1.577885e+07 1.065302e+07 1.530359e+07 2.057625e+07 1.428744e+07 9.427243e+06 1.939553e+07 1.892554e+07 1.141798e+07 1.264023e+07 1.102389e+07 7.133698e+06 1.178679e+07 8.864483e+06 1.292466e+07 1.510717e+07 1.061111e+07 1.476273e+07 1.256605e+07 9.816173e+06 1.041751e+07 1.455702e+07 1.162656e+07 9.602896e+06 1.007665e+07 1.558074e+07 1.410414e+07 1.416232e+07 1.534712e+07 1.275149e+07 8.504552e+06 6.961614e+06 2.436020e+07 1.585213e+07 9.518023e+06 9.596757e+06 9.468461e+06 2.144925e+07 1.431619e+07 1.049721e+07 1.245741e+07 1.580593e+07 7.678967e+06 1.133119e+07 1.340785e+07 1.031677e+07 1.457887e+07 9.191309e+06 1.801231e+07 1.282940e+07 2.041559e+07 9.275633e+06 1.071011e+07 1.329359e+07 1.275533e+07 1.927405e+07 1.086456e+07 2.289002e+07 1.610432e+07 1.505622e+07 1.185554e+07 1.414369e+07 8.821790e+06 1.052136e+07 2.026507e+07 1.045975e+07 1.955628e+07 9.862623e+06 1.199788e+07 1.095846e+07 8.024433e+06 1.115447e+07 1.232029e+07 8.777870e+06 1.073447e+07 1.679097e+07 1.588473e+07 8.281473e+06 1.122251e+07 1.007264e+07 1.048676e+07 1.354221e+07 9.627348e+06 9.488017e+06 1.145975e+07 1.295943e+07 8.345389e+06 9.418038e+06 1.725983e+07 1.527463e+07 1.749334e+07 1.343616e+07 9.670476e+06 1.004475e+07 1.117868e+07 1.285422e+07 1.276940e+07 1.030503e+07 2.124569e+07 9.773343e+06 1.483987e+07 1.586292e+07 1.788318e+07 1.597598e+07 1.141973e+07 1.646691e+07 1.175797e+07 9.253220e+06 1.331725e+07 1.375891e+07 8.768486e+06 1.724778e+07 1.127304e+07 9.010905e+06 2.080169e+07 2.774737e+07 8.666991e+06 1.468689e+07 1.100723e+07 1.840890e+07 1.220071e+07 1.253391e+07 1.355800e+07 1.647445e+07 (2R)-2-[(15Z)-15-Tetracosenoyloxy]-3-[(9Z)-9-tetradecenoyloxy]propyl 2-(trimethylammonio)ethyl phosphate_4.545 1.480449e+06 1.475936e+06 1.308745e+06 1.302546e+06 4.911650e+04 1.108897e+06 1.084812e+06 1.261123e+06 56913.46 1.382531e+06 8.861707e+05 1.117648e+06 59371.55 1.544347e+06 1.288062e+06 1.555167e+06 5.689146e+04 1.228393e+06 1.013853e+06 1.674091e+06 6.005775e+04 1.120530e+06 1.518310e+06 4.477424e+05 25006.605 1.400301e+06 1.433756e+06 1.285287e+06 2.211813e+04 1.201471e+06 1.304215e+06 1.324771e+06 26101.59 1.536602e+06 1.094731e+06 1.102696e+06 4.219305e+04 1.253735e+06 1.296438e+06 1.010038e+06 2.354526e+04 1.624709e+06 1.112893e+06 1.327951e+06 2.499380e+04 1.475550e+06 1.016295e+06 1.339109e+06 1.276956e+06 1.564334e+06 1.126561e+06 5.851884e+05 1.160342e+06 8.923285e+05 1.094095e+06 1.274848e+06 7.595096e+05 8.613960e+05 1.502216e+06 1.150540e+06 1.019524e+06 1.536316e+06 1.844492e+06 1.370782e+06 8.791075e+05 8.252095e+05 1.677862e+06 4.509578e+05 1.201427e+06 1.046526e+06 1.329377e+06 1.354518e+06 6.104221e+05 1.325491e+06 1.141266e+06 9.851986e+05 1.246317e+06 3.106002e+06 1.354335e+06 6.037553e+05 1.729133e+06 1.503217e+06 1.247873e+06 1.910783e+06 8.011610e+05 1.262909e+06 1.688745e+06 1.057720e+06 8.170565e+05 7.821088e+05 1.084693e+06 1.280420e+06 1.038327e+06 1.189830e+06 1.490126e+06 1.548549e+06 1.583921e+06 3.475355e+05 7.515118e+05 1.854363e+06 1.006255e+06 2.126828e+06 3.118767e+06 6.457735e+05 1.199133e+06 1.272194e+06 1.281041e+06 1.786240e+06 1.038581e+06 4.528773e+05 1.051287e+06 1.601426e+06 1.332636e+06 1.090233e+06 8.921301e+05 1.028421e+06 4.619137e+05 9.882381e+05 7.181644e+05 1.548936e+06 8.086598e+05 6.786937e+05 5.456159e+05 1.149005e+06 8.621787e+05 9.909221e+05 2.954470e+06 9.988316e+05 8.952771e+05 4.152036e+05 9.157875e+05 2.261494e+06 1.956432e+06 8.905525e+05 9.972266e+05 1.574807e+06 1.050092e+06 7.163408e+05 3.094965e+06 1.125038e+06 2.129786e+06 1.497726e+06 9.672671e+05 9.408836e+05 1.107280e+06 6.210983e+05 6.136180e+05 1.113660e+06 1.384442e+06 6.173779e+05 1.438170e+06 1.230559e+06 5.482058e+05 9.025446e+05 7.609759e+05 6.038952e+05 1.141370e+06 1.685743e+06 8.183132e+05 1.645302e+06 9.782769e+05 6.169549e+05 7.026147e+05 6.788964e+05 5.247781e+05 1.016659e+06 1.644128e+06 1.242416e+06 5.111203e+05 1.486844e+06 1.582012e+06 7.730832e+05 6.491152e+05 1.591656e+06 5.294603e+05 2.176650e+06 1.820614e+06 8.005255e+05 1.239661e+06 9.746012e+05 4.930114e+05 8.636458e+05 7.880800e+05 1.327442e+06 9.412625e+05 1.851127e+06 1.494157e+06 9.392555e+05 2.453773e+06 1.461143e+06 2.986032e+06 1.865457e+06 1.174361e+06 1.040827e+06 1.176177e+06 1.854910e+06 1.367273e+06 1.645247e+06 7.141180e+05 8.681938e+05 5.758350e+05 1.259732e+06 1.205600e+06 1.221957e+06 2.045001e+06 7.019519e+05 1.308260e+06 1.192230e+06 6.420753e+05 6.908146e+05 8.914551e+05 4.982365e+05 1.419665e+06 1.432063e+06 1.718057e+06 1.463011e+06 7.380272e+05 1.428835e+06 1.286845e+06 3.680379e+05 1.064989e+06 1.050433e+06 5.940075e+05 1.194513e+06 6.169625e+05 5.244995e+05 1.292231e+06 9.185651e+05 1.529469e+06 1.859685e+06 6.707344e+05 8.745144e+05 1.371347e+06 1.797257e+06 6.213417e+05 1.066298e+06 1.952123e+06 6.692235e+05 1.836556e+06 1.354496e+06 1.244735e+06 1.306543e+06 6.233361e+05 7.080184e+05 1.483321e+06 1.094871e+06 8.714372e+05 1.350804e+06 8.223930e+05 2.345468e+06 9.107019e+05 1.047580e+06 1.585511e+06 3.421952e+06 1.052653e+06 6.557963e+05 1.047786e+06 1.613272e+06 1.005740e+06 1.399985e+06 1.591854e+06 1.652206e+06 1-Oleoyl-2-Stearoyl-sn-Glycero-3-Phosphocholine_4.548 3.803414e+07 6.505109e+06 9.128496e+06 8.725875e+06 6.620249e+04 1.326754e+07 8.904483e+06 9.838327e+06 60644.68 9.812979e+06 8.966576e+06 1.169530e+07 77902.15 1.085089e+07 7.526354e+05 1.091337e+07 7.092095e+04 9.212123e+06 1.186206e+07 1.040695e+07 6.597613e+04 8.978392e+06 1.036898e+07 5.909129e+06 25431.191 9.427339e+06 1.076784e+07 9.853839e+06 2.587433e+04 8.954980e+06 9.635841e+06 9.627643e+06 35287.21 8.747099e+06 9.339123e+06 1.037111e+07 5.939959e+04 8.791198e+06 8.610096e+06 8.608232e+06 3.758001e+04 1.003857e+07 8.866061e+06 1.053309e+07 3.655362e+04 8.973898e+06 9.635602e+06 9.029164e+06 6.523239e+06 1.095525e+07 1.225845e+07 8.819947e+06 6.859730e+06 9.761155e+06 9.499796e+06 8.775435e+06 7.392652e+06 5.716026e+06 9.284058e+06 1.504883e+07 4.094971e+07 7.046949e+06 1.053636e+07 4.840720e+06 2.074979e+07 6.969388e+06 9.013919e+06 8.456151e+06 5.427325e+06 2.241898e+06 8.410418e+06 9.017954e+06 1.487631e+07 7.355570e+06 7.641394e+06 8.251385e+06 1.054767e+07 2.087706e+07 1.199422e+07 9.019125e+06 1.119202e+06 8.173747e+06 1.308036e+07 1.329759e+07 8.821631e+06 7.657698e+06 8.300660e+06 8.701287e+06 8.373190e+06 4.337187e+06 1.434776e+07 7.415216e+06 5.772940e+06 7.793202e+06 7.268582e+06 1.088844e+07 1.033376e+07 8.389792e+06 7.012047e+06 1.129708e+07 2.140426e+07 8.835594e+06 3.803182e+07 4.445785e+06 1.077680e+07 7.982735e+06 5.259999e+06 6.859395e+06 1.214681e+07 8.333709e+06 7.968702e+06 1.694861e+07 2.144878e+07 9.338966e+06 9.758130e+06 7.608103e+06 7.010160e+06 5.232763e+06 1.083703e+07 1.181643e+07 9.886629e+06 6.566675e+06 4.994732e+06 7.358898e+06 7.404474e+06 9.809386e+06 9.209613e+06 5.555781e+06 7.227807e+06 6.226476e+06 8.953922e+06 1.066079e+07 8.659236e+06 1.397229e+07 7.999918e+06 7.600547e+06 7.637326e+06 8.763358e+06 1.082204e+07 6.546735e+06 2.871421e+07 4.280030e+07 1.125917e+07 5.510896e+06 2.509917e+07 9.609345e+06 7.333475e+06 8.592977e+06 7.877108e+06 4.946942e+06 8.881399e+06 6.721657e+06 8.135640e+06 1.648811e+07 6.411350e+06 9.305424e+06 7.688709e+06 7.267008e+06 6.560567e+06 1.060963e+07 6.372474e+06 7.725391e+06 8.942443e+06 1.892519e+07 8.643012e+06 8.993641e+06 1.093235e+07 8.570851e+06 4.944971e+06 5.974180e+06 5.281151e+07 1.155108e+07 5.596375e+06 5.449003e+06 6.139374e+06 5.039643e+07 9.650065e+06 6.774152e+06 1.131986e+07 1.902755e+07 5.866373e+06 6.888130e+06 9.754054e+06 7.133760e+06 2.486576e+07 6.069849e+06 2.145368e+07 2.861524e+07 2.854117e+07 8.463641e+06 7.766836e+06 8.824319e+06 8.546300e+06 3.537791e+07 9.124069e+06 4.752599e+07 9.094213e+06 3.310897e+06 1.490947e+06 8.670653e+06 7.255043e+06 6.898573e+06 4.597222e+07 8.281817e+06 3.955034e+07 9.100001e+06 6.668699e+06 5.207709e+06 4.144218e+06 8.886238e+06 7.870786e+06 5.832978e+06 7.078256e+06 1.564783e+07 1.115689e+07 6.711783e+06 9.804299e+06 6.544061e+06 8.420748e+06 7.030052e+06 5.884480e+06 6.368702e+06 6.029635e+06 8.307677e+06 5.981506e+06 5.662391e+06 1.127971e+07 1.015601e+07 1.367049e+07 9.710233e+06 7.873342e+06 5.707808e+06 7.398103e+06 9.388937e+06 8.534530e+06 7.463137e+06 1.022722e+07 6.276416e+06 9.204624e+06 1.040011e+07 1.200677e+07 9.903571e+06 7.330260e+06 9.266740e+06 1.042148e+07 6.896788e+06 1.052333e+07 9.170881e+06 6.141233e+06 1.956120e+07 9.115303e+06 6.477828e+06 1.477808e+07 5.707692e+07 6.166791e+06 1.044022e+07 6.330614e+06 4.407359e+07 9.549593e+06 9.968085e+06 6.148882e+06 1.065360e+07 797.5288_4.551 2.066618e+06 1.836717e+06 1.978505e+06 1.386168e+06 9.217066e+04 1.790455e+06 1.896115e+06 1.691123e+06 78292.85 1.592300e+06 1.514884e+06 1.686016e+06 81515.12 2.088584e+06 1.738858e+06 2.050356e+06 7.073409e+04 1.609841e+06 1.370260e+06 1.774109e+06 7.331425e+04 2.004384e+06 1.659385e+06 1.897202e+06 27898.879 1.420473e+06 1.930228e+06 1.995433e+06 2.943762e+04 1.503775e+06 1.846558e+06 1.261993e+06 39793.56 2.230803e+06 1.436495e+06 1.676193e+06 6.141321e+04 1.808746e+06 2.084228e+06 1.443908e+06 3.941558e+04 1.924375e+06 1.671649e+06 1.659147e+06 4.376716e+04 1.959489e+06 1.739284e+06 1.643962e+06 1.569507e+06 1.927753e+06 2.249928e+06 1.093906e+06 2.030124e+06 1.792392e+06 1.582626e+06 1.045408e+06 1.208264e+06 2.009794e+06 9.923851e+05 1.116441e+06 1.753065e+06 6.070086e+05 3.057724e+06 8.936862e+05 1.658423e+06 1.970039e+06 2.374206e+06 2.495022e+06 2.324066e+06 1.896171e+06 2.141970e+06 1.169387e+06 1.852296e+06 2.537261e+06 2.194494e+06 1.788566e+06 2.171308e+06 1.951515e+06 7.561915e+05 1.817139e+06 1.404241e+06 1.591596e+06 3.000224e+06 9.865071e+05 2.074218e+06 9.824612e+05 1.673146e+06 1.926960e+06 2.113766e+06 2.783240e+06 1.612222e+06 2.594305e+06 2.111006e+06 2.066966e+06 1.560008e+06 1.361484e+06 1.614456e+06 1.761190e+06 2.074491e+06 2.208181e+06 1.578513e+06 1.277857e+06 2.036201e+06 1.593704e+06 1.720115e+06 1.670927e+06 1.564016e+06 1.220928e+06 1.820509e+06 1.816433e+06 2.051048e+06 2.190389e+06 1.217195e+06 1.623786e+06 2.198106e+06 1.990855e+06 1.884436e+06 2.179120e+06 2.581040e+06 2.255791e+06 1.893562e+06 2.166580e+06 2.153135e+06 1.210605e+06 1.573742e+06 1.594143e+06 2.124407e+06 2.369299e+06 2.666878e+06 3.256176e+06 1.823532e+06 9.550931e+05 1.857885e+06 1.549291e+06 1.661637e+06 2.291625e+06 1.991928e+06 2.296102e+06 1.723121e+06 2.780325e+06 1.557600e+06 1.145204e+06 1.281591e+06 1.784545e+06 1.507447e+06 1.009185e+06 1.802403e+06 1.522684e+06 1.839587e+06 1.872318e+06 1.363474e+06 2.140237e+06 2.175844e+06 2.116671e+06 2.188519e+06 1.595660e+06 1.718010e+06 1.879533e+06 2.078129e+06 1.253742e+06 1.670622e+06 1.458008e+06 1.808124e+06 1.841567e+06 1.651109e+06 1.493659e+06 8.902536e+05 1.874682e+06 1.616222e+06 1.913503e+06 1.243248e+06 1.441476e+06 2.221587e+06 2.123904e+06 2.246691e+06 1.240688e+06 1.385235e+06 1.958485e+06 1.508436e+06 1.742880e+06 2.895814e+06 1.642966e+06 2.029662e+06 2.631168e+06 2.035578e+06 2.398786e+06 1.264797e+06 2.122905e+06 1.770036e+06 1.822625e+06 1.977219e+06 2.547199e+06 1.638731e+06 1.459972e+06 1.937629e+06 1.848225e+06 8.419232e+05 1.982820e+06 1.694377e+06 1.948936e+06 2.100783e+06 2.245248e+06 1.614912e+06 2.687154e+06 1.635015e+06 2.257598e+06 2.027743e+06 2.758265e+06 2.277794e+06 9.811919e+05 2.059491e+06 2.311851e+06 1.698156e+06 1.715045e+06 1.834567e+06 1.820584e+06 2.166502e+06 2.079083e+06 2.011071e+06 2.390102e+06 2.668650e+06 2.357803e+06 2.083669e+06 2.293072e+06 2.232169e+06 2.441765e+06 1.383678e+06 1.003593e+06 1.193572e+06 2.380531e+06 2.461555e+06 2.111144e+06 2.043281e+06 2.054397e+06 1.231245e+06 2.746554e+06 1.207260e+06 2.015242e+06 1.709652e+06 1.268205e+06 1.835930e+06 1.572791e+06 2.232914e+06 2.120694e+06 2.588240e+06 2.072373e+06 1.792274e+06 1.326579e+06 1.955236e+06 1.574287e+06 1.602876e+06 2.035544e+06 1.771462e+06 1.013972e+06 1.375825e+06 1.976068e+06 2.597591e+06 2.302577e+06 1.120212e+06 2.324050e+06 2.059341e+06 8.425981e+05 (4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate_4.553 1.261431e+07 1.168806e+07 1.616649e+07 1.406612e+07 2.164305e+05 9.502866e+06 1.615186e+07 1.374539e+07 172880.58 1.289456e+07 1.481283e+07 1.597374e+07 187411.74 1.231491e+07 8.258809e+06 1.855322e+07 2.022093e+05 1.225411e+07 1.386202e+07 1.481354e+07 2.114027e+05 8.472408e+06 1.517763e+07 1.855670e+07 86945.754 9.462309e+06 1.583822e+07 1.251673e+07 1.253622e+05 1.238677e+07 9.884503e+06 1.413243e+07 141413.43 1.607540e+07 1.411464e+07 1.355410e+07 1.714077e+05 1.319049e+07 1.239748e+07 1.528862e+07 1.101151e+05 9.404719e+06 1.545483e+07 1.852655e+07 1.256387e+05 1.197529e+07 1.418417e+07 9.599002e+06 3.736256e+07 1.705598e+07 2.840725e+07 7.932985e+05 3.256104e+07 6.548882e+06 1.644265e+07 2.045726e+07 1.363151e+07 1.641871e+07 1.830864e+07 1.437224e+07 5.851455e+05 1.465954e+07 2.443169e+07 2.126230e+07 7.448582e+06 2.122423e+07 2.172144e+07 4.906121e+06 1.388943e+07 1.639044e+07 1.148932e+07 1.313454e+07 1.359879e+07 9.076209e+06 1.231856e+07 1.765169e+07 1.498692e+07 5.709896e+06 1.140737e+07 1.002023e+07 9.387845e+06 1.522558e+07 9.722101e+06 2.054661e+07 6.896780e+06 2.933146e+07 9.060753e+06 1.448614e+07 1.626580e+07 1.164775e+07 1.024223e+07 1.456337e+07 2.704276e+07 4.898741e+06 1.528542e+07 1.207231e+07 1.311816e+07 3.390000e+06 2.041910e+07 4.941530e+06 1.031423e+07 5.196615e+06 3.023682e+06 2.548047e+07 9.700571e+06 1.111061e+07 1.509202e+07 1.578787e+07 6.365980e+06 2.297477e+07 5.994595e+06 1.559455e+07 7.109232e+06 1.106803e+07 1.367503e+07 1.742912e+07 1.971377e+07 1.409559e+07 1.218551e+07 1.000247e+07 1.208744e+07 1.329985e+07 9.409516e+06 7.995278e+06 7.575511e+06 6.016065e+06 9.467522e+06 1.644990e+07 1.387417e+07 1.771883e+07 3.036001e+07 8.195595e+06 1.606946e+07 1.760084e+07 7.214639e+06 2.899237e+07 2.825336e+07 9.888389e+06 1.342346e+07 1.533999e+07 8.573135e+06 8.516491e+06 4.361670e+06 1.722465e+07 1.452270e+07 1.710322e+07 2.633237e+06 1.473210e+07 2.172996e+07 1.229721e+07 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4.795462e+06 7.271207e+06 4.322540e+06 2.415319e+06 1.550421e+07 1.112584e+07 1.486663e+07 1.544399e+07 1.181877e+07 9.963261e+06 1.420332e+07 9.804729e+06 1.573819e+07 1.917764e+07 1.156126e+07 1.642135e+07 1.468785e+07 7.175592e+06 2.723797e+07 1.693108e+07 2.301192e+07 2.686599e+07 4.994487e+06 2.409771e+07 8.185888e+07 6.194069e+06 7.426921e+06 1.458554e+07 2.329474e+07 2.398975e+07 3.628758e+06 1.949104e+07 1.552457e+06 2.932668e+07 1.804439e+07 C58 H70 O2_4.554 6.545229e+06 6.491928e+06 7.905327e+06 7.334361e+06 1.073100e+05 4.464642e+06 6.989434e+06 6.107709e+06 89226.04 6.919282e+06 6.234924e+06 7.260313e+06 95941.49 6.830088e+06 6.538346e+06 6.652454e+06 9.392429e+04 5.995603e+06 6.721567e+06 6.199252e+06 8.999982e+04 7.838953e+06 6.002882e+06 6.554359e+06 35735.443 6.955183e+06 6.653633e+06 7.050236e+06 3.880433e+04 5.961445e+06 6.273415e+06 5.916292e+06 48776.41 7.241633e+06 6.957435e+06 5.926004e+06 7.378434e+04 7.562831e+06 6.562487e+06 6.500854e+06 4.950502e+04 6.830527e+06 6.496090e+06 6.687850e+06 5.553680e+04 6.379340e+06 6.554685e+06 6.731424e+06 6.240937e+06 6.971689e+06 5.934374e+06 3.760611e+06 6.520896e+06 6.434696e+06 4.689340e+06 4.465545e+06 5.207969e+06 5.781775e+06 4.332538e+06 5.744309e+06 6.231916e+06 4.121551e+06 4.648633e+06 5.466235e+06 5.412117e+06 6.413189e+06 1.117213e+07 6.356834e+06 5.573146e+06 5.836423e+06 5.468584e+06 6.516813e+06 5.071173e+06 7.037717e+06 6.420514e+06 5.869486e+06 5.587607e+06 6.395261e+06 3.877874e+06 5.431796e+06 6.631147e+06 6.075892e+06 8.330530e+06 5.949627e+06 7.467036e+06 8.489554e+06 5.164999e+06 8.990082e+06 6.881683e+06 6.662625e+06 5.896853e+06 6.627424e+06 6.146416e+06 7.614071e+06 6.400286e+06 6.731042e+06 6.564230e+06 5.906338e+06 6.776669e+06 6.965626e+06 5.990796e+06 6.327383e+06 6.753773e+06 6.206438e+06 7.789851e+06 6.188783e+06 7.337508e+06 6.829989e+06 6.903549e+06 5.780818e+06 6.209523e+06 6.663402e+06 5.299332e+06 4.661296e+06 7.785019e+06 8.434482e+06 5.608587e+06 6.919699e+06 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7.923561e+06 154688.20 1.040247e+07 9.695410e+06 9.460059e+06 145812.12 8.497296e+06 8.763567e+06 9.466214e+06 1.416504e+05 9.235374e+06 8.862340e+06 7.888157e+06 1.480994e+05 1.168475e+07 8.029377e+06 7.197366e+06 61251.848 9.212394e+06 7.911870e+06 9.537780e+06 6.996927e+04 9.189256e+06 1.069850e+07 6.871369e+06 74971.02 1.104703e+07 1.021374e+07 8.816541e+06 1.245566e+05 6.989645e+06 9.165836e+06 9.167595e+06 7.842986e+04 8.973775e+06 6.563875e+06 1.274451e+07 6.842769e+04 7.688000e+06 8.666316e+06 9.199935e+06 8.653710e+06 1.311375e+07 7.420121e+06 2.086569e+07 8.129806e+06 8.587405e+06 9.600484e+06 5.831795e+06 1.033026e+07 9.597197e+06 6.993831e+06 1.492618e+07 1.789113e+07 2.315634e+07 8.473474e+06 1.833849e+07 1.007924e+07 7.316835e+06 6.432560e+06 8.167976e+06 8.642812e+06 7.790488e+06 1.260535e+07 1.160344e+07 6.071361e+06 7.415718e+06 1.267268e+07 9.225073e+06 9.680431e+06 1.295395e+07 8.843221e+06 8.561595e+06 7.384413e+06 5.346664e+06 7.369173e+06 8.587535e+06 8.038661e+06 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1.446516e+07 5.371997e+06 9.665977e+06 5.427681e+06 1.294571e+07 7.014692e+06 7.901881e+06 1.274966e+07 1.279246e+07 9.373908e+06 9.263308e+06 1.021219e+07 5.606885e+06 6.041483e+06 7.673271e+06 8.910962e+06 3.003988e+06 6.395444e+06 8.216264e+06 7.554381e+06 7.222462e+06 6.442216e+06 4.123602e+06 7.317109e+06 1.070941e+07 8.399622e+06 2.639494e+07 1.337367e+07 6.993791e+06 8.197838e+06 6.188960e+06 9.196398e+06 8.986909e+06 1.044949e+07 1.075475e+07 9.253239e+06 6.416274e+06 1.267711e+07 5.413717e+06 9.139672e+06 1.278516e+07 9.131184e+06 9.038364e+06 5.730908e+06 8.390368e+06 9.042752e+06 7.591455e+06 9.508289e+06 9.486836e+06 6.412819e+06 1.300591e+07 9.598636e+06 6.523722e+06 5.073244e+06 9.017831e+06 8.974313e+06 5.863810e+06 1.224386e+07 1.212010e+07 7.101621e+06 1.056698e+07 9.414761e+06 8.463088e+06 8.138899e+06 1.052737e+07 1.313910e+07 6.585406e+06 1.264705e+07 4.783423e+06 7.815683e+06 9.671802e+06 1.251752e+07 5.857311e+06 1.163004e+07 2.277788e+07 7.515643e+06 7.461867e+06 1.078008e+07 1.016485e+07 1.385916e+07 6.376850e+06 8.767606e+06 6.843912e+06 5.924456e+06 7.255184e+06 1.019009e+07 6.692487e+06 8.979611e+06 9.169362e+06 4.691562e+06 1.174427e+07 1.344445e+07 1.234010e+07 4.318463e+06 1.170391e+07 1.300197e+07 1.356909e+07 8.308303e+06 1.305747e+07 1.426989e+07 770.6018_4.557 4.835590e+06 6.838961e+06 5.321697e+06 5.080695e+06 1.516486e+05 4.413809e+06 5.251699e+06 5.016059e+06 134372.15 5.686544e+06 5.439021e+06 5.605737e+06 136728.98 6.574617e+06 4.818995e+06 5.155612e+06 1.405845e+05 4.613406e+06 5.868009e+06 6.389368e+06 1.354976e+05 5.147608e+06 5.355566e+06 5.173480e+06 54115.570 4.797185e+06 6.085975e+06 5.505405e+06 7.250269e+04 5.565683e+06 5.837794e+06 6.224675e+06 85221.58 3.173007e+06 5.872897e+06 4.911558e+06 1.147227e+05 5.680023e+06 6.030824e+06 5.687079e+06 6.805593e+04 4.749608e+06 5.271532e+06 6.558318e+06 7.634380e+04 4.965657e+06 6.631686e+06 3.897378e+06 6.595243e+06 4.536412e+06 5.525739e+06 6.204740e+06 3.127652e+06 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4.004231e+06 5.074650e+06 4.058857e+06 3.490074e+06 3.901209e+06 3.396658e+06 5.193579e+06 3.589746e+06 4.028500e+06 4.100106e+06 4.497231e+06 4.075460e+06 4.241071e+06 6.176522e+06 4.319008e+06 4.266656e+06 5.425845e+06 3.292902e+06 3.840585e+06 5.072702e+06 3.412967e+06 3.418032e+06 4.477869e+06 3.257238e+06 4.216802e+06 6.130322e+06 3.523701e+06 3.435301e+06 3.239065e+06 4.650656e+06 4.027161e+06 5.336175e+06 2.159696e+06 3.492629e+06 3.486869e+06 3.675887e+06 4.295114e+06 6.362639e+06 5.317691e+06 3.612702e+06 5.086403e+06 3.573766e+06 3.602815e+06 C54 H79 N S_4.56 3.968107e+06 3.821614e+06 2.557795e+06 2.404119e+06 9.744037e+04 1.926132e+06 2.604087e+06 2.608850e+06 89728.78 2.762792e+06 2.854871e+06 2.849637e+06 103860.43 2.656192e+06 2.531426e+06 2.649742e+06 1.049111e+05 2.627288e+06 2.781335e+06 3.069686e+06 1.033945e+05 2.532936e+06 3.008950e+06 2.177150e+06 40499.258 2.297312e+06 3.076465e+06 2.797484e+06 4.032903e+04 2.636182e+06 2.626845e+06 2.821318e+06 57814.42 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2.602870e+06 2.739063e+06 1.979442e+06 1.380490e+06 3.180749e+06 2.123585e+06 2.825883e+06 1.744369e+06 5.466904e+06 2.446118e+06 3.513487e+06 2.871684e+06 2.721345e+06 7.648961e+05 2.141059e+06 3.024130e+06 2.269670e+06 2.952351e+06 2.405483e+06 2.301048e+06 1.680570e+06 1.921161e+06 2.853768e+06 3.203060e+06 2.186041e+06 2.093545e+06 3.443009e+06 2.136119e+06 1.397064e+06 2.482163e+06 1.325532e+06 2.807871e+06 2.884677e+06 3.153408e+06 1.698529e+06 2.791993e+06 2.806014e+06 2.268804e+06 1.857759e+06 2.960605e+06 3.902441e+06 3.242221e+06 2.209116e+06 1.533601e+06 1.811585e+06 1.273176e+06 2.630496e+06 3.097227e+06 2.410982e+06 4.270849e+06 2.264601e+06 2.566802e+06 3.893175e+06 2.940364e+06 2.957249e+06 2.559479e+06 3.760044e+06 1.630593e+06 1.640427e+06 1.880531e+06 3.056227e+06 1.954824e+06 3.095458e+06 2.064738e+06 1.803939e+06 3.551353e+06 4.804924e+06 2.110553e+06 2.578777e+06 1.884190e+06 3.624956e+06 2.309303e+06 2.454396e+06 1.754545e+06 2.937627e+06 "(2R)-2-[(11Z,14Z)-11,14-Icosadienoyloxy]-3-(pentadecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate_4.562" 1.626733e+07 1.257633e+07 1.492304e+07 1.129825e+07 1.488127e+05 1.191867e+07 1.242648e+07 1.172030e+07 123156.12 1.413332e+07 1.138942e+07 1.384417e+07 130270.40 1.249320e+07 1.254389e+07 1.364498e+07 1.285121e+05 1.278955e+07 1.236408e+07 1.248632e+07 1.303806e+05 1.136324e+07 1.467209e+07 1.055306e+07 52371.427 1.286623e+07 1.315184e+07 1.329268e+07 5.262981e+04 1.293141e+07 1.156662e+07 1.446035e+07 86531.54 1.231342e+07 1.338796e+07 9.175983e+06 1.171014e+05 1.328060e+07 1.397223e+07 1.245485e+07 7.015421e+04 1.154205e+07 1.367654e+07 1.245383e+07 6.811364e+04 1.395602e+07 1.318307e+07 1.135941e+07 1.378937e+07 1.019148e+07 1.095599e+07 1.772912e+07 9.347325e+06 1.245465e+07 1.239857e+07 1.456161e+07 1.165113e+07 1.017738e+07 1.553080e+07 1.203758e+07 1.690851e+07 1.887177e+07 9.835402e+06 1.653065e+07 1.160808e+07 1.369043e+07 1.202037e+07 1.175117e+07 9.099948e+06 1.029700e+07 1.419272e+07 1.305312e+07 1.530424e+07 1.349452e+07 1.225795e+07 9.833209e+06 1.259144e+07 1.056921e+07 1.034607e+07 1.124048e+07 7.274589e+06 9.168724e+06 6.071127e+06 1.038138e+07 1.275307e+07 9.479878e+06 1.971928e+07 7.857833e+06 1.310314e+07 1.024762e+07 7.028227e+06 1.319071e+07 1.078422e+07 1.262217e+07 9.495550e+06 1.138756e+07 1.051103e+07 1.115539e+07 1.267213e+07 1.069750e+07 1.678710e+07 1.152776e+07 5.337808e+06 1.189845e+07 1.350900e+07 1.065805e+07 9.680546e+06 1.114499e+07 1.141102e+07 9.565940e+06 1.051818e+07 1.171289e+07 1.387768e+07 1.002724e+07 1.262703e+07 1.033570e+07 1.142615e+07 1.103856e+07 1.322833e+07 1.312101e+07 8.054651e+06 9.818909e+06 7.422632e+06 1.413907e+07 1.239367e+07 1.161447e+07 1.313697e+07 8.229630e+06 1.375846e+07 7.192798e+06 1.280443e+07 1.994695e+07 9.862702e+06 8.781049e+06 9.946042e+06 1.558269e+07 1.238249e+07 1.240757e+07 9.236458e+06 1.233026e+07 9.919632e+06 9.349107e+06 1.103831e+07 8.743874e+06 2.832312e+07 1.820979e+07 1.535409e+07 1.551684e+07 1.345550e+07 1.120525e+07 1.474363e+07 9.671586e+06 1.906016e+07 1.561953e+07 1.664248e+07 1.673984e+07 1.600161e+07 1.111331e+07 1.303920e+07 1.149268e+07 1.031399e+07 1.066875e+07 1.332645e+07 1.001916e+07 1.100051e+07 1.379976e+07 1.432561e+07 1.206349e+07 1.039179e+07 9.591264e+06 1.588303e+07 1.305652e+07 1.278590e+07 7.888365e+06 1.014627e+07 1.012807e+07 1.199529e+07 1.282655e+07 7.151587e+06 1.138228e+07 1.025859e+07 1.839819e+07 1.263167e+07 9.889372e+06 9.537446e+06 1.473641e+07 1.081248e+07 1.108371e+07 9.086778e+06 1.143027e+07 1.218779e+07 1.292552e+07 1.414736e+07 1.326596e+07 7.592504e+06 1.350591e+07 1.277379e+07 1.681168e+07 1.305370e+07 1.218299e+07 6.473093e+06 1.120064e+07 1.432486e+07 1.131125e+07 1.107007e+07 1.389219e+07 1.176947e+07 1.193899e+07 1.294587e+07 1.486629e+07 1.405746e+07 9.884702e+06 1.175470e+07 1.125505e+07 8.525059e+06 1.027471e+07 1.251263e+07 1.051480e+07 1.215133e+07 1.760536e+07 1.691635e+07 1.213789e+07 1.059279e+07 1.254720e+07 1.262013e+07 1.232004e+07 1.218536e+07 2.137953e+07 1.664257e+07 1.272429e+07 4.004590e+06 1.057417e+07 1.114234e+07 1.206640e+07 1.449274e+07 1.397508e+07 1.632385e+07 1.432072e+07 1.484608e+07 1.919116e+07 1.489676e+07 1.578531e+07 1.131332e+07 2.139080e+07 8.920119e+06 9.075535e+06 6.848806e+06 1.275857e+07 1.348218e+07 1.310284e+07 1.217446e+07 9.769492e+06 1.480191e+07 1.483689e+07 1.579716e+07 1.007222e+07 1.430090e+07 1.170926e+07 1.620750e+07 1.454705e+07 1.354373e+07 1.567669e+07 PC O-35:3_4.564 3.252046e+08 1.548805e+08 1.481903e+08 1.438386e+08 8.619869e+04 1.146400e+08 1.522253e+08 1.554724e+08 66983.51 1.247691e+08 1.422756e+08 1.592419e+08 74100.64 1.391678e+08 1.380783e+08 1.508342e+08 7.397070e+04 1.266707e+08 1.495153e+08 1.587687e+08 7.308175e+04 1.254694e+08 1.448081e+08 1.379359e+08 28132.209 1.454785e+08 1.508363e+08 1.358167e+08 3.000318e+04 1.431656e+08 1.388341e+08 1.525585e+08 45224.42 1.446652e+08 1.263430e+08 1.412758e+08 6.361702e+04 1.463892e+08 1.448117e+08 1.460832e+08 3.747634e+04 1.401259e+08 1.426485e+08 1.612331e+08 3.660032e+04 1.334730e+08 1.336698e+08 1.455681e+08 1.074668e+08 1.306317e+08 1.500142e+08 1.799726e+08 1.270255e+08 9.919960e+07 1.356210e+08 1.522836e+08 1.103867e+08 1.024632e+08 2.166926e+08 1.392720e+08 2.471060e+08 1.332399e+08 1.338676e+08 1.291164e+08 1.472120e+08 1.368273e+08 1.346134e+08 1.268333e+08 9.009689e+07 9.633642e+07 1.683675e+08 1.210740e+08 1.719944e+08 1.584559e+08 1.298548e+08 1.308955e+08 1.293217e+08 1.526567e+08 2.018707e+08 1.453214e+08 2.063183e+08 1.044380e+08 1.130706e+08 1.665173e+08 1.307054e+08 1.283013e+08 7.445981e+07 1.024561e+08 1.412916e+08 1.201696e+08 2.059212e+08 1.292074e+08 1.011224e+08 1.178703e+08 1.359446e+08 9.350314e+07 1.426391e+08 1.161583e+08 1.055154e+08 1.344390e+08 1.791421e+08 1.280666e+08 1.559749e+08 9.862561e+07 1.529993e+08 2.150356e+08 8.877197e+07 1.153549e+08 1.250070e+08 1.779518e+08 1.458672e+08 1.392454e+08 2.041506e+08 1.283477e+08 1.200310e+08 9.507338e+07 1.495001e+08 7.853476e+07 1.463324e+08 1.530942e+08 1.101991e+08 1.155956e+08 9.136776e+07 1.393928e+08 1.158959e+08 1.217802e+08 1.838630e+08 9.282462e+07 1.270617e+08 1.303695e+08 1.130764e+08 1.667399e+08 1.267888e+08 1.513253e+08 9.970418e+07 1.141378e+08 1.459786e+08 1.334108e+08 1.275767e+08 1.148532e+08 1.501681e+08 1.975610e+08 1.337724e+08 8.831604e+07 1.985317e+08 1.951868e+08 1.247924e+08 1.338642e+08 1.228275e+08 9.631438e+07 1.138888e+08 9.113816e+07 1.172194e+08 1.597120e+08 1.046607e+08 1.937044e+08 1.415757e+08 1.397482e+08 1.046502e+08 1.389559e+08 1.084607e+08 1.587016e+08 1.743713e+08 1.711656e+08 1.245864e+08 1.446330e+08 1.669773e+08 1.420768e+08 9.986382e+07 1.470603e+08 2.122850e+08 1.350369e+08 1.236381e+08 1.120822e+08 1.051651e+08 2.053337e+08 1.444057e+08 1.320254e+08 1.417953e+08 1.739852e+08 7.257317e+07 1.186208e+08 1.734191e+08 1.188266e+08 1.390826e+08 1.411733e+08 2.081368e+08 1.627631e+08 1.672577e+08 1.121915e+08 1.135125e+08 1.588894e+08 1.097433e+08 1.899809e+08 6.781562e+07 2.227997e+08 1.282325e+08 2.066185e+08 1.330893e+08 1.086132e+08 1.056828e+08 1.053874e+08 1.762051e+08 1.025193e+08 1.612291e+08 9.008973e+07 1.098341e+08 1.096048e+08 8.928403e+07 9.138267e+07 1.507607e+08 1.631463e+08 1.121988e+08 1.248663e+08 1.482040e+08 8.797767e+07 1.171086e+08 8.786254e+07 8.116639e+07 1.116498e+08 1.107447e+08 9.365870e+07 1.681124e+08 9.669458e+07 7.684202e+07 8.325383e+07 1.596466e+08 1.310980e+08 1.577637e+08 1.348128e+08 1.428452e+08 1.122259e+08 1.330165e+08 9.409633e+07 1.326636e+08 1.342092e+08 1.709365e+08 1.299907e+08 1.688506e+08 1.820318e+08 1.652950e+08 1.398947e+08 1.712283e+08 1.570180e+08 1.347449e+08 1.149033e+08 1.553331e+08 1.794995e+08 9.973297e+07 1.455682e+08 1.671473e+08 1.311726e+08 2.189273e+08 2.759309e+08 1.352765e+08 1.691848e+08 1.019330e+08 1.571756e+08 1.400520e+08 1.116974e+08 1.079156e+08 4.598713e+07 1595.11386_4.568 2.225816e+05 5.394624e+05 6.037792e+05 9.589058e+05 2.043788e+05 3.952243e+05 5.974614e+05 5.358381e+05 216362.79 4.424466e+05 7.345113e+05 7.280984e+05 207310.40 4.810170e+05 8.132608e+05 7.273330e+05 2.077043e+05 3.348110e+05 5.729618e+05 6.094921e+05 1.951739e+05 5.730248e+05 5.992485e+05 7.772963e+05 89164.905 5.928916e+05 5.631276e+05 6.554726e+05 1.022546e+05 5.759462e+05 6.022548e+05 5.552556e+05 140201.25 5.250608e+05 7.426386e+05 4.657233e+05 1.704200e+05 6.510887e+05 7.425652e+05 4.860407e+05 1.053397e+05 6.220440e+05 5.942679e+05 6.937864e+05 1.046318e+05 6.358676e+05 5.582551e+05 5.974795e+05 1.877894e+06 5.557080e+05 1.859943e+05 1.080316e+06 7.926929e+05 1.966137e+05 1.741479e+06 3.890689e+05 1.791110e+05 1.886810e+05 3.612474e+05 1.925355e+05 9.473719e+05 5.306558e+05 2.291111e+06 6.760661e+05 1.737102e+06 5.327924e+05 1.919862e+05 4.787487e+05 4.024242e+05 2.974697e+05 4.667093e+05 2.019738e+05 4.011098e+05 7.070141e+05 7.528638e+05 2.306221e+05 1.616401e+06 1.924530e+05 2.021075e+05 1.886593e+05 6.547841e+05 2.734684e+06 5.396971e+05 8.119170e+05 2.142507e+05 1.812949e+05 2.163759e+05 1.925187e+05 3.091343e+05 1.951288e+05 1.996860e+06 2.155125e+05 2.040428e+05 2.026533e+05 9.332140e+05 1.993395e+05 1.958980e+05 2.026943e+05 2.463794e+05 5.604227e+05 3.476180e+05 1.138098e+06 1.833069e+05 4.575856e+05 3.722920e+05 5.373622e+05 2.195406e+05 2.287290e+05 3.653716e+06 2.273306e+05 8.890108e+05 7.928008e+05 2.023927e+05 4.015916e+05 3.939174e+05 2.009987e+05 1.912094e+05 1.901371e+05 2.208663e+05 2.155042e+05 1.833244e+05 1.791550e+05 2.020091e+05 2.271816e+05 3.569430e+05 2.054031e+05 2.361043e+05 1.732371e+05 3.313407e+05 8.422242e+05 3.337044e+05 1.451787e+06 1.896955e+05 2.193363e+05 2.033022e+05 2.117793e+05 1.982475e+05 1.891778e+05 1.961408e+05 7.806837e+05 1.288283e+06 3.293868e+05 1.902777e+05 1.857454e+05 2.080864e+05 2.286624e+05 1.922911e+05 3.154847e+05 4.429740e+05 2.865171e+05 4.882724e+05 2.102277e+05 1.984250e+05 2.406140e+06 1.873715e+05 3.970278e+05 7.119691e+05 2.792478e+06 1.686902e+06 5.507673e+05 6.377063e+05 1.276154e+06 6.013197e+05 1.748528e+05 4.481864e+05 1.936867e+05 2.043243e+05 6.497993e+05 1.114611e+06 2.053271e+06 2.142804e+05 8.666445e+05 3.171236e+05 5.832093e+05 6.020213e+05 2.105676e+05 2.561399e+05 7.426885e+05 1.475741e+06 6.649174e+05 1.303411e+06 1.842047e+05 6.720326e+05 3.010562e+06 1.853596e+05 3.823679e+05 6.172370e+05 6.668575e+05 2.157707e+06 1.836752e+05 2.183901e+05 2.223409e+05 3.355129e+05 5.612514e+05 2.685943e+05 4.960235e+05 1.860924e+05 2.271289e+05 3.928860e+05 5.132332e+05 1.042052e+06 2.502273e+06 2.320894e+05 3.937629e+05 5.142387e+05 1.994155e+05 6.451890e+05 2.138805e+05 6.778967e+05 1.022467e+06 2.088535e+05 9.818488e+05 6.002928e+05 3.967299e+05 2.147815e+05 2.048734e+05 1.973439e+06 1.584283e+06 2.080344e+05 5.224750e+05 2.666866e+06 4.534419e+05 5.195941e+05 9.421386e+05 1.459704e+06 1.550657e+06 9.590671e+05 2.407908e+05 5.291918e+05 7.824802e+05 2.678913e+06 1.778481e+05 2.873662e+05 7.603706e+05 4.583827e+06 7.102734e+05 5.048722e+05 2.180420e+05 2.108051e+05 2.720805e+05 1.393306e+06 1.075070e+06 4.018057e+05 1.098272e+06 9.439286e+05 5.409683e+06 2.832476e+06 2.526858e+06 6.431429e+05 4.097015e+05 6.013021e+05 8.932503e+05 2.106771e+05 1.584365e+06 1.379587e+06 1.426910e+06 1.984809e+06 9.835255e+05 1.940604e+05 2.015356e+05 3.356078e+05 2.134652e+05 "PC(o-18:0/18:2(9Z,12Z))_4.569" 4.504410e+06 3.056414e+06 2.987627e+06 4.306342e+06 1.339579e+05 2.469834e+06 3.079249e+06 3.253278e+06 119475.37 3.199873e+06 3.244282e+06 3.533429e+06 135167.07 3.112368e+06 2.684299e+06 3.516031e+06 1.347635e+05 3.129948e+06 3.203369e+06 3.135926e+06 1.312631e+05 3.331268e+06 3.537638e+06 2.918549e+06 55155.859 3.129133e+06 3.030881e+06 3.269286e+06 6.266213e+04 3.318755e+06 3.023901e+06 3.683095e+06 90495.22 3.110226e+06 2.976406e+06 2.998422e+06 1.157601e+05 2.996479e+06 3.740422e+06 3.470412e+06 7.297435e+04 2.589170e+06 3.239643e+06 3.814425e+06 7.318900e+04 2.816548e+06 3.221206e+06 3.106687e+06 2.646136e+06 4.923288e+06 3.890802e+06 6.165407e+06 2.125162e+06 2.693794e+06 3.263794e+06 3.410982e+06 3.729325e+06 2.073901e+06 2.642888e+06 2.683961e+06 3.784013e+06 5.635060e+06 4.336455e+06 5.371075e+06 2.291103e+06 3.074016e+06 2.655201e+06 2.865694e+06 2.163334e+06 3.346280e+06 3.027271e+06 3.022050e+06 1.545195e+06 2.309271e+06 3.481539e+06 2.557356e+06 2.520304e+06 4.197180e+06 4.114503e+06 3.255186e+06 1.638267e+06 2.537475e+06 2.190141e+06 2.786915e+06 3.154904e+06 2.992308e+06 3.268221e+06 1.972743e+06 1.858417e+06 2.537845e+06 2.474090e+06 3.332779e+06 2.945206e+06 3.170971e+06 2.694800e+06 2.519733e+06 3.679480e+06 2.017346e+06 3.173563e+06 2.765786e+06 2.984563e+06 4.570005e+06 2.432266e+06 1.462282e+06 3.843933e+06 3.321035e+06 2.767851e+06 3.429531e+06 4.546994e+06 3.178621e+06 2.837722e+06 2.684928e+06 3.048445e+06 2.604594e+06 2.918545e+06 2.691755e+06 2.544336e+06 2.881176e+06 2.544452e+06 4.219050e+06 2.074307e+06 2.765952e+06 2.122589e+06 2.152009e+06 2.822507e+06 3.230665e+06 3.324415e+06 2.122543e+06 2.450590e+06 1.204638e+06 2.256641e+06 4.288885e+06 3.531204e+06 4.735674e+06 2.386970e+06 2.523332e+06 3.032483e+06 3.633020e+06 3.306034e+06 4.303211e+06 3.345516e+06 2.088406e+06 2.598479e+06 2.672047e+06 3.678110e+06 4.611403e+06 2.418245e+06 2.634926e+06 2.117303e+06 2.522068e+06 2.863165e+06 1.868312e+06 2.217358e+06 2.809799e+06 3.264444e+06 3.480137e+06 3.544630e+06 2.588989e+06 2.087230e+06 3.199129e+06 3.225873e+06 3.125945e+06 4.567035e+06 1.948664e+06 3.519912e+06 2.747421e+06 4.611767e+06 2.091455e+06 2.611550e+06 3.604549e+06 2.764130e+06 1.904802e+06 2.580610e+06 3.436005e+06 2.695840e+06 1.753405e+06 3.298659e+06 3.230094e+06 1.666445e+06 2.222517e+06 2.093359e+06 3.682192e+06 2.504792e+06 2.225244e+06 2.541004e+06 3.394900e+06 3.338057e+06 2.852199e+06 5.203784e+06 4.556821e+06 3.070760e+06 2.802956e+06 3.332220e+06 2.386791e+06 3.054222e+06 2.393558e+06 2.567376e+06 2.449323e+06 2.106304e+06 2.633801e+06 1.337078e+06 2.774522e+06 2.386542e+06 2.299186e+06 2.429466e+06 2.024287e+06 4.469195e+06 3.182324e+06 2.216297e+06 2.043301e+06 2.634995e+06 1.077592e+06 2.329591e+06 2.738995e+06 3.371411e+06 2.334133e+06 3.711462e+06 3.531162e+06 3.313039e+06 4.586818e+06 2.325822e+06 3.252451e+06 3.696441e+06 2.347190e+06 2.375332e+06 3.148249e+06 3.775903e+06 3.509749e+06 2.857266e+06 3.345391e+06 9.183257e+05 3.243249e+06 3.066294e+06 3.534497e+06 2.455409e+06 2.998672e+06 4.427703e+06 3.137082e+06 3.510907e+06 3.706697e+06 2.421216e+06 3.987973e+06 3.441904e+06 2.563106e+06 2.008718e+06 2.712852e+06 1.929616e+06 3.556109e+06 2.507956e+06 2.400081e+06 2.951163e+06 1.899297e+06 3.360041e+06 5.170033e+06 3.960532e+06 2.214033e+06 3.958545e+06 3.727902e+06 3.900226e+06 3.573946e+06 5.047222e+06 4.055635e+06 C48 H82 N O2 P3_4.573 6.306264e+05 8.482521e+05 9.242923e+05 7.662252e+05 2.328338e+05 6.383988e+05 8.074794e+05 6.793260e+05 201332.78 8.435939e+05 8.286706e+05 8.737626e+05 191248.85 8.097392e+05 8.649552e+05 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9.291744e+07 6.223583e+07 8.466947e+07 7.507550e+07 1.044236e+08 1.003256e+08 1.040126e+08 6.669962e+07 6.251953e+07 7.569950e+07 6.654859e+07 1.089368e+08 5.083070e+07 1.153459e+08 8.240789e+07 1.044975e+08 7.440716e+07 6.081085e+07 5.441970e+07 5.655931e+07 1.065979e+08 6.399661e+07 1.097740e+08 5.123637e+07 7.097795e+07 6.949652e+07 4.817128e+07 6.646718e+07 8.548961e+07 7.941332e+07 6.414040e+07 7.268062e+07 9.228814e+07 4.961080e+07 6.991390e+07 4.825850e+07 6.844419e+07 5.618054e+07 7.086810e+07 5.106467e+07 8.587628e+07 6.168523e+07 6.648231e+07 4.901527e+07 9.292784e+07 7.616010e+07 8.767061e+07 7.150121e+07 8.687543e+07 6.791169e+07 5.417192e+07 6.293363e+07 7.263209e+07 7.430069e+07 9.729805e+07 6.693585e+07 9.010495e+07 9.209699e+07 8.821141e+07 8.285134e+07 9.410037e+07 8.562730e+07 7.067021e+07 7.123642e+07 9.759796e+07 9.242842e+07 4.987570e+07 8.716583e+07 8.672230e+07 7.805152e+07 1.249872e+08 1.593000e+08 7.598689e+07 8.560837e+07 6.113966e+07 9.723277e+07 6.224161e+07 7.015792e+07 5.249041e+07 8.012143e+07 "PC(14:0/20:3(5Z,8Z,11Z))_4.582" 4.091760e+07 2.186161e+07 2.537783e+07 2.499177e+07 1.613604e+05 1.375533e+07 2.449810e+07 2.411428e+07 143325.98 1.888483e+07 2.188931e+07 2.377827e+07 139254.76 2.125685e+07 2.184348e+07 2.308492e+07 1.355335e+05 2.116918e+07 2.223185e+07 2.118844e+07 1.299707e+05 1.991496e+07 2.248708e+07 3.009924e+07 63367.405 1.746224e+07 2.256962e+07 2.013545e+07 6.301183e+04 1.935910e+07 2.241342e+07 2.296923e+07 91608.63 2.337979e+07 2.200558e+07 2.125087e+07 1.215874e+05 2.309258e+07 2.179972e+07 1.765016e+07 7.991958e+04 2.421352e+07 2.280470e+07 2.591772e+07 7.714397e+04 2.023122e+07 1.810473e+07 2.436550e+07 2.369737e+07 1.905531e+07 2.330396e+07 1.562543e+07 2.883102e+07 1.539940e+07 2.335740e+07 2.173062e+07 1.178756e+07 1.894919e+07 3.564338e+07 1.690243e+07 2.223166e+07 1.779020e+07 2.519979e+07 3.186290e+07 2.091022e+07 1.551512e+07 2.312209e+07 1.862672e+07 1.389100e+07 1.205220e+07 2.293440e+07 1.549104e+07 2.345219e+07 1.606066e+07 1.978275e+07 2.033998e+07 2.444471e+07 2.036180e+07 2.889112e+07 2.024253e+07 2.646656e+07 1.839456e+07 2.148567e+07 2.625400e+07 2.069583e+07 2.497113e+07 3.059042e+07 1.612746e+07 2.246536e+07 2.114055e+07 3.104046e+07 2.884167e+07 1.600868e+07 2.284583e+07 2.847525e+07 2.253228e+07 2.575481e+07 1.589239e+07 1.888376e+07 2.036155e+07 2.190635e+07 2.436496e+07 2.176504e+07 1.281398e+07 1.227041e+07 1.764646e+07 1.541502e+07 1.685769e+07 1.472686e+07 2.659002e+07 1.224618e+07 2.569854e+07 3.841769e+07 3.071941e+07 2.371300e+07 1.600404e+07 2.877990e+07 9.975152e+06 2.050873e+07 2.423733e+07 1.975613e+07 1.454241e+07 5.765699e+06 3.050020e+07 2.250331e+07 1.955593e+07 1.817630e+07 1.712002e+07 2.896212e+07 2.091388e+07 1.334592e+07 2.015581e+07 1.705566e+07 2.169820e+07 1.842873e+07 1.745752e+07 2.485703e+07 2.527362e+07 1.645746e+07 1.985785e+07 2.893450e+07 2.886170e+07 2.102161e+07 1.326054e+07 2.556711e+07 2.297539e+07 1.577121e+07 2.320083e+07 2.229229e+07 1.491947e+07 1.807882e+07 1.695104e+07 2.098666e+07 1.609703e+07 1.632921e+07 1.598102e+07 2.423520e+07 1.978129e+07 1.805044e+07 1.864513e+07 2.143158e+07 2.337467e+07 8.189853e+06 1.873656e+07 2.520096e+07 1.939736e+07 1.920371e+07 1.246436e+07 2.251771e+07 3.559231e+07 2.244230e+07 2.965992e+07 2.209778e+07 1.858370e+07 1.803654e+07 2.952786e+07 2.703279e+07 2.465561e+07 2.312418e+07 1.731847e+07 1.645509e+07 2.384657e+07 2.647212e+07 2.379268e+07 1.796054e+07 2.397569e+07 2.079199e+07 2.133572e+07 2.094031e+07 2.132228e+07 2.160973e+07 3.459446e+07 2.187789e+07 3.226180e+07 1.202390e+07 2.483781e+07 1.465914e+07 2.970215e+07 1.823827e+07 2.098359e+07 1.537572e+07 1.891415e+07 3.118883e+07 2.037533e+07 3.454352e+07 1.966505e+07 1.618111e+07 1.202139e+07 1.195950e+07 1.706141e+07 2.509993e+07 2.223212e+07 2.457064e+07 1.726202e+07 1.766828e+07 2.201530e+07 1.804742e+07 2.520554e+07 2.482762e+07 1.569162e+07 2.058479e+07 2.188868e+07 2.051530e+07 2.067385e+07 1.414110e+07 2.034902e+07 3.675023e+07 2.503584e+07 2.892572e+07 2.974113e+07 2.029103e+07 1.628469e+07 1.994187e+07 2.337821e+07 1.874270e+07 1.818394e+07 3.028462e+07 2.497228e+07 2.641494e+07 2.412587e+07 3.932493e+07 1.775242e+07 2.386293e+07 2.232333e+07 2.759194e+07 1.777806e+07 3.844775e+07 2.213204e+07 2.341544e+07 2.831830e+07 2.196197e+07 2.173384e+07 3.322233e+07 2.701080e+07 2.527718e+07 2.617836e+07 2.288716e+07 2.487346e+07 3.248867e+07 1.668041e+07 2.144704e+07 2.925419e+07 PC 34:2_4.583 1.006413e+09 7.522165e+08 6.915718e+08 7.188480e+08 1.330588e+05 5.176777e+08 6.856260e+08 7.131651e+08 116990.46 6.963796e+08 6.715081e+08 7.223507e+08 120212.38 7.038221e+08 7.532946e+08 8.289254e+08 1.327962e+05 2.951879e+08 8.576286e+08 8.421916e+08 1.357926e+05 3.442818e+08 8.742944e+08 8.565206e+08 65179.216 3.247595e+08 7.485992e+08 7.430212e+08 5.573718e+04 6.740381e+08 6.715725e+08 7.550857e+08 82197.74 7.329924e+08 7.162715e+08 3.225167e+08 1.068167e+05 7.776211e+08 7.409453e+08 7.138959e+08 6.641638e+04 6.882579e+08 6.761149e+08 7.629185e+08 6.341361e+04 6.694143e+08 6.321104e+08 6.882274e+08 6.116677e+08 7.094949e+08 6.742499e+08 8.051754e+08 9.479319e+08 5.871678e+08 7.395045e+08 8.103575e+08 7.829197e+08 9.087587e+08 9.790880e+08 6.927389e+08 7.215881e+08 6.818419e+08 9.988536e+08 9.398202e+08 6.088652e+08 7.013862e+08 7.540673e+08 6.916355e+08 8.405022e+08 8.877143e+08 8.227845e+08 7.109203e+08 7.055192e+08 6.855545e+08 7.291782e+08 6.146470e+08 6.036203e+08 3.074004e+08 9.665952e+08 8.939671e+08 7.108477e+08 9.472357e+08 5.642412e+08 7.747098e+08 6.809707e+08 6.919040e+08 7.665621e+08 6.548272e+08 6.735079e+08 8.167412e+08 6.968355e+08 7.173472e+08 7.437139e+08 7.181672e+08 7.952074e+08 8.235645e+08 7.849974e+08 5.662622e+08 3.869557e+08 6.895048e+08 6.976681e+08 8.444168e+08 6.465227e+08 8.737405e+08 7.492764e+08 9.029174e+08 5.563714e+08 8.634803e+08 5.153725e+08 8.003731e+08 6.809239e+08 6.875614e+08 7.975640e+08 6.598401e+08 7.018267e+08 2.394700e+08 7.823606e+08 6.199124e+08 7.229065e+08 8.380835e+08 5.765454e+08 7.296430e+08 4.391340e+08 9.354135e+08 7.905163e+08 7.818836e+08 7.814205e+08 6.047771e+08 9.252401e+08 5.060234e+08 9.306270e+08 9.511835e+08 6.862251e+08 6.840465e+08 6.936050e+08 8.899125e+08 6.472585e+08 7.309678e+08 7.146847e+08 7.922564e+08 6.657834e+08 7.351534e+08 7.662917e+08 5.941138e+08 9.052718e+08 7.508900e+08 6.111229e+08 9.484037e+08 6.785403e+08 6.014654e+08 7.160747e+08 5.957740e+08 1.030635e+09 7.296793e+08 9.469214e+08 4.042485e+08 7.803647e+08 7.201083e+08 7.063519e+08 7.761339e+08 6.867042e+08 7.828206e+08 8.951255e+08 5.894099e+08 9.417099e+08 7.607036e+08 1.054110e+09 6.551640e+08 6.701768e+08 1.093980e+09 7.023340e+08 8.327542e+08 6.924287e+08 7.472801e+08 6.530194e+08 2.375458e+08 8.681289e+08 7.779982e+08 7.811006e+08 6.842876e+08 5.795758e+08 8.994700e+08 3.842200e+08 5.628465e+08 5.118387e+08 1.035690e+09 7.054024e+08 5.213151e+08 5.663256e+08 6.816142e+08 7.038985e+08 6.570983e+08 7.643155e+08 8.609148e+08 3.786379e+08 6.135148e+08 6.722032e+08 6.747449e+08 5.793067e+08 6.293910e+08 6.677767e+08 7.679397e+08 7.994833e+08 2.165989e+08 7.178884e+08 6.256558e+08 7.202609e+08 7.366867e+08 6.631294e+08 4.321272e+08 7.643221e+08 7.999534e+08 9.283391e+08 5.735106e+08 6.692443e+08 9.069257e+08 5.457763e+08 7.011335e+08 2.999881e+08 6.829107e+08 3.096279e+08 8.155816e+08 6.544612e+08 5.919270e+08 5.976516e+08 6.343972e+08 7.595453e+08 6.809144e+08 9.179132e+08 8.302327e+08 7.538829e+08 6.225688e+08 8.900797e+08 7.076737e+08 2.297645e+08 3.742180e+08 7.735197e+08 7.827519e+08 7.715766e+08 8.020038e+08 8.812880e+08 6.463011e+08 7.537789e+08 7.174542e+08 6.264803e+08 4.825315e+08 7.582893e+08 7.421815e+08 9.906395e+08 7.172078e+08 3.605899e+08 7.358342e+08 7.162710e+08 7.004565e+08 8.174210e+08 8.350483e+08 7.384449e+08 6.217374e+08 1.130676e+09 2.947339e+08 9.011555e+08 9.076137e+08 C16 H33 N P2_4.584 1.430708e+06 1.170588e+06 1.291317e+06 1.169222e+06 1.169749e+05 8.090819e+05 1.141323e+06 1.241259e+06 93571.16 1.069821e+06 1.254040e+06 1.055115e+06 105710.30 1.236278e+06 1.106407e+06 1.142106e+06 1.134784e+05 9.966961e+05 1.151669e+06 1.175580e+06 1.093075e+05 1.107833e+06 1.019390e+06 1.281867e+06 54516.873 1.239277e+06 1.181443e+06 1.070179e+06 5.428152e+04 9.598451e+05 1.090011e+06 1.068342e+06 78883.85 1.335168e+06 1.213446e+06 1.047606e+06 9.758355e+04 1.053061e+06 1.133580e+06 1.178823e+06 6.707272e+04 9.652891e+05 1.148008e+06 1.438355e+06 7.566111e+04 1.160440e+06 1.453241e+06 5.188677e+05 3.046622e+06 2.008145e+06 3.959864e+06 2.277856e+05 8.202335e+05 1.390404e+06 1.428902e+06 7.610660e+05 8.636572e+05 1.382631e+06 9.615033e+05 6.514156e+05 1.317210e+06 1.273797e+06 8.547151e+05 2.906198e+06 6.342933e+05 1.683513e+06 1.023289e+06 3.903833e+05 7.383254e+05 6.943987e+05 1.425359e+05 9.721736e+05 1.025703e+06 9.551963e+05 8.218633e+05 8.093615e+05 2.748283e+06 1.702601e+05 9.588345e+05 1.336138e+06 2.335732e+06 8.069113e+05 1.372606e+06 1.665051e+06 5.858332e+05 2.506397e+06 8.381071e+05 1.501769e+06 1.773318e+06 1.239467e+06 8.936571e+05 1.635649e+06 1.195185e+06 1.731887e+05 2.784613e+06 1.246405e+06 3.897704e+05 3.335749e+05 8.123972e+05 1.562050e+06 1.387830e+06 1.297063e+05 2.482513e+05 1.551254e+06 2.193123e+06 1.564200e+06 7.436185e+05 8.122635e+05 8.696368e+05 1.222006e+06 1.639194e+06 9.740629e+05 6.320638e+05 1.249425e+05 6.221084e+05 1.747719e+06 1.475552e+06 1.624256e+06 1.729061e+06 7.531975e+05 1.719910e+06 1.498626e+06 6.406741e+05 2.111556e+05 4.494795e+05 2.380377e+05 3.067651e+06 3.652842e+06 6.888215e+05 2.542603e+06 3.504974e+06 9.417979e+05 1.481760e+06 7.568895e+05 8.952179e+05 2.209913e+06 1.425690e+06 1.158795e+05 9.126834e+05 1.696302e+06 5.811891e+05 1.692860e+05 8.504793e+05 7.683802e+05 7.635115e+05 1.170154e+06 1.787443e+05 8.234900e+05 1.293030e+06 1.349264e+06 1.501790e+06 1.921097e+06 5.241012e+05 1.255526e+05 6.337805e+05 1.018341e+06 2.449508e+06 1.618773e+06 1.929831e+06 1.540613e+06 1.709229e+06 1.515299e+06 4.291818e+05 1.402812e+05 8.637405e+05 2.782867e+06 1.201693e+06 1.136912e+06 2.033854e+06 1.179643e+06 1.030636e+05 1.755364e+05 9.298448e+05 2.608227e+06 1.641960e+06 8.378906e+05 1.985508e+06 2.498938e+06 1.537016e+06 1.942705e+06 1.216653e+05 5.842366e+05 1.168705e+05 1.335606e+06 1.092916e+06 1.209849e+06 1.874805e+06 1.220733e+06 1.591625e+06 8.572112e+05 2.318757e+06 4.271532e+05 1.278226e+06 1.477159e+05 1.161262e+05 8.621732e+05 1.263624e+06 1.305619e+06 2.730579e+06 2.279378e+06 1.740271e+06 2.599871e+06 5.007439e+05 1.465225e+06 7.890124e+05 9.860959e+05 2.066847e+06 1.148001e+06 1.771968e+06 7.035299e+05 3.069504e+06 1.401364e+06 1.276043e+06 8.125331e+05 2.471562e+06 5.829793e+05 2.751497e+05 5.136292e+05 6.675190e+05 2.271521e+06 2.926009e+06 1.149324e+06 1.115112e+06 1.635596e+06 7.434530e+05 1.645169e+06 1.195935e+05 2.276746e+05 3.790408e+05 1.128537e+06 2.277758e+06 1.030863e+06 7.970648e+05 6.475495e+05 2.542947e+06 3.018563e+06 5.382991e+05 7.177166e+05 1.480999e+06 8.270952e+05 7.186360e+05 1.262261e+06 1.927570e+06 8.256668e+05 9.662238e+05 4.257168e+06 1.717720e+06 2.503984e+06 3.831743e+06 7.060343e+05 8.386187e+05 2.800890e+06 5.992512e+05 1.020252e+06 1.725895e+06 2.770507e+06 1.892439e+06 7.800127e+05 8.359401e+05 4.846712e+05 1.199392e+06 1.192569e+06 405.24293_4.59 3.162903e+06 4.764189e+06 6.872625e+06 6.196186e+06 1.114123e+05 3.434963e+06 6.265329e+06 5.044932e+06 119182.45 6.597582e+06 3.189444e+06 5.326110e+06 114324.23 6.277159e+06 5.916413e+06 6.314514e+06 1.166728e+05 5.933023e+06 3.646954e+06 4.866450e+06 1.126554e+05 5.862558e+06 4.919102e+06 6.700605e+06 52577.024 5.514134e+06 5.574073e+06 5.630533e+06 5.220323e+04 4.791318e+06 5.805109e+06 4.692498e+06 85376.66 6.387928e+06 3.487311e+06 7.142339e+06 1.046732e+05 4.677800e+06 5.082718e+06 7.143979e+06 7.033958e+04 5.405171e+06 3.910920e+06 6.073504e+06 7.378488e+04 5.758843e+06 4.551560e+06 5.943980e+06 5.048376e+06 5.904922e+06 5.587445e+06 3.451854e+06 7.594790e+06 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7.811328e+06 6.403076e+06 4.347388e+06 8.928366e+06 1.147604e+07 9.104768e+06 6.332373e+06 5.845144e+06 8.779168e+06 5.999781e+06 8.555339e+06 8.525077e+06 1.044875e+07 6.531474e+06 7.475539e+06 6.852958e+06 5.803630e+06 6.755923e+06 6.275779e+06 8.264436e+06 5.439107e+06 5.825289e+06 8.241627e+06 9.079926e+06 1.047426e+07 6.808400e+06 1.109196e+07 8.270864e+06 8.515193e+06 3.922865e+06 5.394734e+06 8.533061e+06 1.007291e+07 7.360644e+06 9.096372e+06 5.687562e+06 6.122924e+06 6.884664e+06 1.205377e+07 2.801623e+06 8.894810e+06 7.008964e+06 3.430382e+06 "HexCer 36:4;O6 (86, 184 m/z)_4.591" 6.189484e+06 4.929702e+06 6.226816e+06 4.921766e+06 1.041342e+05 2.486367e+06 4.410903e+06 3.987054e+06 99547.93 6.049255e+06 4.949530e+06 3.582172e+06 90079.01 5.082052e+06 5.695887e+06 3.999926e+06 8.737998e+04 4.647354e+06 5.397750e+06 3.754911e+06 9.271378e+04 4.422489e+06 5.708762e+06 4.340264e+06 46693.871 5.398263e+06 3.769013e+06 5.374643e+06 4.250583e+04 3.384101e+06 5.535605e+06 5.293009e+06 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5.176715e+06 5.348948e+06 3.498421e+06 2.822432e+06 6.002552e+06 3.785565e+06 2.900032e+06 2.822737e+06 2.945896e+06 4.575436e+06 4.389689e+06 1.980638e+06 2.575974e+06 4.101042e+06 3.299251e+06 4.632391e+06 1.175833e+07 6.561547e+06 4.314005e+06 5.014208e+06 4.661479e+06 3.975900e+06 3.914198e+06 1.923373e+06 5.342023e+06 2.578074e+06 2.287726e+06 5.583961e+06 2.082978e+06 4.627999e+06 3.741182e+06 3.544533e+06 4.127096e+06 2.156199e+06 5.452549e+06 2.272433e+06 3.499240e+06 3.914565e+06 4.290654e+06 2.637161e+06 4.764589e+06 3.485774e+06 4.889438e+06 2.981753e+06 4.655331e+06 4.778044e+06 1.650956e+06 5.576164e+06 3.921119e+06 4.340885e+06 4.061552e+06 4.881380e+06 3.263007e+06 5.671365e+06 3.708976e+06 4.628906e+06 2.984517e+06 5.275078e+06 1.669000e+06 3.416446e+06 4.542971e+06 6.434698e+06 2.834335e+06 2.968476e+06 8.504030e+06 3.757641e+06 3.740326e+06 4.851682e+06 4.317979e+06 6.968028e+06 3.150857e+06 4.997221e+06 3.073482e+06 2.097822e+06 2.451925e+06 4.771298e+06 2.323242e+06 3.732300e+06 3.290395e+06 2.025626e+06 5.152760e+06 5.640004e+06 5.021495e+06 2.542593e+06 4.267222e+06 3.584826e+06 4.669153e+06 2.984863e+06 5.051201e+06 8.506997e+06 1-Pentadecanoyl-2-linoleoyl-sn-glycero-3-phosphocholine_4.601 7.391468e+06 5.821446e+06 4.263723e+06 5.271258e+06 1.118761e+05 2.878181e+06 4.556292e+06 5.012257e+06 103430.76 5.240615e+06 4.808208e+06 4.875446e+06 98414.11 4.066205e+06 4.549669e+06 5.492110e+06 9.368330e+04 4.585345e+06 3.823642e+06 4.886734e+06 1.017263e+05 4.263532e+06 5.360774e+06 4.997349e+06 49503.312 4.261407e+06 4.901377e+06 4.466592e+06 4.607526e+04 4.411092e+06 4.663353e+06 5.317272e+06 67743.27 4.856240e+06 4.425578e+06 3.731034e+06 7.997976e+04 5.219177e+06 4.393299e+06 4.927496e+06 5.641864e+04 4.887677e+06 4.536700e+06 5.571103e+06 5.695141e+04 3.979751e+06 4.606804e+06 4.711512e+06 3.544680e+06 4.259738e+06 2.361480e+06 4.595019e+06 5.021275e+06 3.310311e+06 5.013312e+06 4.815821e+06 3.679910e+06 5.966092e+06 7.317024e+06 4.199647e+06 7.172909e+06 4.141246e+06 5.921781e+06 5.457650e+06 4.966085e+06 5.812890e+06 4.250613e+06 5.722860e+06 2.863815e+06 4.921908e+06 4.414291e+06 6.064956e+06 5.825757e+06 3.842585e+06 4.190211e+06 3.958831e+06 6.031269e+06 3.654577e+06 6.312176e+06 3.967271e+06 3.848503e+06 4.477001e+06 2.636800e+06 6.026709e+06 4.307432e+06 3.404392e+06 6.447432e+06 3.400505e+06 5.921581e+06 4.509963e+06 4.112806e+06 6.410637e+06 3.758429e+06 4.866928e+06 4.991487e+06 2.871915e+06 3.803104e+06 3.907693e+06 5.663277e+06 3.528160e+06 5.343554e+06 5.810064e+06 1.842018e+06 4.342837e+06 2.368532e+06 3.588609e+06 3.189910e+06 4.787814e+06 2.397855e+06 4.164917e+06 2.855520e+06 4.308780e+06 6.822030e+06 3.187216e+06 4.191057e+06 2.568888e+06 5.479478e+06 3.878229e+06 4.548825e+06 4.501864e+06 2.676139e+06 1.843303e+06 1.591101e+06 6.062355e+06 5.729382e+06 3.978971e+06 4.145566e+06 2.452057e+06 4.903334e+06 3.852696e+06 4.326644e+06 5.770524e+06 3.147250e+06 3.303465e+06 5.002042e+06 6.754767e+06 3.301035e+06 5.285715e+06 2.788013e+06 4.322111e+06 5.002357e+06 3.569442e+06 4.722334e+06 3.033176e+06 4.342424e+06 7.682844e+06 4.649388e+06 5.490391e+06 4.867198e+06 4.281680e+06 5.724936e+06 2.790406e+06 6.333468e+06 4.134544e+06 6.705140e+06 6.328870e+06 5.525979e+06 4.867399e+06 4.073334e+06 4.123273e+06 3.789201e+06 3.731728e+06 3.447256e+06 3.384850e+06 3.457419e+06 5.870280e+06 5.131693e+06 5.002223e+06 2.582156e+06 4.930082e+06 3.558835e+06 4.162690e+06 5.170168e+06 3.234720e+06 3.723765e+06 4.500843e+06 3.448044e+06 5.703229e+06 3.592693e+06 6.769018e+06 2.991981e+06 8.702820e+06 3.998960e+06 3.103621e+06 3.386969e+06 5.512204e+06 3.986357e+06 4.648751e+06 3.427667e+06 4.009419e+06 2.931426e+06 7.240663e+06 4.690808e+06 5.927681e+06 1.613281e+06 3.980793e+06 5.428264e+06 6.902005e+06 4.146803e+06 4.873191e+06 2.868946e+06 3.678940e+06 7.835241e+06 4.483695e+06 4.876900e+06 6.797093e+06 4.098880e+06 3.467865e+06 4.767892e+06 3.180828e+06 5.170967e+06 4.773749e+06 6.088960e+06 4.357465e+06 2.699951e+06 5.016263e+06 4.170096e+06 2.907601e+06 4.953112e+06 5.222041e+06 6.303537e+06 3.559552e+06 2.686342e+06 4.066167e+06 3.499511e+06 4.611652e+06 6.323897e+06 5.571418e+06 5.942282e+06 6.094571e+06 2.520472e+06 3.552781e+06 4.470992e+06 6.079507e+06 4.191771e+06 5.581963e+06 6.563985e+06 6.308163e+06 6.043164e+06 5.176815e+06 7.104150e+06 4.305210e+06 4.640069e+06 7.204335e+06 4.337828e+06 4.486246e+06 4.532467e+06 5.330529e+06 6.072548e+06 4.675914e+06 5.461327e+06 4.526213e+06 5.343548e+06 4.201148e+06 6.984396e+06 5.432720e+06 4.783376e+06 4.408714e+06 7.346137e+06 4.387031e+06 5.130111e+06 5.856613e+06 "1-hexadecyl-2-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphocholine (1)_4.604" 1.889669e+07 1.508315e+07 1.485401e+07 1.435842e+07 1.138462e+05 7.936984e+06 1.468222e+07 1.399988e+07 109322.78 1.380351e+07 1.294589e+07 1.405340e+07 100563.85 1.241590e+07 1.355399e+07 1.498047e+07 9.177465e+04 1.171272e+07 1.473878e+07 1.273312e+07 9.815410e+04 1.227893e+07 1.567502e+07 1.370064e+07 50990.321 1.155668e+07 1.437840e+07 1.360255e+07 4.875534e+04 1.282787e+07 1.294087e+07 1.335238e+07 70691.31 1.385489e+07 1.351946e+07 1.435055e+07 7.691716e+04 1.286294e+07 1.237513e+07 1.535753e+07 5.837343e+04 1.240617e+07 1.287801e+07 1.500849e+07 6.016314e+04 1.301905e+07 1.254260e+07 1.381000e+07 1.195186e+07 1.843317e+07 1.081856e+07 2.448512e+07 1.583639e+07 1.062486e+07 1.575155e+07 1.874730e+07 1.305897e+07 1.115582e+07 1.260076e+07 1.615632e+07 1.301099e+07 2.700477e+07 2.631911e+07 2.709574e+07 1.235671e+07 1.479806e+07 1.063551e+07 9.397209e+06 1.070354e+07 1.697786e+07 1.594389e+07 1.517896e+07 1.871716e+07 6.616282e+06 1.454378e+07 9.825230e+06 8.779723e+06 1.514667e+07 1.314117e+07 1.280242e+07 1.096356e+07 9.026771e+06 7.108347e+06 1.290987e+07 7.322591e+06 1.482457e+07 1.768327e+07 7.933607e+06 4.543748e+06 8.302570e+06 1.416902e+07 2.752155e+07 1.078369e+07 1.061461e+07 1.236608e+07 1.058063e+07 2.198900e+07 7.723429e+06 1.292565e+07 6.354681e+06 1.227240e+07 2.166332e+07 7.453157e+06 5.782410e+06 1.258863e+07 1.320212e+07 1.353316e+07 1.455203e+07 1.489148e+07 1.303212e+07 1.193829e+07 1.189737e+07 2.148979e+07 9.616881e+06 1.352724e+07 1.495616e+07 1.207682e+07 2.495945e+07 9.294630e+06 1.637952e+07 8.809786e+06 4.697759e+06 4.881796e+06 1.090223e+07 1.322498e+07 1.114335e+07 1.425987e+07 1.022279e+07 1.264503e+07 6.174936e+06 7.515243e+06 1.529002e+07 1.166674e+07 3.190268e+07 1.088666e+07 1.039532e+07 1.180586e+07 1.803225e+07 1.636730e+07 1.748260e+07 2.000541e+07 1.032378e+07 1.289286e+07 1.325555e+07 1.160364e+07 1.614389e+07 6.698569e+06 1.089302e+07 7.306734e+06 8.170775e+06 1.225695e+07 6.780614e+06 1.162495e+07 1.366657e+07 1.353520e+07 1.081165e+07 1.511760e+07 8.674765e+06 9.962285e+06 2.013391e+07 8.074319e+06 1.040835e+07 1.610271e+07 1.642932e+07 1.801092e+07 7.982171e+06 1.837471e+07 9.503747e+06 1.295241e+07 1.170442e+07 1.502712e+07 1.211769e+07 1.497396e+07 1.524227e+07 1.114405e+07 7.811232e+06 1.474470e+07 1.140552e+07 8.593487e+06 8.430444e+06 8.984813e+06 1.500108e+07 1.447221e+07 6.194440e+06 8.231636e+06 1.264403e+07 1.048013e+07 1.327258e+07 4.146549e+07 2.084536e+07 1.345623e+07 1.492863e+07 1.035043e+07 1.141703e+07 1.234814e+07 4.878423e+06 1.722884e+07 8.151031e+06 7.894510e+06 1.902762e+07 6.631092e+06 1.556773e+07 1.104063e+07 1.053802e+07 1.336391e+07 6.615431e+06 1.605902e+07 7.238035e+06 1.015341e+07 1.035283e+07 1.042969e+07 7.889131e+06 1.491821e+07 1.144270e+07 1.714635e+07 9.520073e+06 1.274699e+07 1.519778e+07 5.540598e+06 1.697114e+07 9.745522e+06 1.376440e+07 1.305298e+07 1.392807e+07 9.038042e+06 1.692210e+07 1.176522e+07 1.237032e+07 9.681903e+06 1.927877e+07 4.188427e+06 1.060419e+07 1.312392e+07 1.855212e+07 8.707443e+06 9.256504e+06 2.411318e+07 1.162603e+07 1.153942e+07 1.391444e+07 1.324559e+07 2.004512e+07 9.417065e+06 1.403002e+07 9.322196e+06 5.083516e+06 4.808674e+06 1.535968e+07 8.172515e+06 1.182195e+07 1.025067e+07 6.040011e+06 1.809289e+07 1.665646e+07 1.714478e+07 8.220012e+06 1.474346e+07 8.541389e+06 1.448503e+07 8.810677e+06 1.737566e+07 2.736917e+07 1-[(9Z)-octadecenyl]-2-hexadecanoyl-sn-glycero-3-phosphocholine_4.605 1.295143e+07 9.191863e+06 7.018124e+06 8.816561e+06 1.131484e+05 5.317325e+06 8.479245e+06 8.570059e+06 102577.98 8.269222e+06 8.027237e+06 7.588186e+06 97530.79 7.317011e+06 8.442230e+06 7.883258e+06 1.155311e+05 7.265685e+06 7.648655e+06 8.253340e+06 1.026465e+05 8.411548e+06 9.292006e+06 6.098676e+06 54974.747 6.642401e+06 8.766774e+06 8.307193e+06 4.856183e+04 7.698565e+06 7.749813e+06 8.146585e+06 68682.30 8.453757e+06 7.305424e+06 7.791489e+06 7.650308e+04 7.807416e+06 7.885225e+06 8.046149e+06 5.791325e+04 7.823532e+06 7.294594e+06 9.425350e+06 5.939074e+04 7.217983e+06 7.942985e+06 7.625260e+06 6.774645e+06 1.055193e+07 7.387819e+06 1.270214e+07 3.073773e+06 6.262800e+06 6.601955e+06 6.878389e+06 7.339540e+06 4.970023e+06 5.860420e+06 8.726946e+06 1.078117e+07 1.245275e+07 9.250193e+06 1.154942e+07 6.727985e+06 8.107804e+06 6.164548e+06 8.081700e+06 6.476656e+06 8.223816e+06 8.746895e+06 8.222663e+06 9.328868e+06 6.289611e+06 7.766074e+06 6.170233e+06 6.500461e+06 9.149621e+06 1.045689e+07 8.838090e+06 5.712547e+06 7.885833e+06 5.715457e+06 6.992722e+06 8.800395e+06 9.163727e+06 5.942735e+06 5.060313e+06 6.249322e+06 6.075541e+06 6.909751e+06 6.913432e+06 6.397244e+06 8.578656e+06 5.966166e+06 5.869060e+06 8.089403e+06 5.275009e+06 7.219546e+06 5.981147e+06 7.238161e+06 5.056970e+06 6.321038e+06 3.557054e+06 7.790263e+06 9.603132e+06 5.801119e+06 3.732317e+06 1.744244e+07 6.800630e+06 6.557829e+06 5.524570e+06 6.995352e+06 6.981730e+06 6.392792e+06 6.928691e+06 4.736693e+06 5.320456e+06 7.090327e+06 1.156863e+07 3.734430e+06 6.333158e+06 5.676252e+06 6.069911e+06 6.825727e+06 7.714787e+06 9.711019e+06 6.071601e+06 5.265628e+06 3.442463e+06 7.735430e+06 1.127901e+07 8.048774e+06 8.766837e+06 6.245670e+06 5.936506e+06 6.346198e+06 8.538124e+06 8.188054e+06 7.921415e+06 6.615715e+06 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5.293350e+06 8.586521e+06 5.029114e+06 5.851640e+06 8.094045e+06 5.229454e+06 4.729963e+06 5.086812e+06 9.463518e+06 7.386631e+06 7.467799e+06 8.999590e+06 3.344071e+06 7.583855e+06 7.304937e+06 7.133042e+06 7.792453e+06 8.259585e+06 1.010263e+07 7.357010e+06 9.356212e+06 9.806606e+06 5.625061e+06 1.248874e+07 8.202719e+06 7.204994e+06 5.561741e+06 8.286842e+06 4.014073e+06 8.884247e+06 5.124412e+06 4.215295e+06 8.164679e+06 5.462581e+06 1.248139e+07 1.557567e+07 1.202228e+07 5.932184e+06 1.075927e+07 1.122028e+07 1.090855e+07 9.275882e+06 9.686846e+06 8.990656e+06 C35 H77 N9 O2 P2_4.606 5.138671e+06 3.337921e+06 3.239231e+06 3.254687e+06 1.540639e+05 2.457985e+06 2.817601e+06 3.006988e+06 143208.55 3.083280e+06 2.695347e+06 2.678716e+06 120148.75 3.597349e+06 4.074751e+06 2.743211e+06 1.180225e+05 2.451333e+06 3.122321e+06 2.840575e+06 1.333985e+05 3.098058e+06 4.082983e+06 1.931100e+06 74377.999 2.860240e+06 3.054551e+06 3.304421e+06 6.777078e+04 3.359201e+06 2.807640e+06 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C48 H64 N9 P_4.609 1.810950e+06 2.180477e+06 1.907805e+06 1.681652e+06 9.668149e+04 1.154549e+06 1.618549e+06 2.305426e+06 101271.46 1.283037e+06 1.843586e+06 1.512320e+06 96951.70 2.161659e+06 1.891866e+06 1.248055e+06 9.493128e+04 1.582588e+06 1.833096e+06 1.620705e+06 9.065889e+04 2.094175e+06 2.132365e+06 1.753830e+06 46795.582 1.151704e+06 2.156020e+06 1.388521e+06 4.411646e+04 1.694322e+06 1.792905e+06 1.676231e+06 55898.73 2.094406e+06 1.632637e+06 1.904388e+06 7.498817e+04 1.725741e+06 1.927087e+06 1.049739e+06 6.345887e+04 1.912852e+06 1.622751e+06 2.046951e+06 5.986354e+04 1.920095e+06 1.371259e+06 1.933905e+06 1.866712e+06 3.303999e+06 1.342639e+06 3.385015e+06 1.612970e+06 1.653688e+06 2.441801e+06 2.108277e+06 1.930006e+06 1.703666e+06 1.417354e+06 2.441803e+06 1.359889e+06 2.610427e+06 3.268044e+06 2.978723e+06 1.375806e+06 2.231713e+06 1.665242e+06 1.315752e+06 1.719023e+06 2.334823e+06 1.736380e+06 2.107352e+06 1.009965e+06 1.051797e+06 1.550584e+06 1.415787e+06 1.529271e+06 2.098141e+06 1.236648e+06 2.137589e+06 1.174520e+06 1.345824e+06 1.592042e+06 1.424364e+06 1.313450e+06 1.523568e+06 2.422134e+06 1.343616e+06 7.118967e+05 1.361074e+06 1.489383e+06 3.541608e+06 1.832858e+06 1.241385e+06 1.636068e+06 2.020984e+06 3.029444e+06 1.149305e+06 1.971318e+06 8.617044e+05 1.753094e+06 3.543001e+06 1.059850e+06 1.090949e+06 1.672826e+06 1.403727e+06 2.563099e+06 2.111445e+06 2.414874e+06 1.559057e+06 1.617134e+06 1.564628e+06 2.281844e+06 1.239038e+06 2.058097e+06 2.748749e+06 1.288845e+06 3.371278e+06 1.446061e+06 1.672948e+06 1.643685e+06 1.433894e+06 1.194621e+06 1.093300e+06 1.796611e+06 2.174411e+06 2.049696e+06 1.468708e+06 1.620226e+06 8.280748e+05 8.525752e+05 1.089996e+06 1.869923e+06 3.844255e+06 1.994752e+06 1.654324e+06 1.009450e+06 3.153754e+06 2.617794e+06 2.655720e+06 3.247107e+06 1.114261e+06 9.190737e+05 2.218410e+06 1.484871e+06 2.108195e+06 1.136776e+06 1.553842e+06 6.651881e+05 1.871098e+06 1.912774e+06 9.688225e+05 1.737394e+06 1.751642e+06 2.601133e+06 1.270803e+06 2.411158e+06 1.082464e+06 1.603662e+06 2.696451e+06 1.413204e+06 1.485843e+06 2.186430e+06 2.040197e+06 2.329369e+06 1.198908e+06 1.993859e+06 1.608654e+06 2.427027e+06 1.267079e+06 1.411302e+06 1.276863e+06 1.921053e+06 2.611404e+06 2.158210e+06 1.056085e+06 2.522876e+06 1.694516e+06 1.521933e+06 1.887462e+06 1.810370e+06 1.869841e+06 2.115496e+06 1.042162e+06 1.408751e+06 1.581314e+06 1.364634e+06 1.885958e+06 5.036063e+06 3.509867e+06 2.184194e+06 1.972175e+06 2.071374e+06 1.502575e+06 3.146068e+06 8.815158e+05 2.079311e+06 9.980665e+05 9.654590e+05 3.022897e+06 1.116443e+06 2.510305e+06 1.353954e+06 1.397110e+06 1.504552e+06 9.827660e+05 2.956881e+06 1.564572e+06 1.728126e+06 9.629549e+05 1.824693e+06 1.067011e+06 2.081231e+06 1.842731e+06 1.982465e+06 1.529036e+06 2.305937e+06 1.844999e+06 6.512884e+05 3.229667e+06 1.411149e+06 2.123857e+06 2.465724e+06 2.249787e+06 1.356975e+06 3.007129e+06 1.393078e+06 1.962238e+06 8.689729e+05 2.435059e+06 5.586850e+05 1.809809e+06 1.801475e+06 3.218851e+06 8.327906e+05 1.404525e+06 2.334486e+06 1.502641e+06 1.299817e+06 1.683291e+06 9.753817e+05 2.982606e+06 8.372429e+05 1.576418e+06 1.722904e+06 8.222069e+05 6.830701e+05 1.802951e+06 1.526847e+06 1.344401e+06 1.370619e+06 8.703785e+05 1.983145e+06 2.215159e+06 1.415676e+06 8.097280e+05 2.770428e+06 1.294156e+06 1.172068e+06 1.562256e+06 2.580859e+06 2.004511e+06 1-Palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine_4.61 6.656340e+07 2.212277e+07 2.170510e+07 2.087947e+07 1.091249e+05 1.083615e+07 1.895938e+07 2.043463e+07 101744.34 2.109378e+07 2.005515e+07 2.002615e+07 95642.85 1.765541e+07 2.001598e+07 1.977152e+07 9.386001e+04 1.745651e+07 1.967906e+07 1.899440e+07 9.745795e+04 1.910856e+07 2.102184e+07 2.137354e+07 49501.371 1.716766e+07 1.899703e+07 1.952733e+07 4.687833e+04 1.821397e+07 1.976178e+07 1.996876e+07 61342.88 2.011801e+07 1.876407e+07 2.098635e+07 7.742026e+04 1.688553e+07 1.950810e+07 1.946528e+07 5.834720e+04 1.933042e+07 1.878517e+07 2.215015e+07 5.846844e+04 1.838203e+07 1.806917e+07 1.986595e+07 1.116405e+07 1.059336e+07 8.106917e+06 1.443064e+07 1.981682e+07 1.159151e+07 1.917083e+07 2.318988e+07 6.551032e+06 1.307005e+07 5.403264e+07 1.219639e+07 2.471465e+07 1.326897e+07 1.425625e+07 1.373556e+07 2.515899e+07 1.341135e+07 1.505212e+07 1.867680e+07 1.117671e+07 1.046301e+07 2.151085e+07 1.383114e+07 2.306996e+07 1.282359e+07 1.664545e+07 1.114474e+07 2.277598e+07 2.521264e+07 1.643640e+07 1.081275e+07 3.939457e+07 1.065503e+07 1.854880e+07 2.472600e+07 2.489633e+07 1.831675e+07 1.801021e+07 1.207500e+07 2.686994e+07 1.282440e+07 4.220515e+07 1.935539e+07 1.081475e+07 1.495781e+07 1.767974e+07 1.233358e+07 2.442916e+07 1.943626e+07 1.173065e+07 2.013344e+07 2.241626e+07 2.216708e+07 3.706784e+07 1.000495e+07 1.124692e+07 1.701058e+07 7.799081e+06 1.122702e+07 1.721442e+07 2.121054e+07 9.849833e+06 2.487021e+07 5.070017e+07 2.243689e+07 1.590951e+07 1.328355e+07 2.230752e+07 6.628692e+06 1.555479e+07 1.633427e+07 1.297613e+07 1.027983e+07 4.992422e+06 2.626966e+07 2.445896e+07 1.231819e+07 1.302192e+07 9.601327e+06 2.013853e+07 1.862818e+07 1.408710e+07 2.488117e+07 8.931564e+06 1.529667e+07 1.270645e+07 1.031714e+07 1.989407e+07 1.944305e+07 1.242157e+07 1.179838e+07 2.501154e+07 3.788789e+07 1.492084e+07 9.954856e+06 1.195024e+07 1.743669e+07 1.191993e+07 1.510103e+07 1.371138e+07 9.147971e+06 1.367404e+07 8.354235e+06 1.314444e+07 1.938705e+07 1.256124e+07 2.009373e+07 1.789076e+07 1.839025e+07 1.373723e+07 1.085967e+07 1.027870e+07 1.526434e+07 1.007465e+07 2.932041e+07 1.284568e+07 1.650624e+07 1.326322e+07 2.033103e+07 1.173567e+07 2.558513e+07 3.477267e+07 2.236324e+07 1.915723e+07 1.542010e+07 1.147106e+07 5.039946e+07 1.350719e+07 1.294119e+07 2.856486e+07 3.085871e+07 9.006728e+06 1.972564e+07 3.579374e+07 1.867587e+07 1.926190e+07 1.810962e+07 1.896338e+07 2.280874e+07 2.526808e+07 1.359528e+07 8.234036e+06 2.711804e+07 1.232538e+07 3.924259e+07 7.950011e+06 3.856000e+07 2.251315e+07 3.469051e+07 1.621020e+07 1.217109e+07 1.399800e+07 1.360773e+07 3.389499e+07 1.366218e+07 5.180831e+07 1.047660e+07 1.120885e+07 1.210775e+07 8.970019e+06 1.407629e+07 1.856536e+07 2.335844e+07 1.939039e+07 1.472096e+07 2.845671e+07 1.348553e+07 1.487905e+07 1.140659e+07 1.128730e+07 1.073132e+07 1.600913e+07 6.937835e+06 1.252350e+07 9.844235e+06 1.255450e+07 7.280999e+06 3.284198e+07 1.758598e+07 2.900070e+07 2.034353e+07 4.494819e+07 1.190033e+07 1.260551e+07 1.731065e+07 1.500890e+07 1.191629e+07 2.088597e+07 1.793525e+07 1.918662e+07 1.821614e+07 3.318330e+07 1.521594e+07 1.960200e+07 1.710078e+07 2.696160e+07 1.452419e+07 3.852397e+07 2.018700e+07 1.217903e+07 3.920732e+07 1.652271e+07 1.232881e+07 5.446728e+07 3.768241e+07 1.863271e+07 2.489676e+07 9.407353e+06 2.941045e+07 1.713411e+07 1.178900e+07 8.136426e+06 1.469181e+07 "1-tetradecanoyl-2-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphocholine_4.613" 1.466487e+07 9.084310e+06 9.038742e+06 8.688127e+06 1.056287e+05 3.741923e+06 8.383071e+06 8.451607e+06 105223.35 7.644547e+06 8.597418e+06 8.406886e+06 91008.95 7.289051e+06 7.609363e+06 8.260622e+06 8.904728e+04 7.163463e+06 8.109601e+06 7.780125e+06 9.262554e+04 7.622966e+06 8.456201e+06 9.140829e+06 47905.373 6.964619e+06 8.357328e+06 6.300101e+06 4.649984e+04 7.980049e+06 8.067212e+06 8.690383e+06 61405.25 8.071668e+06 7.374441e+06 7.723479e+06 7.521910e+04 7.838691e+06 8.026160e+06 7.789070e+06 5.433550e+04 8.143256e+06 7.871580e+06 8.760250e+06 5.691594e+04 7.346016e+06 7.158824e+06 8.372475e+06 5.237671e+06 7.071749e+06 3.098570e+06 6.984297e+06 1.128810e+07 7.067430e+06 7.488156e+06 1.248092e+07 3.646728e+06 1.109231e+07 1.772295e+07 5.924694e+06 8.545434e+06 6.325816e+06 9.312955e+06 1.009356e+07 1.058357e+07 7.243818e+06 7.399672e+06 1.052261e+07 5.339419e+06 7.852090e+06 1.048120e+07 6.182941e+06 9.342768e+06 3.704714e+06 9.349435e+06 5.063545e+06 1.047057e+07 7.981527e+06 8.375369e+06 4.059419e+06 1.072626e+07 6.298042e+06 6.761808e+06 1.517039e+07 9.153061e+06 7.843881e+06 9.530880e+06 4.101220e+06 1.332906e+07 6.957137e+06 1.420452e+07 9.546599e+06 3.620879e+06 9.132992e+06 1.247245e+07 4.728930e+06 8.575863e+06 6.901779e+06 9.076976e+06 7.552932e+06 6.506956e+06 1.027758e+07 7.118336e+06 5.107195e+06 2.223653e+06 3.852433e+06 4.479048e+06 1.269658e+07 3.202516e+06 9.206069e+06 4.218110e+06 5.709484e+06 1.229108e+07 6.346851e+06 8.862876e+06 5.281063e+06 8.246329e+06 2.822041e+06 4.518497e+06 8.550580e+06 4.233663e+06 3.040201e+06 1.240830e+06 1.546826e+07 1.150055e+07 8.606189e+06 4.827088e+06 4.591924e+06 7.505587e+06 6.036776e+06 5.537366e+06 1.245397e+07 4.055911e+06 6.565222e+06 8.241361e+06 5.866667e+06 8.079813e+06 1.147420e+07 7.915131e+06 3.225038e+06 5.730136e+06 9.005243e+06 1.147331e+07 4.343817e+06 5.161279e+06 7.626063e+06 4.544563e+06 8.313575e+06 8.175831e+06 5.300638e+06 3.117725e+06 4.193362e+06 7.152625e+06 9.045262e+06 8.731636e+06 5.528185e+06 7.206323e+06 9.196448e+06 6.469095e+06 4.632122e+06 5.229752e+06 6.390197e+06 3.542303e+06 8.734048e+06 6.155640e+06 8.583139e+06 5.405796e+06 7.477149e+06 8.594857e+06 1.317855e+07 5.669114e+06 8.757253e+06 8.382418e+06 6.541214e+06 4.938486e+06 1.025083e+07 6.508915e+06 4.851670e+06 8.725463e+06 1.045550e+07 5.720706e+06 1.320907e+07 8.804693e+06 1.015663e+07 5.487145e+06 1.328995e+07 5.327410e+06 7.184710e+06 7.079321e+06 6.099821e+06 4.891821e+06 1.619743e+07 7.457393e+06 8.862972e+06 2.570190e+06 8.259045e+06 1.106153e+07 1.276850e+07 5.579360e+06 5.732203e+06 5.279410e+06 5.411345e+06 1.208649e+07 8.487406e+06 1.286273e+07 8.459411e+06 3.494143e+06 3.014338e+06 5.235571e+06 6.829114e+06 9.099263e+06 8.210554e+06 1.184987e+07 7.295561e+06 7.770986e+06 1.015128e+07 8.869524e+06 1.112628e+07 6.920408e+06 4.256956e+06 7.979559e+06 4.605506e+06 3.913821e+06 4.564499e+06 5.748791e+06 4.714125e+06 1.257947e+07 9.863296e+06 1.101618e+07 1.262891e+07 1.052389e+07 3.878356e+06 9.322403e+06 9.483802e+06 4.948716e+06 5.904785e+06 9.363015e+06 1.055983e+07 8.584941e+06 6.954926e+06 1.425776e+07 5.841831e+06 1.272898e+07 1.000891e+07 8.795254e+06 8.196667e+06 2.003305e+07 9.859461e+06 8.740912e+06 1.535624e+07 9.302909e+06 7.750178e+06 1.291107e+07 9.992305e+06 7.364564e+06 1.547959e+07 7.102202e+06 7.858001e+06 1.488949e+07 6.527386e+06 6.912975e+06 7.992320e+06 C38 H83 N5 O8 P2_4.616 1.482090e+05 2.267590e+05 3.861241e+05 3.503201e+05 6.370651e+04 1.548231e+05 2.977830e+05 3.779718e+05 60461.73 2.609369e+05 3.938233e+05 3.030471e+05 66372.52 1.611924e+05 3.224925e+05 3.370415e+05 7.059443e+04 1.518622e+05 3.239375e+05 2.210269e+05 6.551771e+04 3.437859e+05 3.767294e+05 3.872645e+05 33363.598 2.464045e+05 2.260095e+05 3.036791e+05 3.722817e+04 1.749175e+05 3.226186e+05 3.606558e+05 44317.73 2.739914e+05 3.501686e+05 2.535724e+05 5.779313e+04 2.784347e+05 2.955201e+05 2.582667e+05 3.957727e+04 2.917157e+05 3.004463e+05 4.026967e+05 3.609946e+04 1.882354e+05 3.295542e+05 2.750979e+05 7.279244e+05 2.251122e+05 3.379456e+05 5.214104e+05 3.039405e+05 8.022956e+04 1.008231e+06 1.552100e+05 7.585263e+04 9.406586e+04 2.587639e+05 1.004648e+05 5.444929e+05 4.043041e+05 1.296899e+06 5.722944e+05 9.092518e+05 1.439275e+05 1.244652e+05 9.996368e+04 9.483164e+04 1.135115e+05 3.202692e+05 9.853489e+04 2.117372e+05 2.048541e+05 3.126129e+05 1.266827e+05 5.960224e+05 5.620528e+04 1.042047e+05 9.223000e+04 3.309037e+05 9.497204e+05 1.957939e+05 6.547476e+05 6.627756e+04 8.313958e+04 5.130272e+04 6.154497e+04 2.009060e+05 6.780544e+04 1.028212e+06 1.657237e+05 1.466569e+05 1.546657e+05 3.204269e+05 6.411810e+04 1.386013e+05 6.139389e+04 1.874718e+05 1.114849e+05 1.659352e+05 6.435176e+05 6.273557e+04 6.705865e+04 6.956920e+04 7.220868e+04 7.814356e+04 1.471711e+05 2.100097e+06 1.996593e+05 3.388217e+05 5.158399e+05 7.025178e+04 1.178123e+05 2.101319e+05 5.065237e+04 9.384432e+04 7.407746e+04 1.011401e+05 7.152758e+04 5.771893e+04 5.036260e+04 4.960026e+04 8.080204e+04 7.362011e+04 1.179360e+05 5.765627e+04 6.006840e+04 1.563077e+05 1.254805e+05 5.853746e+04 6.212987e+05 5.106903e+04 7.160194e+04 7.438940e+04 2.133409e+05 4.948942e+04 1.907680e+05 6.580929e+04 2.091080e+05 7.927118e+05 7.913927e+04 1.350060e+05 1.356685e+05 7.626277e+04 7.587716e+04 9.179675e+04 1.064895e+05 7.533767e+04 6.766166e+04 2.128197e+05 6.793172e+04 1.283209e+05 1.420680e+06 1.190365e+05 2.804333e+05 1.968872e+05 1.103001e+06 7.583028e+05 5.325340e+05 8.238962e+05 5.767714e+05 2.936756e+05 8.689044e+04 1.708315e+05 8.030215e+04 1.781074e+05 3.780656e+05 2.678261e+05 1.626532e+06 5.098461e+04 3.130719e+05 1.088434e+05 2.501450e+05 1.301010e+05 5.325214e+04 1.764801e+05 2.766643e+05 7.082026e+05 6.115596e+05 3.984854e+05 4.907524e+04 4.838271e+05 1.282507e+06 5.488031e+04 1.988183e+05 1.658109e+05 3.319725e+05 6.414106e+05 6.923471e+04 7.757862e+04 5.267584e+04 9.035929e+04 5.607874e+05 5.931203e+04 4.038787e+05 9.715575e+04 8.931862e+04 6.661626e+04 2.732196e+05 4.976019e+05 7.154865e+05 2.661351e+05 1.842989e+05 3.531002e+05 1.804890e+05 6.182792e+05 9.765949e+04 2.381130e+05 7.047319e+05 6.536382e+04 3.072251e+05 2.708563e+05 1.943425e+05 8.355437e+04 1.134478e+05 7.596442e+05 8.515283e+05 7.410775e+04 2.147871e+05 1.277191e+06 2.743333e+05 2.442679e+05 2.863816e+05 7.528732e+05 5.002811e+05 5.256253e+05 1.369156e+05 4.081307e+05 3.319849e+05 1.141454e+06 6.126259e+04 1.086676e+05 3.044341e+05 2.193941e+06 7.189027e+04 1.100598e+05 6.900103e+04 2.398974e+05 1.131736e+05 1.302504e+06 4.641179e+05 2.662159e+05 5.225982e+05 4.828131e+05 1.487371e+06 1.455988e+06 1.617330e+06 2.156175e+05 1.796730e+05 4.366021e+05 1.541773e+05 1.661393e+05 1.025449e+06 4.738171e+05 1.221920e+06 5.225812e+05 6.476036e+05 6.477783e+04 7.748827e+04 2.758325e+05 1.825415e+05 DL-Dipalmitoylphosphatidylcholine_4.619 3.741785e+07 2.126667e+07 1.943165e+07 2.006758e+07 1.118888e+05 9.339163e+06 1.878633e+07 1.882332e+07 97242.38 1.936463e+07 1.909137e+07 1.848995e+07 90410.97 1.682555e+07 1.836190e+07 1.781126e+07 8.912282e+04 1.644179e+07 1.958262e+07 1.845687e+07 9.745120e+04 1.937630e+07 2.111446e+07 1.029165e+07 54004.372 1.862323e+07 1.989224e+07 1.915751e+07 4.698453e+04 1.767583e+07 1.895242e+07 1.776301e+07 57095.89 1.806327e+07 1.802926e+07 1.889015e+07 8.014839e+04 1.759772e+07 1.796233e+07 1.759025e+07 5.901741e+04 1.821383e+07 1.759815e+07 1.991126e+07 5.694542e+04 1.766427e+07 1.858716e+07 1.739561e+07 1.418583e+07 1.657372e+07 1.730394e+07 1.681921e+07 1.376450e+07 1.313851e+07 1.350292e+07 1.687040e+07 1.147978e+07 1.099885e+07 2.330211e+07 1.774094e+07 2.001803e+07 1.732449e+07 1.777737e+07 2.014151e+07 1.841831e+07 1.929799e+07 1.454739e+07 1.725612e+07 1.405646e+07 1.767960e+07 2.160850e+07 1.963656e+07 2.420851e+07 1.449391e+07 1.550456e+07 1.468218e+07 1.489938e+07 1.782044e+07 2.186075e+07 1.751687e+07 1.850810e+07 2.049217e+07 1.404031e+07 1.910560e+07 1.585001e+07 1.910871e+07 1.701948e+07 1.549855e+07 1.616671e+07 1.310230e+07 1.685174e+07 1.390146e+07 1.295113e+07 2.265923e+07 1.151966e+07 1.185105e+07 2.062393e+07 1.729225e+07 1.659601e+07 1.618595e+07 1.575544e+07 2.387291e+07 1.951556e+07 1.283460e+07 1.952538e+07 2.344674e+07 1.443673e+07 1.717329e+07 3.046804e+07 1.789214e+07 2.067527e+07 1.288463e+07 1.674658e+07 1.876889e+07 1.560250e+07 1.797658e+07 1.188480e+07 1.360048e+07 1.564648e+07 2.698387e+07 1.210452e+07 1.345195e+07 9.566544e+06 1.798878e+07 1.740699e+07 1.962844e+07 2.225415e+07 1.864343e+07 1.579412e+07 1.090677e+07 1.872321e+07 2.349098e+07 2.116682e+07 1.768979e+07 1.509574e+07 1.487614e+07 1.557906e+07 1.822276e+07 1.651144e+07 1.667323e+07 1.696101e+07 2.066209e+07 1.452404e+07 1.236698e+07 1.763568e+07 1.736375e+07 1.227911e+07 2.104192e+07 1.465865e+07 1.279800e+07 2.082005e+07 1.065136e+07 1.306813e+07 1.762346e+07 1.346048e+07 2.401371e+07 1.638750e+07 2.760997e+07 1.157588e+07 1.585474e+07 1.248466e+07 1.853746e+07 1.723289e+07 1.525094e+07 1.920508e+07 1.495722e+07 2.241300e+07 1.425471e+07 1.177741e+07 1.436405e+07 2.882976e+07 1.334811e+07 1.589921e+07 1.799794e+07 1.536810e+07 1.627826e+07 2.045562e+07 1.338605e+07 1.279353e+07 1.391827e+07 1.480980e+07 1.897492e+07 1.383720e+07 1.265113e+07 1.165197e+07 1.581778e+07 2.005462e+07 1.603646e+07 1.468553e+07 1.824835e+07 1.776962e+07 1.401015e+07 1.859686e+07 2.153669e+07 1.129636e+07 1.826093e+07 1.334020e+07 1.306562e+07 1.780810e+07 8.903705e+06 9.170901e+06 1.182421e+07 1.707037e+07 1.066957e+07 2.257009e+07 1.138891e+07 1.758653e+07 1.952743e+07 1.421138e+07 1.517330e+07 1.412021e+07 1.932814e+07 1.678431e+07 1.437434e+07 2.213864e+07 1.364665e+07 1.859815e+07 1.449263e+07 1.586667e+07 1.189117e+07 1.284227e+07 1.159292e+07 1.452350e+07 1.269282e+07 1.383546e+07 1.239375e+07 1.922116e+07 1.855344e+07 2.341339e+07 2.129483e+07 1.469229e+07 1.472021e+07 1.438257e+07 1.524532e+07 1.420404e+07 1.726483e+07 2.004524e+07 1.342760e+07 2.159470e+07 2.211070e+07 1.467330e+07 2.473466e+07 1.548177e+07 1.772210e+07 1.398172e+07 1.794072e+07 1.202088e+07 2.011753e+07 1.112402e+07 1.348469e+07 1.358965e+07 1.487119e+07 2.695862e+07 2.922305e+07 2.126699e+07 1.518484e+07 2.359963e+07 2.195165e+07 2.309547e+07 2.040867e+07 1.756790e+07 1.790840e+07 C48 H86 N O2 P3_4.621 1.335747e+05 6.032656e+05 6.025855e+05 5.315424e+05 1.271350e+05 2.107785e+05 4.956681e+05 6.396575e+05 109867.65 4.700898e+05 6.038646e+05 5.407970e+05 110123.79 4.502567e+05 4.935613e+05 4.490201e+05 1.170346e+05 4.383224e+05 5.795648e+05 4.359101e+05 1.133952e+05 5.022617e+05 5.787113e+05 6.553341e+05 52105.023 3.674465e+05 5.033182e+05 5.526471e+05 4.885234e+04 5.103160e+05 5.257094e+05 4.831237e+05 73341.39 5.084496e+05 4.014886e+05 6.565258e+05 9.513554e+04 4.859512e+05 4.922036e+05 4.118627e+05 7.226626e+04 4.892754e+05 4.839765e+05 5.938286e+05 6.335063e+04 6.264167e+05 4.671350e+05 4.565535e+05 1.032147e+06 4.791282e+05 4.166741e+05 7.336986e+05 5.367297e+05 1.636552e+05 1.179306e+06 4.770938e+05 9.982445e+04 1.311095e+05 5.581302e+05 3.951423e+05 5.395990e+05 6.469107e+05 1.800811e+06 1.033703e+06 1.133915e+06 3.998569e+05 3.300326e+05 2.780030e+05 2.856948e+05 3.189989e+05 7.253361e+05 2.317724e+05 3.648669e+05 3.186607e+05 5.177776e+05 1.890491e+05 7.254285e+05 1.084623e+05 1.113799e+05 1.729598e+05 3.101186e+05 1.716684e+06 3.139532e+05 7.277720e+05 1.866412e+05 2.771608e+05 1.919140e+05 1.017729e+05 2.210915e+05 3.046744e+05 1.407236e+06 2.796866e+05 1.395604e+05 2.849401e+05 5.835773e+05 2.689002e+05 2.299049e+05 1.155783e+05 5.129487e+05 4.267324e+05 2.346368e+05 1.161204e+06 9.340413e+04 3.479807e+05 2.237029e+05 2.959975e+05 1.742449e+05 3.184533e+05 2.040546e+06 2.764928e+05 5.153772e+05 5.979707e+05 9.597016e+04 3.478944e+05 4.554743e+05 1.543910e+05 1.159471e+05 1.082674e+05 1.278176e+05 2.055901e+05 1.167950e+05 9.327115e+04 9.466643e+04 1.368128e+05 1.071140e+05 3.024417e+05 1.542225e+05 9.310182e+04 1.014242e+05 1.827906e+05 9.446232e+04 1.464272e+06 1.010880e+05 1.020977e+05 2.061575e+05 1.054772e+05 9.952802e+04 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1.544855e+06 2.717052e+06 1.826844e+06 3.341137e+06 1.946554e+06 2.000579e+06 2.314446e+06 2.319237e+06 1.539460e+06 2.687635e+06 2.376516e+06 1.642462e+06 1.865034e+06 2.719238e+06 2.017665e+06 2.622216e+06 2.352556e+06 1.179031e+06 2.161281e+06 2.165531e+06 1.561051e+06 2.450676e+06 2.079014e+06 2.036410e+06 1.685210e+06 2.671463e+06 2.212896e+06 2.809693e+06 2.388758e+06 3.282070e+06 2.084840e+06 2.089980e+06 2.876141e+06 2.150081e+06 2.834787e+06 3.061107e+06 2.570119e+06 2.678872e+06 4.064029e+06 2.441341e+06 2.721919e+06 2.432120e+06 2.488800e+06 2.570174e+06 1.604304e+06 2.633574e+06 2.432570e+06 2.542469e+06 2.681487e+06 1.909868e+06 2.454135e+06 3.743531e+06 3.729269e+06 2.548469e+06 1.693600e+06 2.648257e+06 3.583062e+06 3.468723e+06 2.758479e+06 2.431186e+06 2.616666e+06 HYPOXANTHINE 5.066418e+07 7.532631e+07 8.081389e+07 7.796616e+07 1.676061e+05 5.597743e+07 7.498812e+07 7.910300e+07 149396.70 6.866169e+07 8.772837e+07 7.716988e+07 140432.86 7.001697e+07 6.997996e+07 7.491039e+07 3.850531e+05 6.519422e+07 8.068614e+07 7.214079e+07 1.556726e+05 6.587395e+07 7.959720e+07 8.872749e+07 70698.936 7.019008e+07 6.743661e+07 7.538675e+07 7.517816e+04 6.996510e+07 7.434730e+07 8.117528e+07 90068.58 6.884729e+07 7.381084e+07 7.926376e+07 1.261706e+05 7.039823e+07 7.448399e+07 7.500737e+07 1.041655e+05 7.051758e+07 7.074630e+07 8.635571e+07 9.471037e+04 6.911749e+07 6.939877e+07 7.691894e+07 6.154528e+07 2.225020e+07 4.963953e+07 3.423739e+08 1.016229e+08 7.557975e+07 6.192057e+07 8.304952e+07 4.409570e+07 4.138895e+07 3.434052e+07 2.344914e+08 7.687810e+07 4.287338e+07 4.580104e+07 4.169391e+07 1.713855e+08 1.050891e+08 4.978227e+07 4.785604e+07 1.657977e+07 6.266110e+07 3.385612e+08 5.256317e+07 7.492686e+07 2.002412e+08 2.858375e+07 1.066364e+08 4.632349e+07 1.383868e+08 1.141668e+08 7.154583e+07 5.454952e+07 1.413959e+08 5.277141e+07 9.928082e+07 3.533873e+07 9.654681e+07 1.781865e+07 2.907109e+07 3.290057e+07 3.067271e+07 8.158240e+07 2.084083e+08 1.786033e+07 2.839970e+07 3.772055e+07 1.736296e+08 2.055023e+08 3.040389e+07 2.758618e+08 4.418295e+07 2.106704e+07 1.114779e+08 2.893507e+07 1.028332e+08 4.456989e+07 3.449425e+07 5.904523e+07 1.979430e+07 5.520100e+07 5.625521e+07 2.927092e+07 7.112072e+07 6.152714e+07 2.170924e+08 4.525670e+08 2.643978e+07 8.298559e+07 5.850835e+07 1.492136e+07 4.626381e+07 3.664379e+07 2.055905e+07 1.475002e+07 2.142716e+07 2.410119e+07 3.639072e+07 7.547048e+07 2.598670e+07 2.155459e+07 6.208317e+07 1.940288e+07 1.203908e+08 3.198199e+07 2.847476e+07 3.648947e+07 2.829704e+07 4.025042e+07 1.584152e+07 2.506565e+07 2.698026e+07 5.287763e+07 5.156875e+07 3.519814e+07 2.837833e+07 3.448003e+07 3.497094e+07 4.807821e+07 2.998017e+07 4.274514e+07 3.185170e+07 4.262131e+07 5.360455e+07 3.321379e+07 8.796866e+07 6.708876e+07 2.756203e+07 3.568236e+07 7.006868e+07 5.861373e+07 5.551084e+07 6.669671e+07 7.764586e+07 4.035746e+07 3.536432e+07 3.408196e+07 4.608258e+07 5.186748e+07 6.701134e+07 4.822841e+07 7.124879e+07 4.565663e+07 4.751423e+07 1.848378e+07 3.760057e+07 2.665605e+07 9.725157e+07 5.134354e+07 1.112876e+08 3.127375e+07 1.140789e+08 2.736170e+08 2.387808e+07 2.800467e+07 1.206145e+08 1.615539e+08 1.180407e+08 2.900381e+07 2.601074e+07 5.783413e+07 3.007021e+07 3.526583e+07 1.096654e+08 6.300079e+07 1.017989e+08 8.319300e+07 4.139078e+07 3.809596e+07 3.689579e+07 4.261721e+07 3.895398e+07 5.508907e+07 4.565345e+07 2.441711e+07 3.965875e+07 3.665307e+07 2.845245e+08 6.187697e+07 6.165954e+07 3.585694e+07 5.806226e+07 8.482976e+07 3.723322e+07 2.501751e+07 2.580601e+07 1.986992e+08 1.212788e+08 3.841222e+07 3.268238e+07 1.384264e+09 6.914530e+07 2.948474e+07 4.968744e+07 2.397174e+07 3.742719e+07 8.058232e+07 3.830975e+07 5.033789e+07 4.689657e+07 1.196299e+08 3.167675e+07 1.573690e+08 8.434757e+07 8.471093e+07 8.758883e+07 7.914290e+07 3.148264e+07 2.302333e+07 3.331914e+07 1.416782e+07 4.628636e+07 6.031574e+07 6.575591e+07 9.284418e+07 6.575090e+07 1.539740e+08 1.736459e+08 5.875170e+07 5.526485e+07 3.029848e+07 8.070906e+07 7.524790e+07 4.767097e+07 7.651892e+07 6.845166e+07 1.173697e+08 3.306591e+08 5.911352e+07 5.756252e+07 2.716092e+07 2.298012e+07 3.136932e+07 3.780001e+07 C45 H74 N4 O6 P2_4.642 9.178447e+06 4.561426e+06 5.712862e+06 4.614098e+06 1.341640e+05 3.302572e+06 4.821651e+06 4.184222e+06 119552.28 4.563505e+06 4.669814e+06 4.235477e+06 99503.76 5.476933e+06 4.651963e+06 4.061931e+06 9.925959e+04 4.746773e+06 4.813109e+06 4.159903e+06 1.189226e+05 5.327300e+06 5.107122e+06 3.119344e+06 54990.905 4.418848e+06 5.123579e+06 4.374157e+06 5.674792e+04 4.305062e+06 5.044591e+06 4.854451e+06 60522.78 5.176979e+06 4.230135e+06 3.902973e+06 8.157082e+04 4.269175e+06 5.219312e+06 3.939348e+06 6.211532e+04 5.063863e+06 4.769871e+06 5.121730e+06 5.875532e+04 4.440295e+06 4.112469e+06 4.684413e+06 4.728614e+06 5.054424e+06 4.315738e+06 3.414007e+06 3.571135e+06 4.348868e+06 3.117630e+06 4.207369e+06 3.794834e+06 3.903799e+06 5.850627e+06 4.424593e+06 5.395722e+06 6.535587e+06 2.952930e+06 4.567330e+06 4.141749e+06 4.936714e+06 4.199606e+06 5.013024e+06 5.522911e+06 5.849669e+06 3.822635e+06 5.589510e+06 5.607046e+06 4.406561e+06 3.914265e+06 4.177360e+06 4.298951e+06 4.574123e+06 4.310633e+06 4.455466e+06 3.670325e+06 5.297242e+06 4.700789e+06 3.401138e+06 4.683251e+06 3.855866e+06 4.931055e+06 6.078655e+06 5.830547e+06 4.659414e+06 3.590490e+06 2.878125e+06 4.399043e+06 4.727818e+06 2.699246e+06 3.429971e+06 4.773134e+06 4.396110e+06 3.766534e+06 5.386481e+06 4.264716e+06 6.183542e+06 6.276098e+06 3.775911e+06 4.925143e+06 5.471155e+06 4.604504e+06 4.568683e+06 9.119908e+06 5.325090e+06 6.196107e+06 3.721978e+06 4.749788e+06 5.194766e+06 4.165798e+06 6.581344e+06 3.576039e+06 4.290773e+06 5.092921e+06 5.781034e+06 3.846972e+06 3.784045e+06 3.519349e+06 3.963476e+06 3.496731e+06 4.073807e+06 5.717683e+06 5.689551e+06 3.850141e+06 3.511806e+06 5.884084e+06 4.305593e+06 4.685810e+06 5.250082e+06 4.133799e+06 3.415561e+06 2.175662e+06 4.805748e+06 3.719161e+06 4.581551e+06 3.884733e+06 5.286429e+06 3.570928e+06 5.058577e+06 4.403453e+06 4.915524e+06 4.301278e+06 4.949194e+06 3.183102e+06 4.634779e+06 5.281825e+06 4.473543e+06 4.176296e+06 4.449455e+06 4.371531e+06 6.115984e+06 5.335602e+06 7.705717e+06 3.365643e+06 3.738696e+06 3.298952e+06 4.310867e+06 4.045286e+06 4.248212e+06 5.093340e+06 2.944020e+06 5.535488e+06 3.332741e+06 3.416957e+06 2.662085e+06 6.317688e+06 3.429861e+06 4.136716e+06 6.013941e+06 4.204996e+06 3.832816e+06 5.250786e+06 3.097820e+06 3.861346e+06 3.991283e+06 2.754502e+06 4.530684e+06 2.277359e+06 2.461880e+06 4.758240e+06 3.670948e+06 5.212295e+06 5.116368e+06 4.362293e+06 4.761477e+06 4.950682e+06 4.382329e+06 5.594213e+06 5.029940e+06 3.558320e+06 5.317735e+06 4.200525e+06 4.084673e+06 5.425433e+06 3.494631e+06 2.553592e+06 3.478238e+06 3.714141e+06 3.723378e+06 6.522759e+06 3.150911e+06 6.022308e+06 5.839281e+06 5.663804e+06 3.946034e+06 3.916169e+06 4.396569e+06 3.873307e+06 4.308037e+06 5.663676e+06 3.755754e+06 4.644999e+06 3.943509e+06 2.993779e+06 4.563226e+06 4.519983e+06 3.539432e+06 5.175909e+06 4.453969e+06 4.368154e+06 3.246709e+06 3.622947e+06 4.124465e+06 4.559641e+06 4.941292e+06 4.276966e+06 3.472115e+06 3.759931e+06 4.374457e+06 4.175179e+06 4.346873e+06 5.054616e+06 4.119112e+06 5.810667e+06 6.098244e+06 3.314434e+06 7.009484e+06 4.590931e+06 4.493882e+06 4.363227e+06 4.329200e+06 3.432169e+06 4.231831e+06 3.682695e+06 3.108686e+06 3.330971e+06 4.682709e+06 7.975420e+06 3.630314e+06 4.660032e+06 2.915625e+06 5.753780e+06 6.147351e+06 4.406202e+06 5.909395e+06 5.039071e+06 3.971705e+06 C42 H78 N O P3_4.643 1.051908e+07 4.707177e+06 5.313317e+06 4.878796e+06 1.121826e+05 2.908321e+06 4.600647e+06 4.614530e+06 108089.42 4.412152e+06 5.062792e+06 4.825746e+06 98753.61 4.087151e+06 4.274668e+06 4.681499e+06 1.000044e+05 4.191048e+06 5.205889e+06 4.347372e+06 1.149645e+05 4.220856e+06 5.034019e+06 4.176005e+06 50195.698 4.058184e+06 5.083030e+06 4.699109e+06 5.589604e+04 3.846448e+06 4.670704e+06 5.043678e+06 64672.92 4.514326e+06 4.301758e+06 4.802113e+06 9.329137e+04 4.365335e+06 4.964151e+06 4.088849e+06 7.704064e+04 3.463176e+06 4.956883e+06 5.432500e+06 6.376896e+04 4.277372e+06 4.074030e+06 4.733174e+06 2.057023e+06 3.180200e+06 1.790805e+06 3.767341e+06 4.613575e+06 3.691849e+06 2.944146e+06 6.686160e+06 1.407522e+06 2.938903e+06 1.008170e+07 2.721447e+06 5.360154e+06 3.044532e+06 3.684997e+06 3.406150e+06 1.103834e+07 3.782570e+06 2.886677e+06 4.840283e+06 2.748876e+06 3.099661e+06 7.919056e+06 5.508146e+06 6.364076e+06 2.260211e+06 4.176187e+06 2.600700e+06 4.463290e+06 7.559412e+06 3.705634e+06 2.580865e+06 6.432995e+06 3.850855e+06 3.454866e+06 7.976793e+06 5.819303e+06 4.109691e+06 6.797421e+06 2.205595e+06 8.549089e+06 3.014009e+06 7.076834e+06 4.046795e+06 1.935501e+06 4.179514e+06 5.184966e+06 1.763071e+06 4.330435e+06 6.161666e+06 3.572011e+06 4.448844e+06 4.626759e+06 7.172143e+06 9.173772e+06 2.155144e+06 1.720436e+06 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1.361736e+06 1.482826e+06 4.463365e+05 9.945431e+05 6.418597e+05 9.388599e+06 1.763463e+06 1.678256e+06 1.076763e+06 1.585073e+06 2.432996e+06 4.504697e+05 7.968089e+05 6.796030e+05 5.126712e+06 2.611448e+06 8.090327e+05 6.828098e+05 1.571543e+07 2.077095e+06 8.581769e+05 1.036749e+06 8.782251e+05 1.602137e+06 2.221171e+06 1.129586e+06 1.115773e+06 7.409420e+05 1.835442e+06 6.461722e+05 3.183619e+06 1.492903e+06 2.396618e+06 2.557328e+06 1.993951e+06 6.859949e+05 6.795941e+05 9.595569e+05 1.673566e+05 1.394074e+06 1.595547e+06 1.516506e+06 1.860450e+06 1.665524e+06 3.098771e+06 3.716487e+06 1.365391e+06 9.769454e+05 8.923753e+05 1.582403e+06 1.352458e+06 1.484180e+06 1.308094e+06 1.608634e+06 2.668900e+06 4.062999e+06 1.179233e+06 1.130037e+06 6.188226e+05 5.073779e+05 7.457665e+05 7.352964e+05 156.5187_4.664 7.391362e+05 1.117852e+06 1.219119e+06 1.258746e+06 9.685563e+04 7.332174e+05 1.009107e+06 1.330362e+06 89280.82 1.172037e+06 1.258532e+06 1.104233e+06 89765.78 1.020190e+06 1.066594e+06 9.211841e+05 9.595078e+04 1.036954e+06 1.382363e+06 1.140695e+06 1.141533e+05 9.197395e+05 1.149527e+06 1.421426e+06 44472.564 9.564868e+05 1.050222e+06 1.159770e+06 5.386597e+04 9.011897e+05 1.317117e+06 1.243260e+06 70234.59 1.011791e+06 1.020735e+06 1.241013e+06 1.020269e+05 9.002363e+05 1.304365e+06 1.049233e+06 8.299698e+04 1.011278e+06 1.058451e+06 1.429865e+06 7.199107e+04 8.967842e+05 1.183557e+06 1.075453e+06 1.228335e+06 3.640128e+05 6.889951e+05 5.539689e+06 1.436352e+06 1.335060e+06 9.645165e+05 1.295804e+06 6.284716e+05 7.248220e+05 4.959875e+05 4.612288e+06 1.401696e+06 8.107964e+05 5.494152e+05 4.301971e+05 2.214812e+06 1.475280e+06 8.084808e+05 5.858427e+05 2.863352e+05 9.163229e+05 4.004393e+06 9.760293e+05 7.351581e+05 3.219842e+06 3.714565e+05 1.751023e+06 6.738073e+05 1.864349e+06 2.022846e+06 1.142140e+06 8.145118e+05 1.665880e+06 5.669139e+05 1.089901e+06 2.588519e+05 1.007301e+06 3.023339e+05 7.634218e+05 5.173728e+05 4.169420e+05 9.169885e+05 4.930758e+06 2.752833e+05 3.066439e+05 3.696943e+05 3.095501e+06 3.234003e+06 4.340813e+05 3.977435e+06 9.449399e+05 3.096522e+05 1.870980e+06 1.914430e+05 1.604951e+06 6.834879e+05 3.740515e+05 9.085783e+05 2.064639e+05 6.900961e+05 8.250997e+05 3.811946e+05 1.158940e+06 1.096812e+06 2.518060e+06 4.345263e+06 3.525042e+05 1.271177e+06 1.613161e+06 2.050358e+05 6.178247e+05 6.001870e+05 3.561830e+05 1.578492e+05 7.521918e+04 1.348857e+05 1.115962e+05 8.031338e+05 3.888659e+05 1.399977e+05 1.544365e+06 1.823512e+05 1.614693e+06 4.215075e+05 5.191729e+05 3.179143e+05 4.902097e+05 3.883768e+05 1.059090e+05 1.715764e+05 3.892857e+05 6.881988e+05 7.289075e+05 6.289496e+05 5.342592e+05 5.770661e+05 5.048130e+05 9.978629e+05 4.222268e+05 5.504983e+05 5.466638e+05 4.354997e+05 8.877897e+05 6.008138e+05 1.058748e+06 9.728332e+05 3.521297e+05 3.789350e+05 5.845734e+05 8.471163e+05 1.057678e+06 7.183910e+05 1.506785e+06 2.152798e+05 3.609196e+05 5.523298e+05 5.835232e+05 5.834665e+05 9.545715e+05 7.190605e+05 1.129310e+06 3.761536e+05 4.838669e+05 2.083818e+05 6.573431e+05 4.231811e+05 1.266341e+06 8.124687e+05 2.154107e+06 5.033925e+05 2.323074e+06 2.627579e+06 2.637295e+05 3.515118e+05 1.554311e+06 3.787341e+06 1.300088e+06 3.416972e+05 3.737878e+05 9.679342e+05 4.973631e+05 3.426174e+05 1.926202e+06 6.556899e+05 1.186852e+06 1.175997e+06 5.762998e+05 7.571808e+05 6.241686e+05 5.432438e+05 1.066513e+06 9.344316e+05 9.863163e+05 1.390865e+05 5.633521e+05 4.233569e+05 6.525256e+06 9.245588e+05 7.304120e+05 7.690939e+05 9.804671e+05 1.382577e+06 1.705553e+05 3.673623e+05 2.830516e+05 2.641934e+06 1.752994e+06 4.474732e+05 4.263426e+05 1.274268e+07 1.517691e+06 3.424126e+05 7.003501e+05 4.317175e+05 1.096832e+06 1.438451e+06 7.379302e+05 6.849589e+05 4.908369e+05 1.289219e+06 3.571814e+05 2.417009e+06 1.084911e+06 1.552858e+06 1.594223e+06 1.253742e+06 3.535943e+05 3.337876e+05 5.872530e+05 2.533729e+05 6.676209e+05 8.837009e+05 9.496103e+05 1.196672e+06 9.360388e+05 2.182519e+06 2.077295e+06 8.349410e+05 5.673118e+05 5.432354e+05 1.177578e+06 7.224826e+05 7.917718e+05 9.225890e+05 8.602263e+05 1.759106e+06 2.816141e+06 7.859368e+05 5.791256e+05 3.048491e+05 1.305469e+05 4.435213e+05 4.336516e+05 C10 H6 N5 O4 P_4.666 9.719556e+05 1.553083e+06 1.369885e+06 1.605867e+06 1.005245e+05 1.043634e+06 1.545688e+06 1.672129e+06 86628.56 1.212189e+06 1.680869e+06 1.693822e+06 80529.47 1.248774e+06 1.334980e+06 1.382439e+06 8.330573e+04 1.363818e+06 1.419602e+06 1.636802e+06 8.988478e+04 1.162321e+06 1.458163e+06 2.080849e+06 37634.349 1.150504e+06 1.501334e+06 1.357624e+06 5.011708e+04 1.208385e+06 1.380609e+06 1.578418e+06 65084.90 1.436997e+06 1.489000e+06 1.593311e+06 8.808893e+04 1.304071e+06 1.427448e+06 1.503571e+06 7.099169e+04 1.389359e+06 1.365191e+06 1.645309e+06 6.237012e+04 1.333543e+06 1.417894e+06 1.482740e+06 1.804422e+06 4.513008e+05 7.540056e+05 5.958778e+06 1.828859e+06 1.643343e+06 1.320600e+06 2.066802e+06 9.810555e+05 1.017156e+06 8.234542e+05 5.651184e+06 1.726458e+06 1.111098e+06 7.803153e+05 6.969480e+05 2.819428e+06 1.853373e+06 8.641132e+05 9.432519e+05 5.308683e+05 1.390603e+06 6.193181e+06 1.094574e+06 1.005017e+06 4.227101e+06 4.981021e+05 2.346811e+06 8.115318e+05 2.290310e+06 3.019796e+06 1.659121e+06 1.151053e+06 1.994444e+06 7.862737e+05 1.378210e+06 3.542881e+05 1.010819e+06 5.491164e+05 1.036947e+06 7.059927e+05 5.051679e+05 1.502414e+06 5.942027e+06 4.330315e+05 3.681122e+05 6.295571e+05 3.909328e+06 4.217731e+06 6.113600e+05 5.811551e+06 1.093639e+06 5.019334e+05 2.857646e+06 3.264355e+05 2.487370e+06 8.467025e+05 7.478706e+05 1.185335e+06 4.161019e+05 9.210700e+05 1.038907e+06 4.876281e+05 1.728634e+06 1.503265e+06 2.916698e+06 6.848317e+06 4.921172e+05 1.465700e+06 1.900915e+06 3.133378e+05 8.289955e+05 7.073033e+05 4.352631e+05 3.238768e+05 2.643060e+05 2.356457e+05 1.764496e+05 7.419835e+05 5.550774e+05 2.402773e+05 1.807363e+06 3.029461e+05 2.324427e+06 6.536140e+05 7.255024e+05 6.374802e+05 5.626998e+05 4.343548e+05 2.373957e+05 2.634087e+05 5.542558e+05 9.489084e+05 1.141292e+06 9.478039e+05 7.645240e+05 8.634212e+05 8.175786e+05 1.421865e+06 9.137841e+05 7.776643e+05 6.439509e+05 4.809750e+05 1.380118e+06 8.460718e+05 1.327375e+06 1.147470e+06 5.676432e+05 9.447330e+05 5.981895e+05 1.017052e+06 1.227773e+06 7.101447e+05 1.598738e+06 2.785738e+05 5.839520e+05 8.176585e+05 9.165582e+05 1.007492e+06 1.355766e+06 9.543717e+05 1.386521e+06 4.687197e+05 6.011859e+05 2.654525e+05 8.482212e+05 4.559942e+05 1.673393e+06 1.239586e+06 2.294808e+06 6.051743e+05 3.355326e+06 3.276974e+06 4.916004e+05 3.907564e+05 1.749509e+06 4.641649e+06 1.550679e+06 7.580852e+05 5.001700e+05 1.449353e+06 6.036108e+05 5.067741e+05 2.260834e+06 8.559658e+05 1.266794e+06 1.232218e+06 5.856602e+05 1.123208e+06 6.896685e+05 7.922045e+05 1.393298e+06 1.203371e+06 1.140254e+06 3.274195e+05 7.871833e+05 5.419545e+05 7.644784e+06 1.265130e+06 1.102806e+06 9.337536e+05 1.253114e+06 2.122338e+06 2.089659e+05 5.798767e+05 4.651911e+05 2.944792e+06 1.965770e+06 6.134401e+05 5.014777e+05 1.725049e+07 2.176568e+06 6.307060e+05 7.114512e+05 7.320426e+05 1.432006e+06 1.624310e+06 1.005727e+06 7.292475e+05 6.348656e+05 1.300009e+06 5.258756e+05 2.829122e+06 1.215642e+06 2.282891e+06 2.141346e+06 1.833243e+06 5.514102e+05 5.021455e+05 8.947971e+05 7.648917e+04 1.122318e+06 1.360648e+06 1.214852e+06 1.479033e+06 1.498233e+06 2.952873e+06 2.370861e+06 1.224390e+06 1.079019e+06 8.849266e+05 1.119882e+06 9.064353e+05 1.225192e+06 9.297867e+05 1.190125e+06 2.421927e+06 2.941644e+06 9.844589e+05 9.230687e+05 5.229426e+05 4.118955e+05 6.731415e+05 6.973286e+05 C8 H9 N O6 P2_4.667 7.055541e+05 1.120621e+06 1.207726e+06 1.089542e+06 7.754893e+04 7.344078e+05 1.176076e+06 1.175205e+06 69126.07 9.999798e+05 1.308991e+06 1.130754e+06 66236.13 1.006882e+06 9.528424e+05 1.079179e+06 7.084615e+04 9.961535e+05 1.208902e+06 1.082476e+06 8.247901e+04 1.012740e+06 1.096756e+06 1.307298e+06 36327.806 9.430782e+05 9.746063e+05 1.138482e+06 4.279801e+04 1.036215e+06 1.203632e+06 9.791595e+05 53360.31 1.119150e+06 1.085108e+06 1.060357e+06 7.189341e+04 1.127199e+06 1.261539e+06 8.429862e+05 6.205751e+04 9.764138e+05 1.231159e+06 1.192623e+06 5.486701e+04 9.804483e+05 1.042830e+06 1.129547e+06 9.269542e+05 2.886319e+05 7.114074e+05 4.903899e+06 1.501786e+06 1.380696e+06 8.024834e+05 1.207834e+06 7.308224e+05 6.029170e+05 3.873620e+05 3.746263e+06 8.702604e+05 5.043212e+05 4.280107e+05 5.314354e+05 2.274146e+06 1.525670e+06 8.084207e+05 6.415580e+05 2.366640e+05 1.027497e+06 3.789286e+06 1.014793e+06 7.714451e+05 3.140872e+06 3.228093e+05 1.570959e+06 6.525833e+05 2.236541e+06 1.727969e+06 1.138710e+06 8.587573e+05 2.045626e+06 7.884230e+05 1.263028e+06 4.204090e+05 1.203877e+06 1.871271e+05 4.973986e+05 4.600135e+05 4.919326e+05 1.112549e+06 3.273206e+06 2.522683e+05 3.823281e+05 5.051851e+05 2.653550e+06 2.696323e+06 5.153778e+05 3.938618e+06 7.222102e+05 2.885617e+05 1.523641e+06 3.206084e+05 1.646509e+06 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2.845154e+05 1.996372e+05 3.590584e+05 3.659489e+05 C33 H71 N5 O15 S_4.669 1.071005e+06 2.045322e+06 2.429400e+06 2.575610e+06 1.514232e+05 1.688893e+06 3.179285e+06 2.610522e+06 164635.72 1.987498e+06 1.605741e+06 2.997369e+06 160569.38 1.787655e+06 1.923853e+06 2.684877e+06 1.454046e+05 2.379603e+06 2.411026e+06 2.156410e+06 1.452358e+05 2.147348e+06 2.289023e+06 2.930919e+06 59623.661 2.023837e+06 2.381732e+06 1.996287e+06 7.044925e+04 2.125438e+06 2.238346e+06 2.272472e+06 96580.44 2.744170e+06 2.292098e+06 2.261287e+06 1.061055e+05 2.132049e+06 2.362157e+06 1.984005e+06 8.192239e+04 2.444346e+06 2.348067e+06 2.965260e+06 7.262325e+04 1.898013e+06 1.935935e+06 2.507969e+06 5.571907e+06 3.007435e+06 1.319867e+06 2.492032e+06 2.716564e+06 5.066364e+05 5.792311e+06 2.590587e+06 5.000440e+05 9.584290e+05 2.273244e+06 1.558724e+06 3.269230e+06 3.141404e+06 8.057774e+06 2.759484e+06 4.226616e+06 1.897035e+06 1.241164e+06 1.359843e+06 1.924952e+06 1.366334e+06 2.126430e+06 9.090922e+05 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3.367730e+06 7.036234e+05 2.212815e+06 2.140743e+06 5.959418e+06 1.711438e+05 3.241701e+06 2.758621e+06 1.793017e+07 2.486172e+06 2.711887e+06 8.651919e+05 2.081667e+06 1.863750e+06 6.587567e+06 3.150231e+06 1.297099e+06 3.557396e+06 3.592728e+06 9.681381e+06 6.365455e+06 5.039896e+06 2.248691e+06 2.433039e+06 2.513330e+06 2.061050e+06 1.032260e+06 3.941413e+06 3.683078e+06 3.627474e+06 3.949912e+06 2.182411e+06 8.718041e+05 5.347350e+05 2.490585e+06 1.515777e+06 C9 H16 N O7 P S_4.669 7.301824e+05 1.099717e+06 1.300660e+06 1.241822e+06 7.955586e+04 7.853861e+05 1.012960e+06 1.347056e+06 76470.67 1.188020e+06 1.280511e+06 1.124975e+06 77319.44 1.039418e+06 1.086336e+06 9.374026e+05 8.254120e+04 1.055031e+06 1.405429e+06 1.160002e+06 9.072043e+04 9.355515e+05 1.172462e+06 1.457694e+06 38650.754 9.840178e+05 1.037862e+06 1.219498e+06 4.802590e+04 9.513537e+05 1.199774e+06 1.320046e+06 62943.84 1.071839e+06 9.799119e+05 1.285916e+06 8.701981e+04 9.286126e+05 1.331651e+06 1.066014e+06 7.125690e+04 1.026820e+06 1.075770e+06 1.459812e+06 6.225423e+04 9.179410e+05 1.221264e+06 1.070928e+06 1.264802e+06 3.708706e+05 7.101286e+05 5.645685e+06 1.516288e+06 1.399400e+06 9.817527e+05 1.392857e+06 6.399225e+05 7.135781e+05 5.145337e+05 4.066314e+06 1.491428e+06 8.318969e+05 5.594643e+05 4.408187e+05 2.256013e+06 1.516293e+06 8.055915e+05 6.164406e+05 2.911005e+05 9.728939e+05 4.023613e+06 1.020366e+06 7.531046e+05 3.247099e+06 3.898001e+05 1.987660e+06 6.850148e+05 1.897214e+06 2.059684e+06 1.164622e+06 7.838174e+05 1.694271e+06 5.814035e+05 1.109473e+06 2.631827e+05 9.544831e+05 3.104661e+05 7.777252e+05 5.269211e+05 4.263473e+05 9.760848e+05 4.227745e+06 2.858319e+05 3.117731e+05 3.766082e+05 2.901974e+06 3.287543e+06 4.406691e+05 4.514563e+06 9.625987e+05 3.152657e+05 1.981026e+06 1.974474e+05 1.687260e+06 7.132477e+05 3.994101e+05 9.605398e+05 2.183955e+05 7.192085e+05 8.666947e+05 4.060891e+05 1.187031e+06 1.141970e+06 2.556204e+06 5.465614e+06 3.518938e+05 1.297511e+06 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1.379316e+05 7.962022e+06 7.446814e+06 1.003384e+07 56821.184 8.034431e+06 8.613283e+06 6.552443e+06 6.810729e+04 6.792752e+06 8.120838e+06 8.671413e+06 156363.92 8.913929e+06 7.442866e+06 7.476643e+06 9.716522e+04 9.019642e+06 8.499033e+06 8.518289e+06 8.115054e+04 6.829032e+06 8.986764e+06 7.859820e+06 7.610826e+04 6.840993e+06 8.101384e+06 8.654402e+06 9.557509e+06 6.792305e+06 8.515343e+06 7.767846e+06 8.344337e+06 7.806744e+06 9.545479e+06 9.510629e+06 6.560487e+06 9.501161e+06 1.476826e+07 1.166178e+07 8.592031e+06 9.875257e+06 1.061689e+07 9.004351e+06 5.328724e+06 7.866483e+06 6.221394e+06 4.495868e+06 9.190219e+06 9.801677e+06 9.529773e+06 9.720779e+06 5.883120e+06 5.120361e+06 1.114691e+07 9.166227e+06 6.471836e+06 4.617419e+06 1.491567e+07 9.387624e+06 5.871852e+06 7.667097e+06 3.972572e+06 7.423404e+06 2.647188e+06 5.806742e+06 9.974816e+06 1.133916e+07 8.034678e+06 4.682786e+06 7.430545e+06 8.372154e+06 8.045203e+06 8.120882e+06 8.660845e+06 9.792060e+06 9.769752e+06 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9.131635e+06 5.927236e+06 9.046953e+06 9.242902e+06 4.920005e+06 8.588357e+06 6.075872e+06 1.254455e+07 8.530026e+06 9.187911e+06 1.599648e+07 C42 H76 N9 O6 P3_4.673 4.783505e+06 2.937598e+06 3.422253e+06 3.150141e+06 1.503134e+05 1.825833e+06 3.010548e+06 3.301432e+06 141784.81 2.623812e+06 2.988402e+06 3.454770e+06 132071.90 2.667740e+06 2.547107e+06 3.118368e+06 1.389859e+05 2.854389e+06 3.043108e+06 2.791281e+06 1.498091e+05 2.304600e+06 2.918323e+06 3.796746e+06 58173.260 2.652695e+06 3.113064e+06 2.636281e+06 6.782301e+04 2.769377e+06 2.643778e+06 3.342587e+06 97404.17 3.053867e+06 2.473750e+06 2.861696e+06 1.048456e+05 3.038662e+06 2.988308e+06 2.767397e+06 8.002474e+04 2.744214e+06 2.670723e+06 4.240360e+06 7.607321e+04 2.549173e+06 2.411398e+06 2.925376e+06 3.035896e+06 3.247272e+06 1.688847e+06 2.898101e+06 3.044016e+06 2.174126e+06 5.018035e+06 4.466054e+06 3.331252e+06 4.491748e+06 6.916883e+06 5.838025e+06 3.695450e+06 4.169613e+06 4.841086e+06 3.531684e+06 2.582857e+06 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3.802137e+06 5.343115e+06 3.848236e+06 5.788259e+06 5.882608e+06 5.693887e+06 6.884234e+06 8.155468e+06 8.906239e+06 6.639018e+06 8.139256e+06 7.214889e+06 5.645427e+06 5.342818e+06 3.547738e+06 6.500047e+06 7.759257e+06 4.055980e+06 5.796484e+06 6.380225e+06 7.251665e+06 2.579030e+06 4.993814e+06 7.227210e+06 3.524407e+06 5.178229e+06 2.680307e+06 5.640192e+06 7.344248e+06 5.193608e+06 6.329372e+06 6.442813e+06 6.261901e+06 5.954581e+06 3.387643e+06 3.997264e+06 4.546868e+06 6.732266e+06 5.988750e+06 4.249637e+06 6.190182e+06 6.105510e+06 5.632390e+06 8.161703e+06 3.167947e+06 6.886097e+06 4.781839e+06 4.479084e+06 7.587763e+06 3.163121e+06 7.205121e+06 5.267751e+06 6.795451e+06 6.337036e+06 4.281864e+06 6.096993e+06 3.768316e+06 3.926841e+06 4.392890e+06 4.444698e+06 8.891861e+06 6.323250e+06 5.625005e+06 1.139357e+07 6.270522e+06 7.865384e+06 5.465194e+06 5.150061e+06 4.725719e+06 7.084304e+06 6.279873e+06 5.003296e+06 7.202684e+06 2.842654e+06 6.367180e+06 1.782253e+06 6.164949e+06 5.356407e+06 4.625838e+06 4.892098e+06 5.143157e+06 4.791763e+06 4.911482e+06 7.586470e+06 8.276194e+06 3.836811e+06 8.314120e+06 9.275049e+06 5.794091e+06 6.028189e+06 4.296971e+06 4.848199e+06 3.361165e+06 5.363150e+06 5.327694e+06 4.312017e+06 6.546129e+06 7.499581e+06 5.585426e+06 5.572846e+06 7.972093e+06 7.075406e+06 3.758076e+06 6.992098e+06 6.050324e+06 5.358021e+06 5.038393e+06 6.271300e+06 5.232382e+06 4.526687e+06 6.005872e+06 4.757476e+06 7.994856e+06 4.871462e+06 3.840124e+06 6.908790e+06 3.325126e+06 4.792434e+06 5.837230e+06 2.849052e+06 5.893501e+06 4.936309e+06 6.193274e+06 5.546008e+06 5.853480e+06 5.662346e+06 C3 H7 N3 O_4.678 2.026383e+07 1.563972e+07 1.535138e+07 1.047112e+07 1.689922e+05 1.254870e+07 1.453876e+07 1.527504e+07 176588.44 1.463672e+07 1.018794e+07 1.494030e+07 357170.18 1.365350e+07 1.445262e+07 1.371627e+07 1.673446e+05 1.392058e+07 1.413224e+07 1.397288e+07 1.834753e+05 1.193661e+07 1.434445e+07 1.669566e+07 77507.409 1.109328e+07 1.409284e+07 1.354222e+07 8.872947e+04 1.360097e+07 1.371289e+07 1.442217e+07 128635.22 1.402892e+07 1.275449e+07 1.403952e+07 1.463795e+05 1.294344e+07 1.637245e+07 1.401887e+07 1.235969e+05 1.088585e+07 1.427665e+07 1.665011e+07 1.209602e+05 1.140149e+07 1.294025e+07 1.457809e+07 1.595760e+07 1.414894e+07 1.309855e+07 1.524005e+07 1.014792e+07 1.520628e+07 1.709932e+07 1.686173e+07 1.596097e+07 1.688432e+07 1.767500e+07 1.274857e+07 1.634187e+07 1.617554e+07 1.586950e+07 1.437356e+07 1.390133e+07 1.515157e+07 1.312904e+07 1.617303e+07 1.387585e+07 1.416705e+07 1.128039e+07 1.495209e+07 1.205786e+07 1.286662e+07 1.516599e+07 1.553082e+07 1.408178e+07 1.317025e+07 1.858113e+07 1.439515e+07 1.289980e+07 1.332194e+07 1.037874e+07 1.122054e+07 8.842524e+06 1.152921e+07 1.682649e+07 1.946782e+07 1.643857e+07 1.196194e+07 1.305869e+07 1.735283e+07 1.849362e+07 1.448473e+07 1.405341e+07 1.091241e+07 1.487459e+07 1.382232e+07 1.335247e+07 1.443226e+07 1.389815e+07 1.190971e+07 1.226556e+07 1.434834e+07 1.390524e+07 1.369146e+07 1.298416e+07 1.231399e+07 1.478425e+07 1.697774e+07 1.434215e+07 1.415334e+07 1.862718e+07 1.155782e+07 1.286743e+07 1.443199e+07 1.567240e+07 1.863447e+07 1.662609e+07 1.307711e+07 1.570023e+07 1.189317e+07 1.436297e+07 1.223883e+07 1.109906e+07 7.488381e+06 1.046971e+07 1.433485e+07 1.202911e+07 1.715557e+07 1.525416e+07 1.215208e+07 1.415543e+07 1.628854e+07 1.364250e+07 1.712726e+07 1.110458e+07 1.517628e+07 1.152203e+07 1.380512e+07 9.813071e+06 1.510239e+07 1.654056e+07 1.644773e+07 1.679824e+07 1.430839e+07 1.608417e+07 1.651980e+07 1.315603e+07 1.136415e+07 1.184721e+07 1.703585e+07 1.754984e+07 1.246085e+07 1.457169e+07 1.450929e+07 1.410112e+07 9.688801e+06 1.342375e+07 1.738067e+07 6.682067e+06 1.522936e+07 9.468819e+06 1.463629e+07 1.582208e+07 1.342999e+07 1.569524e+07 1.448933e+07 1.477158e+07 1.397955e+07 9.753494e+06 1.135511e+07 1.082848e+07 1.622001e+07 1.520697e+07 1.239678e+07 1.482806e+07 1.501219e+07 1.399088e+07 1.744870e+07 1.098333e+07 1.478283e+07 1.162725e+07 1.258540e+07 1.597042e+07 1.030422e+07 1.714373e+07 1.435661e+07 1.664997e+07 1.458733e+07 1.031792e+07 1.778443e+07 1.132795e+07 1.162022e+07 7.933183e+06 1.424097e+07 2.059766e+07 1.518668e+07 1.254409e+07 1.852971e+07 1.523053e+07 1.570265e+07 1.380020e+07 1.349222e+07 8.428570e+06 1.603865e+07 1.377783e+07 1.346119e+07 1.571089e+07 1.054175e+07 1.197381e+07 7.142630e+06 1.406629e+07 1.089586e+07 1.089595e+07 8.951938e+06 1.351143e+07 1.303914e+07 1.483514e+07 1.651735e+07 1.369643e+07 1.153244e+07 1.684087e+07 1.806724e+07 1.400005e+07 1.523338e+07 1.301240e+07 1.293776e+07 1.140427e+07 1.307919e+07 1.464695e+07 1.196720e+07 1.719507e+07 1.672077e+07 1.485912e+07 1.034496e+07 2.035240e+07 1.618380e+07 1.165784e+07 1.836102e+07 1.578349e+07 1.486657e+07 1.214726e+07 1.668899e+07 1.263489e+07 1.125504e+07 1.497380e+07 1.242007e+07 1.684791e+07 1.386383e+07 1.095831e+07 1.592582e+07 1.214314e+07 1.454723e+07 1.587541e+07 1.040187e+07 1.351396e+07 1.324782e+07 1.656699e+07 1.240550e+07 1.090642e+07 1.637678e+07 C18 H39 N O2_4.678 5.541019e+05 3.428891e+05 4.491434e+05 3.620723e+05 1.086066e+05 2.064654e+05 3.279524e+05 3.740558e+05 106355.91 3.801007e+05 3.904836e+05 4.190777e+05 107309.83 2.674579e+05 3.321408e+05 3.205537e+05 1.237743e+05 3.805933e+05 2.861692e+05 3.019808e+05 1.347120e+05 3.960176e+05 4.040165e+05 3.855526e+05 54901.201 3.285186e+05 2.894138e+05 4.058296e+05 6.296827e+04 3.121122e+05 3.528457e+05 3.649599e+05 93251.98 2.965306e+05 5.066973e+05 2.817210e+05 1.197478e+05 3.367762e+05 2.971697e+05 3.913427e+05 1.022426e+05 2.904187e+05 3.538099e+05 4.024345e+05 7.913738e+04 3.097307e+05 3.080420e+05 3.928991e+05 2.105722e+05 1.009127e+05 2.897627e+05 2.106009e+06 3.794204e+05 4.984928e+05 4.039881e+05 3.497940e+05 3.549773e+05 3.444180e+05 3.976277e+05 7.984908e+05 3.019324e+05 3.637778e+05 2.577287e+05 2.449486e+05 9.354482e+05 4.694504e+05 3.546028e+05 1.160919e+05 4.309769e+05 3.720378e+05 1.472722e+06 3.348261e+05 2.651046e+05 6.630393e+05 1.182718e+05 5.376671e+05 3.205793e+05 1.010535e+06 1.751337e+05 4.358705e+05 5.231776e+05 7.392161e+05 2.746150e+05 4.308834e+05 1.046660e+05 5.040455e+05 1.085926e+05 1.286042e+05 1.233743e+05 9.366215e+04 1.771333e+05 9.873908e+05 1.807850e+05 1.900489e+05 3.434905e+05 7.832151e+05 1.672658e+06 2.001001e+05 1.811096e+06 2.097655e+05 2.291926e+05 2.882824e+05 1.161339e+05 2.014093e+05 1.242627e+05 1.093902e+05 1.070156e+05 1.053502e+05 3.458295e+05 3.843196e+05 1.866537e+05 3.015851e+05 3.094832e+05 1.058690e+06 2.158078e+06 9.451589e+04 3.748416e+05 1.633127e+05 2.543007e+05 4.320500e+05 2.301122e+05 1.388075e+05 1.804834e+05 9.742866e+04 9.614237e+04 1.547991e+05 2.315394e+05 1.545465e+05 7.187073e+04 1.123357e+05 1.495559e+05 4.283911e+05 2.350106e+05 2.747619e+05 1.583614e+05 1.865104e+05 1.818455e+05 1.059860e+05 9.608083e+04 1.088900e+05 1.890391e+05 3.114335e+05 1.094417e+05 2.056401e+05 1.048302e+05 1.748944e+05 1.479786e+05 2.157763e+05 1.803781e+05 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1.158653e+05 2.102886e+05 1.147712e+06 3.187848e+05 4.706117e+05 9.958299e+04 2.424391e+05 3.408976e+05 3.504783e+05 1.995067e+05 1.534684e+05 3.127964e+05 1.113551e+05 4.626217e+05 3.527468e+05 3.355456e+05 4.271251e+05 1.478968e+05 6.756842e+05 7.180731e+05 1.874052e+05 2.166586e+05 1.290186e+05 4.105512e+05 6.402320e+05 3.648744e+05 9.272776e+05 4.004108e+05 7.991659e+05 1.804983e+06 1.242171e+05 8.424873e+05 1.790639e+05 1.455733e+05 3.080769e+05 4.007729e+05 C39 H77 N5 O10 S2_4.679 1.302919e+07 7.122687e+06 6.097340e+06 7.982688e+06 2.113781e+05 3.887199e+06 7.301169e+06 6.255211e+06 196969.63 6.177637e+06 7.451241e+06 6.207989e+06 173543.10 5.585470e+06 6.431876e+06 5.476648e+06 2.080265e+05 7.565238e+06 8.126066e+06 5.503982e+06 1.796150e+05 5.982130e+06 6.690158e+06 5.688136e+06 77522.722 6.169544e+06 8.005462e+06 6.702241e+06 8.441348e+04 4.816334e+06 6.723872e+06 6.199217e+06 112556.73 6.544897e+06 7.736401e+06 5.750040e+06 1.247518e+05 6.467214e+06 6.825185e+06 6.936112e+06 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2.434200e+06 5.041306e+06 1.930217e+06 5.466503e+06 7.854092e+05 4.313976e+06 3.374383e+06 3.002888e+06 2.719772e+06 3.175834e+06 2.421745e+06 2.906255e+06 5.624610e+06 4.780665e+06 2.252523e+06 5.764589e+06 7.335735e+06 3.880778e+06 3.901641e+06 2.724971e+06 2.762862e+06 1.895856e+06 2.524310e+06 3.616565e+06 2.372501e+06 4.114584e+06 5.738452e+06 4.314602e+06 3.262258e+06 4.739858e+06 5.892770e+06 1.862442e+06 4.090105e+06 5.372648e+06 3.662446e+06 2.360965e+06 4.297123e+06 3.535938e+06 2.165920e+06 3.736363e+06 5.076001e+06 6.671555e+06 2.961944e+06 1.888689e+06 5.220793e+06 1.794963e+06 2.964086e+06 3.651352e+06 1.220164e+06 3.251437e+06 2.612278e+06 3.720083e+06 4.295500e+06 3.664077e+06 4.072550e+06 C7 H13 N O4 P2_4.681 4.195720e+08 3.083541e+08 7.545562e+07 9.223024e+07 2.036377e+05 1.962714e+08 2.214700e+08 2.022475e+08 154045.60 1.801832e+08 2.118327e+08 1.775155e+08 1582472.04 1.792319e+08 1.793475e+08 1.879561e+08 5.183062e+05 1.693948e+08 1.876004e+08 1.893229e+08 1.533871e+05 1.778568e+08 1.747021e+08 2.105107e+08 55208.933 1.706707e+08 1.936732e+08 1.884835e+08 6.309560e+04 1.739416e+08 1.874787e+08 1.855932e+08 94777.57 1.875029e+08 1.824025e+08 1.825388e+08 1.090901e+05 1.762822e+08 1.980569e+08 1.836704e+08 8.914428e+04 1.811206e+08 1.740387e+08 1.908930e+08 1.265452e+05 1.951932e+08 1.790975e+08 1.857994e+08 2.541067e+08 1.936691e+08 1.410308e+08 1.823467e+08 1.832312e+08 2.145231e+08 2.486601e+08 2.123548e+08 2.237528e+08 2.478359e+08 2.430564e+08 2.040591e+08 2.451943e+08 2.235923e+08 1.836754e+08 1.538762e+08 1.511607e+08 1.506927e+08 1.468353e+08 2.331649e+07 2.624292e+08 1.819218e+08 2.079576e+08 2.160403e+08 1.385855e+08 1.940887e+08 2.107926e+08 1.895538e+08 1.834231e+08 1.630819e+08 2.200403e+08 2.233243e+08 1.987349e+08 1.630801e+08 1.405178e+08 1.243548e+08 1.068601e+08 1.149218e+08 2.391741e+08 3.274343e+08 2.561911e+08 1.591423e+08 1.643902e+08 2.591998e+08 2.402242e+08 1.527407e+08 1.670861e+08 2.116769e+08 1.947268e+08 1.955357e+08 1.845296e+08 2.186842e+08 2.353257e+08 2.083176e+08 1.178398e+08 2.132742e+08 1.938092e+08 1.876395e+08 1.781163e+08 1.515762e+08 1.797619e+08 1.797907e+08 1.866322e+08 2.111815e+08 1.678557e+08 1.303792e+08 1.463132e+08 2.718703e+08 1.902775e+08 5.006877e+07 2.407029e+08 1.431386e+08 2.031360e+08 2.317628e+08 2.342398e+08 1.473420e+08 1.283565e+08 6.217619e+07 1.197671e+08 1.986754e+08 1.329426e+08 2.788641e+07 2.182975e+08 1.769675e+08 1.840667e+08 2.774971e+08 1.656678e+08 2.153688e+08 1.249337e+08 2.052663e+08 1.352515e+08 1.970602e+08 1.804936e+08 1.804257e+08 2.245714e+08 2.694392e+08 3.391316e+08 2.096459e+08 2.481164e+08 2.461857e+08 1.745890e+08 1.605109e+08 1.158740e+08 2.200111e+08 2.495802e+08 1.486406e+08 1.922437e+08 2.236205e+08 2.359089e+08 9.789558e+07 1.754259e+08 2.265554e+08 1.060815e+08 1.858317e+08 9.907400e+07 1.646114e+08 2.311610e+08 1.726943e+08 2.112300e+08 2.068637e+08 1.943703e+08 1.949730e+08 1.016763e+08 1.347348e+08 1.552551e+08 2.215777e+08 1.903819e+08 1.390615e+08 1.988957e+08 2.025760e+08 1.951803e+08 2.530196e+08 1.043592e+08 2.107672e+08 1.597602e+08 1.543361e+08 2.439409e+08 1.265397e+08 2.399636e+08 2.045586e+08 2.459980e+08 1.982334e+08 1.423316e+08 2.294063e+08 1.514794e+08 1.352272e+08 1.589179e+08 1.535448e+08 2.718517e+08 2.631833e+07 1.689337e+08 3.130860e+08 2.157703e+08 2.280599e+08 1.734381e+08 1.683890e+08 2.095907e+08 2.255784e+08 1.970532e+08 2.182052e+08 2.395303e+08 1.558351e+08 2.147769e+08 7.223277e+07 2.072897e+08 1.770105e+08 1.413512e+08 1.610910e+08 1.731619e+08 1.506160e+08 1.545894e+08 5.429884e+07 2.231343e+08 1.307594e+08 2.654939e+08 3.191323e+08 1.856027e+08 2.074937e+08 1.554927e+08 1.560999e+08 1.223416e+08 1.967940e+08 1.836435e+08 1.417502e+08 2.287752e+08 2.416340e+08 1.786674e+08 1.859263e+08 3.755009e+08 2.492875e+08 1.330999e+08 2.618816e+08 2.142408e+08 1.919346e+08 1.336040e+08 8.985290e+07 1.705700e+08 1.370727e+08 1.858902e+08 1.560095e+08 2.567640e+08 1.614921e+08 1.138606e+08 2.251526e+08 1.143396e+08 1.940132e+08 2.424861e+08 9.706027e+07 2.077863e+08 1.589943e+08 2.079684e+08 1.864504e+08 1.893291e+08 2.038011e+08 C3 H8 P2_4.681 3.299801e+06 2.904774e+06 2.527279e+06 2.186354e+06 1.240404e+05 1.787429e+06 2.381294e+06 2.443891e+06 115069.69 2.148342e+06 2.697361e+06 2.465880e+06 100512.05 2.526606e+06 2.167692e+06 2.344451e+06 9.993152e+04 2.167799e+06 2.497344e+06 2.411502e+06 1.038695e+05 2.400869e+06 2.327174e+06 2.886248e+06 44797.570 2.091147e+06 2.291791e+06 2.283991e+06 5.455946e+04 2.294960e+06 2.397082e+06 2.509308e+06 81236.28 2.356472e+06 2.498141e+06 2.305013e+06 9.556199e+04 2.209155e+06 2.610615e+06 2.528909e+06 8.266327e+04 2.093545e+06 2.260320e+06 2.366572e+06 8.101585e+04 2.506703e+06 2.563109e+06 2.236462e+06 4.077239e+06 2.607447e+06 2.110984e+06 2.356834e+06 2.128065e+06 2.973375e+06 3.522280e+06 3.788367e+06 2.785062e+06 2.914141e+06 4.090901e+06 2.644199e+06 2.721085e+06 3.302740e+06 2.435477e+06 2.307757e+06 2.242556e+06 2.165029e+06 2.286955e+06 2.459044e+06 3.247090e+06 2.399793e+06 2.267663e+06 2.601761e+06 2.055187e+06 2.470265e+06 2.794605e+06 2.318086e+06 2.529346e+06 1.955580e+06 2.808697e+06 2.607686e+06 2.522353e+06 1.850186e+06 1.735648e+06 1.467257e+06 1.411952e+06 1.426858e+06 3.435561e+06 4.432263e+06 3.148490e+06 1.852072e+06 2.166518e+06 3.631888e+06 2.843884e+06 1.827914e+06 2.425008e+06 2.424575e+06 2.824973e+06 5.426932e+06 2.811820e+06 2.963864e+06 2.908244e+06 2.419461e+06 1.387795e+06 2.887085e+06 1.759716e+06 4.955385e+06 1.988999e+06 1.926481e+06 2.000821e+06 2.512895e+06 2.385894e+06 2.675130e+06 3.639818e+06 1.741173e+06 2.064751e+06 2.924235e+06 2.338481e+06 2.914921e+06 3.125507e+06 1.807005e+06 2.654739e+06 3.307010e+06 3.270775e+06 9.340708e+05 1.577554e+06 8.661625e+05 1.648696e+06 3.294675e+06 1.637293e+06 3.081653e+06 2.716600e+06 2.545817e+06 2.462338e+06 3.064983e+06 2.115642e+06 2.849090e+06 1.464983e+06 4.885977e+06 1.341724e+06 2.800098e+06 2.146184e+06 2.217758e+06 3.269161e+06 3.626784e+06 3.883629e+06 2.580118e+06 3.253208e+06 3.286526e+06 2.418832e+06 2.249156e+06 1.461130e+06 2.967367e+06 2.839501e+06 2.400012e+06 2.165908e+06 2.642969e+06 1.922966e+06 1.203887e+06 4.030666e+06 2.885512e+06 1.268937e+06 2.259210e+06 1.302520e+06 2.405363e+06 3.127105e+06 2.315734e+06 2.483129e+06 3.347989e+06 2.947256e+06 2.789163e+06 1.402338e+06 1.333000e+06 2.078767e+06 3.022946e+06 2.735897e+06 1.896059e+06 2.628422e+06 2.758610e+06 2.574728e+06 3.277892e+06 1.533129e+06 3.152015e+06 2.174825e+06 1.903628e+06 3.021598e+06 1.539646e+06 3.298205e+06 2.849955e+06 3.174796e+06 4.650232e+06 1.675802e+06 3.040322e+06 1.833546e+06 1.921123e+06 1.960391e+06 1.971769e+06 4.263119e+06 3.337976e+06 2.176440e+06 4.269670e+06 2.645782e+06 2.672510e+06 2.247830e+06 2.413133e+06 2.059684e+06 5.358441e+06 2.406040e+06 2.050403e+06 2.847649e+06 1.592364e+06 2.864811e+06 8.724686e+05 2.878817e+06 2.202892e+06 2.073317e+06 1.726059e+06 2.475027e+06 2.298116e+06 2.044209e+06 2.868043e+06 3.496412e+06 1.589171e+06 3.249789e+06 4.623942e+06 2.312886e+06 4.794534e+06 2.307031e+06 2.613612e+06 1.574850e+06 2.417430e+06 2.274522e+06 2.301606e+06 2.894472e+06 2.994992e+06 2.583218e+06 2.286333e+06 3.365341e+06 3.348142e+06 1.516170e+06 2.925828e+06 1.826244e+06 2.365549e+06 1.822745e+06 2.154528e+06 2.335022e+06 1.870873e+06 2.421010e+06 1.977994e+06 3.187974e+06 1.950308e+06 1.580392e+06 3.096933e+06 1.598723e+06 2.240651e+06 2.632220e+06 1.104281e+06 2.571815e+06 2.248468e+06 2.294064e+06 2.770698e+06 2.272150e+06 2.587478e+06 C45 H64 N4 O3 S2_4.681 1.031409e+06 3.211572e+05 3.571970e+05 2.861106e+05 1.201280e+05 2.792467e+05 4.006319e+05 3.034767e+05 121843.53 3.144062e+05 2.345529e+05 4.437101e+05 110654.22 3.351109e+05 3.218682e+05 1.802260e+05 1.062814e+05 2.873816e+05 3.478719e+05 3.329697e+05 9.728555e+04 4.698277e+05 2.079550e+05 3.824442e+05 42560.200 3.168102e+05 3.191576e+05 3.094736e+05 5.158683e+04 2.052329e+05 3.317100e+05 4.848901e+05 70944.46 3.156777e+05 2.890713e+05 2.479368e+05 8.334880e+04 2.530293e+05 3.829359e+05 3.565023e+05 6.155537e+04 2.823696e+05 3.401599e+05 4.019269e+05 5.930774e+04 2.270833e+05 3.681437e+05 2.868483e+05 1.906941e+05 4.203590e+05 1.092961e+05 3.042170e+05 3.552355e+05 1.090762e+06 1.026282e+05 9.336150e+05 1.274825e+05 3.789969e+05 8.840822e+05 1.085394e+05 2.681532e+05 1.243873e+05 2.406247e+05 8.687840e+04 9.703652e+05 1.096029e+05 1.235654e+05 1.326857e+06 4.798263e+05 2.213537e+05 9.013806e+05 3.893641e+05 3.293882e+05 1.345457e+05 2.517488e+05 2.393523e+05 2.221490e+05 5.975155e+05 1.222759e+05 1.473417e+05 6.064460e+05 1.241629e+05 1.645468e+05 8.696143e+05 6.317765e+05 6.584661e+04 4.853404e+05 2.252741e+05 6.624126e+05 5.207916e+05 8.826323e+05 1.135638e+05 1.550351e+05 9.228591e+04 5.865016e+05 9.382687e+04 1.592582e+05 4.159578e+05 9.097796e+04 7.746099e+05 3.477216e+05 3.069023e+05 1.317692e+06 1.486504e+05 9.200469e+04 1.924816e+05 9.187823e+04 1.975147e+06 2.350653e+05 2.917256e+05 1.550570e+05 2.875767e+05 5.144276e+05 5.192896e+05 2.101329e+05 2.292126e+05 1.678555e+05 1.201777e+05 2.294063e+05 3.309207e+05 1.374619e+05 8.936698e+04 9.095241e+04 1.241587e+06 7.707003e+05 3.472206e+05 1.908119e+05 2.134383e+05 1.539544e+05 1.191790e+05 1.909773e+05 9.337314e+05 1.124928e+05 1.646139e+05 5.923955e+05 9.854183e+04 1.922139e+05 8.163322e+05 1.912994e+05 1.183221e+05 1.930573e+05 8.696413e+05 2.145651e+06 1.406286e+05 2.272651e+05 3.502265e+05 3.060055e+05 6.260302e+05 1.886019e+05 2.088142e+05 7.582253e+04 9.727278e+04 4.740621e+05 3.513198e+05 2.105979e+05 2.187740e+05 2.171650e+05 4.372795e+05 7.598077e+04 2.819481e+05 1.854863e+05 8.258697e+04 6.975515e+04 5.444304e+05 1.162733e+05 1.095054e+06 9.717225e+04 5.197716e+05 7.009786e+05 2.068096e+05 5.990172e+05 2.480802e+05 7.616598e+04 1.563805e+05 2.362229e+05 3.710149e+05 1.209853e+05 8.708332e+04 1.478749e+05 8.383422e+05 1.357703e+05 1.321765e+06 3.754874e+05 1.827129e+05 1.860400e+05 1.543768e+05 1.039366e+05 3.597388e+05 2.654688e+05 1.191709e+05 1.752565e+05 9.458270e+05 7.698249e+04 8.283250e+05 6.981444e+04 1.587671e+05 4.713042e+05 5.064053e+05 8.427989e+04 1.070514e+05 2.002123e+05 1.397565e+05 5.191116e+05 3.087165e+05 9.347868e+05 2.510560e+05 1.192768e+05 9.522258e+04 1.515372e+05 1.084390e+05 2.385555e+05 2.225951e+05 4.271900e+05 3.061989e+05 4.885224e+05 1.397316e+05 4.724989e+05 1.455454e+05 1.137612e+05 9.502081e+04 1.813637e+05 8.277944e+04 1.453961e+05 1.249780e+05 7.831148e+04 1.344574e+05 6.656012e+05 5.047383e+05 1.057070e+06 8.894973e+05 2.543078e+05 9.692559e+04 3.394351e+05 2.979778e+05 2.514587e+05 1.168568e+05 4.576318e+05 1.586468e+05 1.560201e+05 2.907862e+05 4.745518e+05 2.366411e+05 6.740044e+05 4.481009e+05 3.373290e+05 4.605610e+05 2.644916e+06 1.035395e+05 2.524913e+05 2.795129e+06 8.070151e+04 9.693060e+04 4.764341e+05 2.637167e+05 3.297209e+05 2.618994e+05 2.592676e+05 8.437768e+05 8.094276e+05 9.586777e+04 9.331887e+04 9.547291e+04 107.0076_4.681 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2.129896e+07 1.260772e+07 1.178113e+07 1.818710e+07 9.444126e+06 2.209331e+07 1.415030e+07 2.067087e+07 1.746236e+07 9.853579e+06 2.217101e+07 1.282941e+07 1.091210e+07 1.361888e+07 1.170212e+07 3.155126e+07 1.781577e+07 1.542424e+07 2.945142e+07 1.813079e+07 2.074074e+07 1.852860e+07 1.605460e+07 1.439525e+07 2.333251e+07 1.881082e+07 1.377633e+07 2.561214e+07 7.795382e+06 2.441821e+07 4.429841e+06 2.581298e+07 1.621851e+07 1.216131e+07 1.413738e+07 1.655373e+07 1.257387e+07 1.107793e+07 2.586086e+07 2.269594e+07 1.086344e+07 2.331273e+07 3.408076e+07 2.035277e+07 2.428991e+07 2.015064e+07 1.403881e+07 8.959809e+06 1.475610e+07 1.554567e+07 1.114271e+07 1.990486e+07 2.962400e+07 1.498973e+07 1.664629e+07 2.707311e+07 2.546873e+07 8.781775e+06 2.150090e+07 2.513379e+07 1.390959e+07 9.933206e+06 1.222262e+07 1.470845e+07 1.167103e+07 1.451216e+07 1.376975e+07 2.820888e+07 1.371533e+07 9.749831e+06 1.911600e+07 8.957792e+06 1.483027e+07 2.057266e+07 7.143527e+06 1.315245e+07 1.069716e+07 1.537405e+07 1.303009e+07 1.233280e+07 1.769524e+07 C41 H66 N3 O10 P_4.682 1.109761e+06 3.039254e+05 2.757420e+05 3.339629e+05 1.136207e+05 2.396729e+05 4.902885e+05 3.334122e+05 101184.87 2.200074e+05 3.521451e+05 2.708442e+05 91108.08 3.580154e+05 3.708561e+05 2.403552e+05 8.965203e+04 3.164277e+05 2.528870e+05 3.740999e+05 7.796276e+04 2.978606e+05 3.167914e+05 4.851042e+05 28079.051 2.222958e+05 2.921328e+05 2.899987e+05 3.736800e+04 3.236588e+05 2.835517e+05 2.906255e+05 57871.83 4.246724e+05 3.320793e+05 2.170620e+05 6.795015e+04 3.636684e+05 2.832645e+05 2.753674e+05 5.028606e+04 3.578108e+05 4.018991e+05 2.988940e+05 4.387706e+04 2.489478e+05 3.525738e+05 3.145023e+05 6.279356e+04 3.607423e+05 4.930928e+04 2.506076e+05 3.108857e+05 1.019254e+06 8.571679e+04 7.740327e+05 7.332654e+04 5.182295e+05 9.641297e+05 9.030779e+04 2.409000e+05 2.086684e+05 7.136213e+04 7.187545e+04 8.293712e+05 9.812526e+04 1.556361e+05 1.065183e+06 6.059211e+05 2.379574e+05 7.746416e+05 4.687158e+05 3.359245e+05 9.038271e+04 1.586117e+05 2.094855e+05 4.104453e+05 5.580245e+05 8.508578e+04 7.215129e+04 5.276559e+05 6.791960e+04 6.461196e+04 6.615646e+05 5.185338e+05 5.060807e+04 2.946762e+05 2.044636e+05 8.219717e+05 4.611391e+05 8.562918e+05 1.235743e+05 7.584523e+04 1.048339e+05 4.303115e+05 8.772172e+04 8.638393e+04 2.685371e+05 7.874823e+04 9.700035e+05 4.071877e+05 4.577854e+05 6.025407e+05 1.156583e+05 7.256303e+04 1.006123e+05 1.160732e+05 1.785379e+06 7.437700e+04 2.510546e+05 1.096259e+05 2.416111e+05 4.757415e+05 5.339024e+05 1.487057e+05 9.629017e+04 1.988727e+05 8.258176e+04 3.143839e+05 3.697485e+05 9.948080e+04 7.045187e+04 7.564788e+04 9.731032e+05 7.384716e+05 1.584665e+05 6.731363e+04 8.342110e+04 1.218785e+05 9.783660e+04 2.415590e+05 5.698934e+05 9.658371e+04 1.513691e+05 5.463817e+05 8.117215e+04 1.057962e+05 8.713282e+05 2.122318e+05 1.011182e+05 2.245283e+05 7.281284e+05 1.907039e+06 1.580974e+05 1.799932e+05 2.979809e+05 2.887693e+05 6.630771e+05 1.328064e+05 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5.946683e+05 4.813974e+05 8.886285e+05 6.104825e+05 2.587805e+05 5.314887e+04 7.834274e+04 4.859643e+05 9.216504e+04 2.550063e+05 4.751794e+05 8.566010e+04 1.739588e+05 3.025720e+05 3.846331e+05 1.789067e+05 5.167875e+05 6.194702e+05 3.662674e+05 2.828004e+05 2.176322e+06 2.539301e+05 1.833345e+05 2.277023e+06 6.728515e+04 7.675832e+04 5.193169e+05 1.928839e+05 1.761098e+05 1.642992e+05 1.177931e+05 6.188965e+05 8.124798e+05 1.655683e+05 1.207899e+05 1.058399e+05 C2 H8 N4 O2_4.683 6.221657e+06 5.243493e+06 5.068844e+06 4.971988e+06 1.083242e+05 4.035232e+06 4.851143e+06 6.546049e+06 100874.87 4.194973e+06 5.654577e+06 5.665838e+06 101392.69 4.135270e+06 4.848375e+06 4.942913e+06 1.162096e+05 4.331693e+06 5.020757e+06 5.152406e+06 1.239745e+05 4.248004e+06 5.561039e+06 6.523998e+06 49964.857 4.140595e+06 4.945552e+06 4.727808e+06 6.002894e+04 4.739881e+06 4.702799e+06 5.871314e+06 87598.14 4.854725e+06 4.545748e+06 5.400209e+06 9.788581e+04 4.576199e+06 5.090624e+06 5.490531e+06 7.870339e+04 4.620312e+06 4.932876e+06 5.375346e+06 7.729148e+04 4.853495e+06 4.418239e+06 5.390696e+06 7.613620e+06 4.824167e+06 3.113077e+06 5.183251e+06 4.417133e+06 5.407277e+06 9.118863e+06 8.547482e+06 6.571827e+06 9.354777e+06 9.052869e+06 6.927216e+06 8.468593e+06 9.004435e+06 5.906097e+06 4.928150e+06 4.558788e+06 3.503406e+06 4.670638e+06 4.427922e+06 8.921007e+06 5.058463e+06 5.112925e+06 8.660868e+06 3.771769e+06 4.562308e+06 5.078729e+06 5.754240e+06 5.479393e+06 4.082305e+06 9.597982e+06 5.047828e+06 5.913907e+06 4.642340e+06 2.133579e+06 3.121441e+06 2.061175e+06 2.326214e+06 7.538307e+06 9.979127e+06 7.133632e+06 3.336736e+06 4.720147e+06 7.361626e+06 8.067341e+06 3.369435e+06 4.303022e+06 5.798595e+06 6.152606e+06 4.884494e+06 5.066687e+06 1.164641e+07 9.191494e+06 7.512984e+06 2.240435e+06 4.790135e+06 4.834760e+06 5.379148e+06 3.092280e+06 5.091531e+06 4.289006e+06 5.246542e+06 4.673208e+06 6.363221e+06 1.153617e+07 2.998974e+06 3.276688e+06 4.330823e+06 5.026444e+06 8.635774e+06 6.776651e+06 4.138978e+06 4.783801e+06 5.686212e+06 4.759923e+06 3.423479e+06 2.630521e+06 1.105046e+06 1.938281e+06 5.159634e+06 2.802070e+06 7.600136e+06 6.589898e+06 6.770518e+06 4.049062e+06 6.843546e+06 3.807625e+06 7.076573e+06 3.035167e+06 5.385983e+06 2.585917e+06 5.303980e+06 5.317402e+06 6.027180e+06 7.930069e+06 7.712083e+06 7.796341e+06 5.739171e+06 6.010835e+06 7.809989e+06 5.240963e+06 3.518279e+06 2.946222e+06 4.784290e+06 6.946549e+06 3.190135e+06 5.015494e+06 4.452453e+06 7.032846e+06 1.639263e+06 3.474807e+06 6.603005e+06 1.882921e+06 6.301607e+06 2.017278e+06 3.715229e+06 7.330280e+06 4.754287e+06 5.180435e+06 5.382192e+06 4.247645e+06 5.807373e+06 2.810159e+06 3.128519e+06 4.074082e+06 6.274331e+06 4.415988e+06 3.460752e+06 5.851979e+06 5.180717e+06 6.221838e+06 8.291331e+06 2.481679e+06 5.586764e+06 3.687999e+06 2.993811e+06 6.278881e+06 2.304821e+06 6.292757e+06 5.262137e+06 7.110883e+06 4.855951e+06 2.794623e+06 6.142829e+06 2.712986e+06 2.630448e+06 3.159798e+06 3.198266e+06 1.111176e+07 6.774632e+06 3.943506e+06 1.191430e+07 5.055963e+06 6.633860e+06 3.531728e+06 4.011091e+06 3.352898e+06 6.680884e+06 4.743184e+06 3.060599e+06 5.476546e+06 3.613099e+06 6.116971e+06 1.152494e+06 5.047195e+06 4.128145e+06 3.585826e+06 3.701140e+06 4.225218e+06 3.446384e+06 5.629959e+06 7.539481e+06 6.670839e+06 2.981878e+06 7.325465e+06 8.070413e+06 4.716014e+06 4.395563e+06 4.356211e+06 3.660442e+06 3.234918e+06 3.861428e+06 4.943912e+06 2.644302e+06 5.722173e+06 9.408651e+06 4.946843e+06 3.967531e+06 8.026497e+06 6.968249e+06 2.213997e+06 7.095249e+06 7.315511e+06 4.971291e+06 3.153081e+06 6.108157e+06 4.350452e+06 3.121830e+06 5.765694e+06 4.335477e+06 8.580619e+06 4.737004e+06 2.842468e+06 5.394007e+06 2.977443e+06 5.553952e+06 5.750664e+06 2.271849e+06 3.517719e+06 3.969326e+06 7.573039e+06 3.936000e+06 5.049405e+06 7.177249e+06 C6 H4 N4 O2 S_4.683 3.484962e+08 2.579516e+08 1.886171e+08 1.823764e+08 6.672658e+05 1.723311e+08 2.295140e+08 2.233597e+08 545879.44 2.005110e+08 2.373943e+08 2.046702e+08 2039809.43 2.050795e+08 2.080653e+08 2.100356e+08 9.858155e+05 1.940154e+08 2.153951e+08 2.132722e+08 2.751495e+06 2.021623e+08 1.946152e+08 2.400842e+08 313236.337 1.949955e+08 2.173864e+08 2.143882e+08 2.602243e+05 1.970513e+08 2.123499e+08 2.088705e+08 1239939.25 2.153148e+08 2.042259e+08 2.068675e+08 4.563919e+05 2.011709e+08 2.257454e+08 2.055008e+08 1.585198e+06 2.050629e+08 1.999464e+08 2.158302e+08 1.663184e+06 2.200648e+08 2.022845e+08 2.112690e+08 2.905341e+08 2.237251e+08 1.593451e+08 2.016837e+08 2.095843e+08 2.440151e+08 2.877816e+08 2.390645e+08 2.547460e+08 2.872071e+08 2.751845e+08 2.320948e+08 2.762469e+08 2.531465e+08 2.070376e+08 1.734182e+08 1.697283e+08 1.729568e+08 1.720333e+08 1.811899e+08 3.027548e+08 2.075847e+08 2.149585e+08 2.041386e+08 1.556519e+08 2.195707e+08 2.389652e+08 2.117467e+08 2.099766e+08 1.874985e+08 2.508253e+08 2.466079e+08 2.227028e+08 1.849663e+08 1.574100e+08 1.405560e+08 1.206799e+08 1.297298e+08 2.727577e+08 3.002174e+08 2.860506e+08 1.792721e+08 1.836732e+08 2.001931e+08 2.750604e+08 1.750756e+08 1.897217e+08 2.401920e+08 2.174109e+08 2.226767e+08 2.073854e+08 2.696279e+08 2.725238e+08 2.350425e+08 1.334384e+08 2.366813e+08 2.191046e+08 2.112263e+08 1.999108e+08 1.701638e+08 1.999902e+08 2.023826e+08 2.092430e+08 2.400215e+08 1.940998e+08 1.465595e+08 1.653083e+08 2.704886e+08 2.137747e+08 3.032587e+08 2.741270e+08 1.602350e+08 2.281224e+08 2.653182e+08 2.634176e+08 1.643129e+08 1.443748e+08 7.164017e+07 1.282724e+08 2.273453e+08 1.503549e+08 2.672829e+08 2.481357e+08 1.992008e+08 2.058682e+08 3.068017e+08 1.908344e+08 1.931123e+08 1.399656e+08 2.326966e+08 1.521298e+08 2.211931e+08 2.036888e+08 2.048373e+08 2.538018e+08 3.056338e+08 3.436549e+08 2.380943e+08 2.792241e+08 2.819766e+08 2.010622e+08 1.820228e+08 1.324676e+08 2.514764e+08 2.848751e+08 1.663632e+08 2.182156e+08 1.917614e+08 2.690727e+08 1.063993e+08 1.985791e+08 2.604877e+08 1.197441e+08 2.057495e+08 1.110319e+08 1.861048e+08 2.582510e+08 1.985957e+08 2.396458e+08 2.359603e+08 2.228589e+08 2.148807e+08 1.158701e+08 1.520314e+08 1.766143e+08 2.472269e+08 2.166220e+08 1.587120e+08 2.250643e+08 2.288347e+08 2.205957e+08 2.880718e+08 1.143987e+08 2.412756e+08 1.813143e+08 1.721533e+08 2.674895e+08 1.410818e+08 2.549874e+08 2.233691e+08 2.687450e+08 2.258623e+08 1.617191e+08 2.591457e+08 1.682752e+08 1.518263e+08 1.772227e+08 1.735844e+08 3.085783e+08 5.343889e+07 1.904452e+08 3.629445e+08 2.458453e+08 2.618161e+08 1.957566e+08 1.930261e+08 1.977794e+08 2.572777e+08 2.239302e+08 2.091378e+08 2.731702e+08 1.433177e+08 2.390997e+08 8.401884e+07 1.837653e+08 1.992297e+08 1.599935e+08 1.818351e+08 1.926394e+08 1.682917e+08 1.721379e+08 8.653366e+07 2.576962e+08 1.493418e+08 3.046550e+08 3.620453e+08 2.112191e+08 2.367380e+08 1.747813e+08 1.752686e+08 1.383769e+08 1.968198e+08 2.081542e+08 1.599882e+08 2.580168e+08 2.777524e+08 2.030629e+08 2.090170e+08 3.499877e+08 2.840040e+08 1.400991e+08 2.584151e+08 2.428544e+08 2.063102e+08 1.526740e+08 1.115650e+08 1.955098e+08 1.542739e+08 2.103041e+08 1.741488e+08 2.918135e+08 1.844795e+08 1.288798e+08 2.544971e+08 1.286927e+08 2.098851e+08 2.422487e+08 1.092478e+08 2.252710e+08 1.798606e+08 2.347262e+08 2.119670e+08 2.127494e+08 2.281990e+08 119.0159_4.683 4.424747e+06 3.275883e+06 3.337121e+06 3.326984e+06 1.173041e+05 2.218057e+06 3.378319e+06 3.295703e+06 126148.03 3.060007e+06 3.494309e+06 3.392214e+06 103611.56 2.929062e+06 2.520077e+06 3.442340e+06 1.065888e+05 3.106907e+06 3.191013e+06 3.214786e+06 1.143175e+05 2.969647e+06 3.166311e+06 3.532024e+06 48141.944 2.719444e+06 3.317278e+06 2.980420e+06 5.566658e+04 3.227355e+06 3.023859e+06 3.215970e+06 83241.74 3.367818e+06 2.852659e+06 3.283681e+06 9.813230e+04 3.078234e+06 3.305220e+06 3.066962e+06 8.287558e+04 3.018092e+06 2.792194e+06 3.400468e+06 7.977748e+04 3.425506e+06 2.978814e+06 3.142978e+06 4.614347e+06 3.054599e+06 2.936088e+06 3.022350e+06 3.182861e+06 3.685229e+06 4.582711e+06 3.917338e+06 3.619417e+06 4.230543e+06 3.915070e+06 3.458852e+06 3.925575e+06 7.021317e+06 2.939257e+06 2.733497e+06 2.738451e+06 2.519103e+06 2.824139e+06 3.162574e+06 4.699463e+06 3.399883e+06 2.799726e+06 3.818716e+06 2.192600e+06 3.380395e+06 3.562731e+06 3.854199e+06 2.891025e+06 2.713580e+06 3.847065e+06 3.725935e+06 3.787814e+06 2.537784e+06 2.144205e+06 2.064830e+06 1.704361e+06 1.994388e+06 4.642044e+06 5.680337e+06 4.167350e+06 2.533293e+06 2.696213e+06 4.557832e+06 3.905996e+06 2.375315e+06 2.632549e+06 3.705203e+06 3.259804e+06 3.298099e+06 2.134370e+06 4.843009e+06 4.240509e+06 3.951539e+06 1.833586e+06 3.371463e+06 2.988937e+06 3.044755e+06 2.968758e+06 2.235458e+06 3.367368e+06 2.919264e+06 2.989683e+06 3.512104e+06 4.912632e+06 2.378637e+06 2.667675e+06 3.952690e+06 2.706833e+06 6.071018e+06 3.902918e+06 2.450204e+06 4.465881e+06 3.960268e+06 3.838785e+06 2.203566e+06 2.056827e+06 1.014984e+06 1.628746e+06 3.796488e+06 2.178565e+06 4.204469e+06 3.440181e+06 2.963319e+06 3.058546e+06 4.271770e+06 2.718785e+06 3.722394e+06 1.610031e+06 3.218492e+06 2.016020e+06 3.147657e+06 3.598054e+06 3.142387e+06 4.251407e+06 4.621696e+06 4.862530e+06 3.368209e+06 4.803921e+06 3.848792e+06 3.354583e+06 2.506646e+06 1.952699e+06 3.465829e+06 4.329339e+06 2.673566e+06 3.624197e+06 3.102451e+06 3.616116e+06 1.567371e+06 2.899660e+06 3.839859e+06 1.592297e+06 3.029941e+06 1.470509e+06 3.281022e+06 4.302887e+06 3.212464e+06 3.757164e+06 3.702544e+06 3.332719e+06 3.259367e+06 1.851880e+06 2.056261e+06 2.530073e+06 3.617654e+06 3.516052e+06 2.430699e+06 2.947570e+06 3.814123e+06 3.518063e+06 3.966139e+06 1.909357e+06 3.912926e+06 2.550628e+06 2.054026e+06 3.814872e+06 2.108059e+06 2.922544e+06 3.265234e+06 3.863116e+06 3.823832e+06 2.165324e+06 3.712898e+06 2.429174e+06 2.241921e+06 2.581516e+06 2.256213e+06 5.138756e+06 3.830920e+06 2.906753e+06 5.469154e+06 3.405121e+06 4.119130e+06 2.837075e+06 3.156066e+06 2.682724e+06 3.941963e+06 3.498135e+06 2.793419e+06 4.046594e+06 1.913659e+06 3.798454e+06 1.325711e+06 3.494606e+06 2.801088e+06 2.498967e+06 2.778764e+06 3.291671e+06 2.624837e+06 2.724312e+06 4.575388e+06 2.848829e+06 2.462587e+06 4.225413e+06 5.440087e+06 3.131492e+06 3.223284e+06 2.494690e+06 2.621492e+06 2.132396e+06 2.903630e+06 2.917658e+06 2.494125e+06 3.361795e+06 4.367866e+06 3.208690e+06 3.100556e+06 4.305075e+06 4.113084e+06 1.967827e+06 3.576729e+06 3.425943e+06 3.053753e+06 2.331020e+06 4.138711e+06 2.669308e+06 2.455719e+06 3.324256e+06 1.880724e+06 4.719956e+06 2.464614e+06 1.900881e+06 4.033356e+06 1.932723e+06 2.752973e+06 3.126634e+06 1.458553e+06 3.248871e+06 2.635778e+06 3.646091e+06 3.086845e+06 3.189087e+06 3.259358e+06 154.97805_4.683 5.508184e+07 3.970187e+07 3.591598e+07 3.739214e+07 4.927519e+05 2.079744e+07 3.850133e+07 3.755388e+07 418711.65 3.350651e+07 3.477582e+07 3.519705e+07 430019.06 3.345243e+07 3.695967e+07 3.705120e+07 4.413035e+05 3.237829e+07 3.732888e+07 3.076899e+07 4.079049e+05 3.486942e+07 3.011429e+07 4.153211e+07 168030.522 3.327381e+07 3.440335e+07 3.654699e+07 1.859747e+05 3.264163e+07 3.489476e+07 3.452265e+07 267693.21 3.731847e+07 3.178782e+07 3.512715e+07 3.471214e+05 3.478137e+07 3.907110e+07 3.126590e+07 2.587476e+05 3.445474e+07 3.495516e+07 3.507344e+07 2.515438e+05 3.483856e+07 3.291653e+07 3.665476e+07 4.477949e+07 3.979140e+07 2.686412e+07 2.992505e+07 3.500665e+07 4.200107e+07 4.820374e+07 3.801968e+07 4.475819e+07 5.207160e+07 4.234545e+07 3.549554e+07 3.921952e+07 3.982988e+07 3.009423e+07 2.865898e+07 2.702845e+07 3.034789e+07 3.414497e+07 3.391258e+07 5.432149e+07 3.908930e+07 3.078520e+07 4.431842e+07 2.529854e+07 3.678330e+07 3.744959e+07 3.297893e+07 3.513958e+07 3.251569e+07 3.932010e+07 2.923542e+07 3.316212e+07 2.896753e+07 2.548296e+07 2.208585e+07 2.074783e+07 2.292099e+07 4.826997e+07 6.184437e+07 4.323875e+07 2.951944e+07 2.558343e+07 4.297808e+07 5.093429e+07 2.783551e+07 3.293289e+07 3.730243e+07 3.253294e+07 3.777168e+07 3.248984e+07 5.988415e+07 4.318204e+07 3.524054e+07 2.298742e+07 3.027230e+07 3.518417e+07 3.346383e+07 3.075797e+07 2.790627e+07 2.848779e+07 3.010425e+07 2.983118e+07 4.070833e+07 3.564995e+07 2.475415e+07 2.561170e+07 4.429651e+07 3.457307e+07 6.242930e+07 4.557659e+07 2.443101e+07 3.577181e+07 4.509176e+07 3.980442e+07 2.473466e+07 2.430893e+07 1.423449e+07 2.010958e+07 3.873333e+07 2.352943e+07 5.062152e+07 4.043231e+07 2.775125e+07 3.228148e+07 3.750625e+07 3.219463e+07 3.864742e+07 2.223800e+07 3.457730e+07 2.485786e+07 3.264573e+07 2.897675e+07 3.251322e+07 3.772849e+07 5.064666e+07 5.295259e+07 4.002385e+07 4.307310e+07 4.384526e+07 3.516010e+07 3.099632e+07 2.215398e+07 4.120636e+07 5.002400e+07 2.612741e+07 3.778698e+07 3.776620e+07 4.368204e+07 1.789227e+07 3.287989e+07 4.298927e+07 2.049566e+07 2.843994e+07 1.518800e+07 3.028637e+07 3.924005e+07 3.181324e+07 3.959397e+07 4.075830e+07 3.916783e+07 3.070864e+07 2.039150e+07 2.595776e+07 2.634137e+07 3.734235e+07 3.653306e+07 2.423017e+07 3.747645e+07 3.608026e+07 3.247107e+07 4.455509e+07 1.494157e+07 4.106311e+07 2.743376e+07 2.443102e+07 3.664085e+07 2.231235e+07 4.226408e+07 2.384064e+07 4.180557e+07 3.871891e+07 2.759471e+07 3.861582e+07 2.443694e+07 2.464794e+07 2.536596e+07 2.888892e+07 5.225535e+07 3.825183e+07 3.134892e+07 6.226206e+07 3.607321e+07 4.673333e+07 3.194981e+07 3.298542e+07 3.082030e+07 3.949210e+07 3.801540e+07 3.217356e+07 4.563616e+07 2.319622e+07 3.475686e+07 1.632217e+07 4.226299e+07 3.206097e+07 2.607558e+07 2.763674e+07 2.561309e+07 2.825369e+07 2.451140e+07 4.698760e+07 4.961393e+07 2.514760e+07 5.272505e+07 5.997691e+07 3.119406e+07 3.659640e+07 2.873999e+07 2.952709e+07 2.291444e+07 3.305234e+07 3.511077e+07 2.678088e+07 4.088862e+07 4.229332e+07 3.647596e+07 3.301957e+07 5.073138e+07 4.869172e+07 1.992995e+07 4.299131e+07 4.017977e+07 2.923705e+07 3.033461e+07 4.063882e+07 3.272529e+07 2.406749e+07 3.803002e+07 2.757403e+07 4.704240e+07 2.836131e+07 2.088726e+07 4.085156e+07 2.173311e+07 2.984567e+07 3.714447e+07 1.631102e+07 3.763947e+07 3.069076e+07 3.557338e+07 3.651527e+07 3.310207e+07 3.086170e+07 C7 H2 N O3 P_4.683 4.249387e+07 2.871964e+07 2.530096e+07 2.692455e+07 2.033069e+06 1.580820e+07 2.689969e+07 2.672164e+07 3563152.13 2.423488e+07 2.547434e+07 2.626191e+07 590860.38 2.435516e+07 2.766533e+07 2.136561e+07 2.606546e+06 2.406269e+07 2.807098e+07 2.404536e+07 2.994723e+06 2.511364e+07 2.037375e+07 3.016216e+07 332464.629 2.480613e+07 2.405545e+07 2.633640e+07 2.671403e+05 2.370460e+07 2.518254e+07 2.365907e+07 1670943.84 2.827996e+07 2.233854e+07 2.477960e+07 4.456518e+05 2.528957e+07 2.797364e+07 2.229402e+07 1.661572e+06 2.445611e+07 2.639184e+07 2.512777e+07 1.740391e+06 2.538035e+07 2.349855e+07 2.604990e+07 3.710819e+07 2.929865e+07 1.867872e+07 1.979803e+07 2.678859e+07 3.011718e+07 3.826422e+07 2.704781e+07 3.179837e+07 4.001442e+07 3.275440e+07 2.686266e+07 3.152059e+07 2.975073e+07 2.251694e+07 1.991039e+07 1.864694e+07 2.266769e+07 2.599458e+07 2.344952e+07 4.168288e+07 2.596213e+07 2.388303e+07 3.395098e+07 1.721730e+07 2.576246e+07 2.913252e+07 2.292323e+07 2.704785e+07 2.469224e+07 3.002497e+07 2.439985e+07 2.743576e+07 2.182567e+07 1.724056e+07 1.522136e+07 1.425739e+07 1.459496e+07 3.388380e+07 4.921480e+07 3.081778e+07 2.030880e+07 1.982546e+07 3.201877e+07 3.565188e+07 2.317643e+07 2.285643e+07 2.856544e+07 2.297107e+07 2.749570e+07 2.308629e+07 5.142542e+07 3.646164e+07 2.738731e+07 1.564134e+07 2.413717e+07 2.609827e+07 2.409806e+07 2.249767e+07 1.897451e+07 2.044953e+07 2.298485e+07 2.306157e+07 2.922316e+07 2.744883e+07 1.712717e+07 1.813142e+07 3.321032e+07 2.377773e+07 4.777091e+07 3.376501e+07 1.739991e+07 2.540061e+07 3.449197e+07 2.989241e+07 1.715921e+07 1.609443e+07 9.368005e+06 1.456213e+07 2.929176e+07 1.658385e+07 3.859276e+07 3.058349e+07 2.270459e+07 2.247147e+07 3.000547e+07 2.411155e+07 2.821262e+07 1.518337e+07 2.802751e+07 1.716755e+07 2.436671e+07 2.365488e+07 2.482611e+07 2.815437e+07 3.728571e+07 3.900151e+07 2.906291e+07 3.192670e+07 3.661474e+07 2.649893e+07 2.238274e+07 1.535706e+07 3.203449e+07 3.654064e+07 1.780333e+07 2.648321e+07 2.851069e+07 3.364674e+07 1.183286e+07 2.351905e+07 3.266112e+07 1.366657e+07 2.029834e+07 1.170701e+07 2.195250e+07 2.812120e+07 2.509048e+07 2.916450e+07 2.979253e+07 2.906652e+07 2.092915e+07 1.431664e+07 1.772970e+07 2.148256e+07 2.597068e+07 2.661388e+07 1.940651e+07 2.684624e+07 2.716852e+07 2.540590e+07 3.533999e+07 1.085059e+07 3.103432e+07 2.167451e+07 1.921331e+07 2.415759e+07 1.486942e+07 3.252082e+07 1.897486e+07 3.027248e+07 2.804610e+07 1.972841e+07 3.019635e+07 1.726588e+07 1.685814e+07 1.833572e+07 2.098510e+07 3.766995e+07 2.784050e+07 2.197837e+07 5.038185e+07 2.990933e+07 3.464049e+07 2.254607e+07 2.367793e+07 2.119020e+07 3.104233e+07 2.761358e+07 2.272569e+07 3.420803e+07 1.476178e+07 2.475804e+07 1.240429e+07 3.013883e+07 2.274466e+07 1.865989e+07 2.097878e+07 1.993865e+07 1.809336e+07 1.706562e+07 3.392260e+07 3.686300e+07 1.795367e+07 4.010857e+07 4.430878e+07 2.644316e+07 2.862514e+07 1.968342e+07 2.003996e+07 1.600475e+07 2.335860e+07 2.480797e+07 1.815763e+07 2.977772e+07 3.671924e+07 2.477402e+07 2.349072e+07 3.726464e+07 3.533368e+07 1.487041e+07 3.232975e+07 2.887567e+07 2.347275e+07 1.959691e+07 3.134058e+07 2.401013e+07 1.776739e+07 2.490493e+07 1.832058e+07 3.554704e+07 2.232622e+07 1.423076e+07 3.011250e+07 1.526644e+07 2.351053e+07 2.613956e+07 1.275705e+07 3.133889e+07 2.109716e+07 2.643217e+07 2.559474e+07 2.395841e+07 2.390923e+07 C50 H67 N7 S2_4.683 3.920517e+06 2.492468e+06 2.327244e+06 2.407966e+06 8.670665e+04 1.571571e+06 2.077514e+06 2.093209e+06 94296.81 2.166658e+06 2.668298e+06 2.416688e+06 87149.39 2.055296e+06 1.798706e+06 2.307247e+06 8.672152e+04 2.141632e+06 2.329055e+06 1.991571e+06 8.392071e+04 2.265218e+06 2.500038e+06 2.108938e+06 32663.347 2.223288e+06 2.063430e+06 2.191174e+06 4.121723e+04 2.265579e+06 2.249868e+06 2.564886e+06 63799.81 1.801724e+06 2.106140e+06 1.988584e+06 7.036832e+04 2.441751e+06 2.490348e+06 2.118919e+06 5.584168e+04 1.648203e+06 2.709269e+06 2.327322e+06 5.423304e+04 2.045418e+06 2.189028e+06 2.155603e+06 1.421492e+06 2.614605e+06 2.889071e+06 4.191632e+06 1.991608e+06 2.442615e+06 2.795389e+06 2.223775e+06 2.280013e+06 2.030607e+06 2.977544e+06 2.447725e+06 2.397188e+06 3.907303e+06 2.772676e+06 2.294274e+06 1.894716e+06 1.784591e+06 1.907259e+06 2.514131e+06 2.344325e+06 2.201133e+06 2.336491e+06 2.215757e+06 3.870519e+06 1.979102e+06 2.137858e+06 2.372031e+06 2.021177e+06 2.132011e+06 3.976755e+06 2.862349e+06 2.799613e+06 1.514900e+06 1.062946e+06 1.828504e+06 1.619273e+06 1.696625e+06 4.486146e+06 2.843830e+06 2.835578e+06 1.783792e+06 1.935344e+06 2.491904e+06 1.870833e+06 1.996295e+06 2.202593e+06 2.185636e+06 1.553970e+06 2.417001e+06 1.551295e+06 3.129500e+06 2.621988e+06 1.768044e+06 1.448525e+06 1.598872e+06 2.403271e+06 3.425739e+06 1.289367e+06 1.988678e+06 1.262970e+06 2.377295e+06 1.897521e+06 2.314188e+06 2.238447e+06 2.057688e+06 1.340153e+06 1.863123e+06 1.937765e+06 2.250304e+06 2.292167e+06 1.997505e+06 1.883630e+06 2.460711e+06 1.398538e+06 1.633677e+06 1.507960e+06 1.654394e+06 1.667135e+06 1.903800e+06 1.377090e+06 2.217029e+06 1.931906e+06 3.031953e+06 2.374257e+06 2.435884e+06 2.410568e+06 1.839930e+06 1.555584e+06 1.704955e+06 1.487315e+06 2.699267e+06 2.313995e+06 2.138392e+06 3.190457e+06 2.060425e+06 3.162949e+06 1.985996e+06 1.597544e+06 2.482600e+06 1.829418e+06 1.428103e+06 1.709667e+06 1.866201e+06 2.253148e+06 1.609649e+06 1.690398e+06 3.370697e+06 2.120056e+06 1.206154e+06 1.789139e+06 2.248075e+06 2.170894e+06 2.067184e+06 2.895184e+06 2.271979e+06 2.863219e+06 2.344242e+06 2.931205e+06 1.752264e+06 1.503538e+06 1.963918e+06 1.899186e+06 2.380594e+06 1.700915e+06 1.803095e+06 2.562549e+06 2.138294e+06 3.164283e+06 2.724425e+06 2.300859e+06 2.124267e+06 8.605720e+05 2.238920e+06 2.088323e+06 1.235050e+06 1.819457e+06 1.249473e+06 2.372903e+06 2.360307e+06 2.733245e+06 2.502249e+06 1.506613e+06 2.636623e+06 2.034841e+06 2.015012e+06 9.879562e+05 2.305578e+06 2.131678e+06 1.984055e+06 2.088032e+06 2.117141e+06 1.257877e+06 1.506419e+06 2.088307e+06 1.524784e+06 1.919684e+06 1.502415e+06 2.024730e+06 1.660728e+06 1.985072e+06 2.177284e+06 2.134531e+06 1.511043e+06 2.325993e+06 2.356675e+06 2.631730e+06 1.622079e+06 2.202861e+06 1.463423e+06 8.387974e+05 2.115684e+06 2.166942e+06 1.630107e+06 3.356498e+06 2.083471e+06 1.398220e+06 2.024663e+06 1.753317e+06 1.889614e+06 2.316534e+06 1.878875e+06 1.173422e+06 1.625414e+06 2.257234e+06 2.036681e+06 1.715046e+06 1.721209e+06 2.598700e+06 1.947135e+06 2.022313e+06 1.992287e+06 1.875112e+06 2.824145e+06 2.054204e+06 2.364004e+06 1.876662e+06 1.579363e+06 1.754089e+06 2.196114e+06 2.095859e+06 2.211174e+06 1.616794e+06 2.024327e+06 2.107236e+06 3.663706e+06 2.889034e+06 2.406525e+06 1.839802e+06 2.189883e+06 2.390927e+06 1.562264e+06 2.353144e+06 2.557563e+06 106.50916_4.683 3.877853e+06 3.131759e+06 3.326227e+06 3.060945e+06 1.256527e+05 2.038898e+06 4.591882e+06 2.719498e+06 122020.29 2.085750e+06 3.459033e+06 3.301497e+06 112885.87 3.502385e+06 3.203141e+06 2.418908e+06 1.233396e+05 2.650439e+06 3.621526e+06 3.105511e+06 1.328210e+05 2.833616e+06 3.362723e+06 3.156087e+06 53465.471 2.832684e+06 2.627672e+06 3.097587e+06 5.583657e+04 3.799110e+06 3.146684e+06 2.851360e+06 81187.59 2.724348e+06 3.059883e+06 4.037823e+06 9.362771e+04 2.472985e+06 3.327200e+06 2.749917e+06 8.325374e+04 2.823742e+06 3.174142e+06 3.537436e+06 8.401985e+04 2.831977e+06 2.791513e+06 3.296245e+06 4.666224e+06 3.211574e+06 2.577849e+06 2.934597e+06 3.442598e+06 3.245626e+06 4.376616e+06 7.617749e+06 3.813431e+06 3.282596e+06 3.273590e+06 3.295340e+06 2.775273e+06 7.254568e+06 2.721792e+06 2.217349e+06 2.507082e+06 2.936051e+06 3.893756e+06 2.939862e+06 6.792453e+06 3.115576e+06 2.829737e+06 3.822136e+06 2.218243e+06 4.587058e+06 3.379941e+06 3.035058e+06 3.441267e+06 2.691777e+06 4.127500e+06 3.349932e+06 3.057874e+06 3.289407e+06 1.890678e+06 2.138284e+06 2.317746e+06 1.748749e+06 4.295908e+06 5.223166e+06 3.647991e+06 3.295322e+06 1.944631e+06 3.580122e+06 3.460484e+06 2.339345e+06 2.564530e+06 4.139005e+06 3.014858e+06 3.287768e+06 3.918024e+06 3.630369e+06 5.054987e+06 3.085683e+06 1.960802e+06 3.550749e+06 2.328731e+06 2.865875e+06 2.106877e+06 2.475294e+06 2.348702e+06 2.783451e+06 2.604890e+06 3.407175e+06 4.958545e+06 2.052956e+06 2.504170e+06 3.038708e+06 2.767486e+06 5.501959e+06 4.637879e+06 2.074004e+06 3.241362e+06 3.983544e+06 8.545991e+06 1.819695e+06 2.115108e+06 1.055278e+06 1.769281e+06 3.299230e+06 1.880410e+06 5.418579e+06 2.514129e+06 2.567443e+06 3.013196e+06 3.935031e+06 2.799888e+06 3.160553e+06 1.957498e+06 3.095093e+06 2.183968e+06 4.490335e+06 2.992318e+06 3.001229e+06 3.607665e+06 3.844596e+06 3.821142e+06 3.025726e+06 4.109447e+06 3.590708e+06 2.889383e+06 2.665094e+06 2.073889e+06 3.287602e+06 4.195427e+06 2.220991e+06 3.380051e+06 2.916372e+06 3.590334e+06 1.577244e+06 3.013372e+06 2.782326e+06 1.691412e+06 3.058593e+06 1.726343e+06 2.155223e+06 2.689558e+06 3.085534e+06 2.120060e+06 3.583895e+06 3.135783e+06 2.816590e+06 1.628994e+06 2.358988e+06 2.591926e+06 3.265451e+06 3.013375e+06 2.568993e+06 2.908720e+06 2.732134e+06 2.920717e+06 4.190748e+06 1.838563e+06 6.108872e+06 3.173560e+06 2.419003e+06 4.783428e+06 1.655246e+06 3.286819e+06 3.123201e+06 4.086319e+06 3.427187e+06 2.387789e+06 3.796949e+06 2.033657e+06 1.888948e+06 2.375811e+06 3.328596e+06 3.272503e+06 3.033835e+06 2.896232e+06 5.014551e+06 6.801696e+06 5.116182e+06 2.673859e+06 2.594377e+06 2.678668e+06 4.403197e+06 2.501349e+06 2.597212e+06 4.073706e+06 1.752936e+06 2.838056e+06 9.649392e+05 3.685325e+06 2.126613e+06 2.560668e+06 2.986350e+06 2.729827e+06 2.839773e+06 3.273719e+06 3.923393e+06 4.052473e+06 2.121406e+06 3.875368e+06 5.444542e+06 3.501012e+06 3.526410e+06 2.433175e+06 2.685591e+06 2.247730e+06 2.542323e+06 3.399220e+06 2.536092e+06 3.392478e+06 4.403413e+06 2.060686e+06 2.821472e+06 4.055553e+06 2.682509e+06 1.890888e+06 3.265929e+06 3.912476e+06 3.366303e+06 2.351753e+06 3.488444e+06 3.231831e+06 2.686722e+06 2.967628e+06 2.135793e+06 5.463028e+06 3.216664e+06 2.038859e+06 3.649011e+06 1.606947e+06 2.595979e+06 2.745200e+06 1.597651e+06 2.883768e+06 2.836096e+06 2.645259e+06 2.629123e+06 2.733868e+06 2.919353e+06 C9 H4 N2 P2_4.684 1.184404e+07 7.960028e+06 8.248586e+06 7.607671e+06 1.630539e+05 5.673819e+06 8.253021e+06 7.807552e+06 150844.92 7.449026e+06 8.567875e+06 7.274564e+06 197221.83 7.563717e+06 7.256294e+06 7.376958e+06 1.446223e+05 7.846792e+06 8.081391e+06 7.114053e+06 1.586047e+05 7.488240e+06 7.473587e+06 8.358978e+06 65470.305 7.263912e+06 7.266747e+06 7.643093e+06 7.229488e+04 7.987036e+06 7.796188e+06 7.104148e+06 104863.20 8.085700e+06 6.971122e+06 7.294673e+06 1.179977e+05 7.792448e+06 9.215193e+06 6.627209e+06 1.027584e+05 7.925466e+06 6.755229e+06 7.738506e+06 1.048681e+05 7.895063e+06 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8.457186e+06 9.617784e+06 6.905071e+06 8.792326e+06 6.758893e+06 8.095843e+06 7.951330e+06 7.825501e+06 8.844028e+06 4.400329e+06 7.440516e+06 3.375559e+06 8.370049e+06 7.594850e+06 5.895215e+06 6.551931e+06 7.022257e+06 7.355397e+06 5.926079e+06 9.294462e+06 8.949714e+06 5.825018e+06 1.003169e+07 1.091263e+07 7.360857e+06 7.688415e+06 6.198931e+06 7.133753e+06 5.393493e+06 7.553703e+06 6.530434e+06 6.557354e+06 8.599460e+06 1.028920e+07 7.209487e+06 7.321657e+06 8.411928e+06 8.777897e+06 5.721192e+06 8.691679e+06 7.766237e+06 7.579527e+06 5.900012e+06 8.653343e+06 7.724513e+06 5.863183e+06 7.733003e+06 6.129620e+06 1.041823e+07 6.098646e+06 5.574385e+06 8.745010e+06 5.118990e+06 6.591496e+06 7.266517e+06 3.946474e+06 8.041484e+06 6.826272e+06 7.565614e+06 7.267756e+06 7.227444e+06 7.211549e+06 C6 H2 N2 O_4.684 1.958860e+07 1.299894e+07 9.897854e+06 1.220647e+07 1.383719e+05 1.121140e+07 1.294121e+07 1.268875e+07 149125.35 1.049552e+07 1.333633e+07 1.194052e+07 318641.81 1.180543e+07 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9.752531e+06 1.169898e+07 9.832160e+06 1.656018e+07 1.272771e+07 7.931970e+06 1.484772e+07 6.610683e+06 9.478775e+06 1.301661e+07 6.374285e+06 1.286156e+07 1.089721e+07 1.317911e+07 1.068373e+07 1.183663e+07 1.212740e+07 127.52003_4.685 5.429372e+06 4.468199e+06 4.970891e+06 4.337458e+06 1.104733e+05 3.285656e+06 4.049530e+06 4.887342e+06 107491.32 4.068086e+06 4.840653e+06 3.956266e+06 101122.12 4.455365e+06 4.510213e+06 4.010449e+06 1.074687e+05 4.246796e+06 4.318787e+06 4.535786e+06 1.185476e+05 4.073782e+06 3.979469e+06 5.036517e+06 49756.548 4.535737e+06 3.765748e+06 4.205454e+06 5.791044e+04 4.364027e+06 4.464322e+06 4.419941e+06 84375.97 4.443234e+06 4.114802e+06 4.264465e+06 9.427593e+04 3.909380e+06 4.433678e+06 4.317083e+06 7.523680e+04 5.467562e+06 3.615733e+06 3.378181e+06 7.735148e+04 5.006643e+06 4.464988e+06 4.306703e+06 6.654914e+06 4.760646e+06 3.116077e+06 3.671129e+06 4.713963e+06 5.404034e+06 6.875363e+06 4.801330e+06 5.089410e+06 6.306013e+06 5.178098e+06 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2.580135e+06 4.718525e+06 3.039329e+06 3.582751e+06 3.645750e+06 4.129013e+06 6.092618e+06 6.469373e+06 5.484097e+06 4.872430e+06 4.762229e+06 5.729103e+06 2.727084e+06 4.356077e+06 2.987321e+06 5.369585e+06 5.930313e+06 3.217359e+06 4.287265e+06 4.563216e+06 4.371330e+06 1.634323e+06 3.992766e+06 5.014984e+06 2.310931e+06 4.236032e+06 1.765467e+06 3.321202e+06 4.262812e+06 4.047461e+06 4.322970e+06 5.742924e+06 3.911592e+06 3.983863e+06 1.957710e+06 3.206899e+06 3.692900e+06 5.328510e+06 4.541504e+06 3.010146e+06 4.594496e+06 4.206669e+06 4.523849e+06 6.170580e+06 2.404944e+06 5.380429e+06 3.780900e+06 3.353693e+06 5.303034e+06 2.609675e+06 5.020274e+06 5.108797e+06 4.905282e+06 3.774470e+06 3.765750e+06 4.801527e+06 2.982513e+06 2.338643e+06 3.483112e+06 3.320269e+06 6.506164e+06 4.766294e+06 4.393451e+06 8.723455e+06 5.589686e+06 4.348676e+06 3.945298e+06 3.699659e+06 3.305948e+06 7.322703e+06 5.253530e+06 4.346856e+06 5.821907e+06 1.837749e+06 5.496970e+06 1.106829e+06 4.502667e+06 4.644726e+06 2.372129e+06 3.718110e+06 4.558245e+06 3.669286e+06 4.548445e+06 6.457604e+06 5.453561e+06 2.941425e+06 6.388721e+06 7.314190e+06 4.810133e+06 4.633822e+06 2.511490e+06 4.055317e+06 2.902607e+06 3.455052e+06 4.141226e+06 3.235217e+06 6.513320e+06 6.665917e+06 4.657395e+06 3.790456e+06 5.597745e+06 5.891748e+06 2.463079e+06 5.086203e+06 5.418294e+06 3.575345e+06 3.099112e+06 3.018865e+06 4.908758e+06 3.327754e+06 4.688848e+06 3.345891e+06 6.676788e+06 3.585514e+06 2.637851e+06 5.776884e+06 2.048355e+06 3.607222e+06 4.644069e+06 2.076240e+06 4.214078e+06 2.283517e+06 4.059346e+06 4.456428e+06 4.342037e+06 4.089525e+06 C44 H80 N9 O6 P3_4.685 2.727562e+06 1.540418e+06 1.688891e+06 1.687962e+06 1.501891e+05 8.657508e+05 1.324665e+06 1.571139e+06 138103.12 1.564315e+06 1.587017e+06 1.812765e+06 129745.78 1.271565e+06 1.398430e+06 1.357096e+06 1.423398e+05 1.362055e+06 1.626860e+06 1.348370e+06 1.474250e+05 1.180666e+06 1.568618e+06 1.823765e+06 55334.787 1.535860e+06 1.439505e+06 1.529795e+06 6.636719e+04 1.173068e+06 1.495271e+06 1.498258e+06 98007.42 1.481896e+06 1.453201e+06 1.446263e+06 1.070907e+05 1.474539e+06 1.580430e+06 1.471961e+06 8.712796e+04 1.351707e+06 1.446559e+06 1.862734e+06 8.499499e+04 1.264768e+06 1.263488e+06 1.587935e+06 2.082924e+06 1.582902e+06 8.907903e+05 1.233266e+06 1.597630e+06 1.385838e+06 2.183431e+06 2.226197e+06 1.249303e+06 1.948232e+06 3.669736e+06 2.015994e+06 1.800317e+06 1.879068e+06 1.857723e+06 2.053268e+06 1.255364e+06 1.253738e+06 1.206277e+06 1.270279e+06 2.503033e+06 2.202715e+06 1.693095e+06 2.096307e+06 1.288813e+06 8.473599e+05 3.115856e+06 1.737140e+06 2.562518e+06 1.180055e+06 3.511436e+06 1.880749e+06 2.022435e+06 1.728232e+06 5.092337e+05 1.279472e+06 5.230230e+05 7.229650e+05 1.344175e+06 2.600590e+06 1.604381e+06 4.412651e+05 1.614071e+06 1.490939e+06 1.290998e+06 9.138006e+05 1.296912e+06 1.422808e+06 1.413799e+06 1.771756e+06 1.063741e+06 1.865300e+06 1.892495e+06 1.065572e+06 8.062259e+05 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2.942776e+05 1.753326e+06 9.201118e+05 8.884760e+05 1.238683e+06 4.968534e+05 1.630990e+06 1.124877e+06 1.698565e+06 1.253167e+06 1.039508e+06 2.024549e+06 1.165396e+06 1.072912e+06 6.839663e+05 1.145885e+06 2.054004e+06 1.569855e+06 1.351348e+06 2.201127e+06 1.362061e+06 1.509986e+06 9.980530e+05 8.775651e+05 1.380983e+06 1.023194e+06 9.787341e+05 7.595035e+05 9.767847e+05 6.659000e+05 1.804545e+06 5.738200e+05 1.515461e+06 1.659213e+06 1.339280e+06 8.409128e+05 1.163137e+06 1.270700e+06 4.618232e+05 9.274527e+05 1.670794e+06 9.845572e+05 1.543400e+06 2.530246e+06 9.438334e+05 1.517370e+06 6.544170e+05 9.781968e+05 1.098084e+06 1.331925e+06 1.436678e+06 1.137629e+06 1.132190e+06 2.090399e+06 1.540254e+06 1.289228e+06 1.747602e+06 2.044527e+06 6.989711e+05 2.262397e+06 1.386108e+06 1.446544e+06 1.331993e+06 1.573880e+06 1.045484e+06 9.058758e+05 1.223847e+06 2.368924e+06 2.470573e+06 1.551207e+06 7.095043e+05 2.246671e+06 9.563428e+05 2.243559e+06 1.744642e+06 1.101209e+06 1.697847e+06 1.122969e+06 1.826936e+06 1.200056e+06 1.028947e+06 2.521474e+06 C4 H3 N3 O3 S_4.685 3.748655e+07 2.573063e+07 2.685833e+07 2.656697e+07 4.036231e+05 1.262274e+07 2.912441e+07 2.640278e+07 364986.03 1.996803e+07 2.443783e+07 2.370726e+07 247845.36 2.286843e+07 2.445518e+07 3.032217e+07 2.437887e+05 2.184470e+07 2.386677e+07 1.855600e+07 2.848244e+05 2.492360e+07 2.262101e+07 2.859724e+07 129052.828 2.279759e+07 2.375469e+07 2.330261e+07 1.330065e+05 2.335433e+07 2.379596e+07 2.395841e+07 311322.42 2.612580e+07 2.242335e+07 2.460352e+07 3.917192e+05 2.481417e+07 2.417155e+07 2.176982e+07 2.215465e+05 2.493431e+07 2.532855e+07 2.449444e+07 3.202421e+05 2.151962e+07 2.333299e+07 2.551211e+07 2.892717e+07 2.838070e+07 2.013848e+07 2.231752e+07 2.100497e+07 3.023154e+07 2.933091e+07 2.813527e+07 3.120259e+07 3.513618e+07 2.643495e+07 2.490787e+07 2.465849e+07 2.849744e+07 1.940029e+07 2.002472e+07 1.851005e+07 1.891624e+07 2.334330e+07 1.974035e+07 3.590442e+07 2.787616e+07 2.431780e+07 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2.422166e+07 2.022800e+07 2.250734e+07 1.567697e+07 2.327724e+07 2.035860e+07 1.943079e+07 2.644994e+07 2.419044e+07 2.645210e+07 2.253688e+07 3.235777e+07 3.034057e+07 1.512161e+07 2.973320e+07 2.690554e+07 1.779035e+07 2.207805e+07 2.848789e+07 2.174219e+07 1.715097e+07 2.833849e+07 2.111147e+07 3.301161e+07 1.880557e+07 1.669820e+07 2.782634e+07 1.599240e+07 2.124769e+07 2.285232e+07 1.076599e+07 2.740274e+07 2.192670e+07 2.473494e+07 2.306189e+07 2.304431e+07 2.139599e+07 116.01207_4.686 1.864256e+06 1.857312e+06 1.731691e+06 1.866010e+06 8.278363e+04 1.052062e+06 1.666308e+06 1.731512e+06 91503.02 1.577794e+06 1.936058e+06 1.701053e+06 87951.94 1.560757e+06 1.583326e+06 1.488361e+06 8.743312e+04 1.484708e+06 1.720438e+06 1.932053e+06 7.973630e+04 1.363758e+06 2.104544e+06 1.728991e+06 32673.070 1.398091e+06 1.581840e+06 1.627459e+06 4.434704e+04 1.737266e+06 1.385455e+06 1.766796e+06 69154.35 1.684577e+06 1.602273e+06 1.838718e+06 7.788351e+04 1.640098e+06 1.728253e+06 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5.870766e+07 3.995308e+07 2.381195e+07 3.886844e+07 1.824547e+05 3.878899e+07 3.794194e+07 4.036459e+07 180003.67 3.673808e+07 2.284461e+07 3.614588e+07 157044.28 3.992055e+07 3.590216e+07 2.990983e+07 1.466872e+05 4.678449e+07 3.577693e+07 2.908490e+07 1.629163e+05 4.123478e+07 2.978046e+07 3.550463e+07 67036.770 3.383128e+07 4.463514e+07 3.474412e+07 7.289175e+04 3.267273e+07 3.622128e+07 3.164417e+07 105246.67 4.194049e+07 2.359088e+07 4.842009e+07 1.182287e+05 3.520410e+07 3.929423e+07 3.426449e+07 1.119791e+05 3.546719e+07 2.430565e+07 3.765502e+07 1.124373e+05 3.752458e+07 3.593673e+07 3.752382e+07 4.710554e+07 3.769659e+07 3.143158e+07 3.108504e+07 3.686531e+07 2.774070e+07 5.037928e+07 3.654034e+07 3.731843e+07 5.316560e+07 5.013575e+07 3.264146e+07 3.540025e+07 3.929912e+07 3.069606e+07 2.825508e+07 2.791085e+07 3.257055e+07 3.828393e+07 3.185040e+07 3.427144e+07 4.084574e+07 3.190182e+07 3.975379e+07 2.461299e+07 3.380421e+07 3.791043e+07 2.377986e+07 3.588847e+07 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3.390523e+07 3.772233e+07 4.253852e+07 3.104283e+07 3.471155e+07 3.401736e+07 5.811646e+07 3.131306e+07 4.093402e+07 3.736441e+07 3.169609e+07 1.910354e+07 4.606755e+07 4.276921e+07 2.787226e+07 3.486174e+07 2.563834e+07 4.954868e+07 2.983237e+07 2.808516e+07 3.883055e+07 2.707904e+07 3.375509e+07 3.479248e+07 2.717374e+07 4.494103e+07 3.430192e+07 3.518438e+07 3.562985e+07 3.482167e+07 3.642084e+07 C41 H67 N9 O5 P2_4.688 6.967541e+06 3.438094e+06 2.755058e+06 3.608726e+06 9.864805e+04 1.843740e+06 3.695280e+06 3.533856e+06 107093.61 2.294545e+06 2.598858e+06 3.715230e+06 97506.45 2.848517e+06 3.057699e+06 2.644203e+06 9.482874e+04 2.960695e+06 3.349192e+06 2.852137e+06 9.181118e+04 3.036737e+06 2.829305e+06 3.718635e+06 36028.588 2.789646e+06 3.097637e+06 2.700454e+06 4.603951e+04 2.667278e+06 3.318456e+06 3.280256e+06 70712.35 3.142506e+06 2.848446e+06 2.911653e+06 8.107265e+04 2.767708e+06 3.004628e+06 2.903408e+06 5.915582e+04 3.217500e+06 3.125221e+06 3.349061e+06 5.703585e+04 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5.419377e+06 2.499392e+06 2.892372e+06 2.389478e+06 2.333861e+06 2.536861e+06 2.749266e+06 2.616132e+06 2.575708e+06 5.174114e+06 2.517226e+06 1.549723e+06 2.474686e+06 5.209484e+06 2.958803e+06 3.163817e+06 2.507176e+06 3.021445e+06 3.495217e+06 1.213679e+06 3.107125e+06 3.496676e+06 2.188177e+06 3.961889e+06 3.149409e+06 4.141999e+06 2.937930e+06 2.479873e+06 2.135578e+06 2.911074e+06 3.255180e+06 3.096025e+06 2.175319e+06 3.765709e+06 3.064179e+06 5.942363e+06 4.642557e+06 4.203622e+06 3.183992e+06 2.852461e+06 3.906732e+06 3.593672e+06 4.250746e+06 3.015992e+06 3.555130e+06 1.912459e+06 2.550990e+06 3.726197e+06 3.300759e+06 5.953262e+06 3.791162e+06 2.386306e+06 3.830384e+06 2.469871e+06 3.501565e+06 5.446599e+06 3.623835e+06 3.798098e+06 2.447619e+06 4.146672e+06 2.401534e+06 4.428224e+06 4.683549e+06 C H3 O7 P_4.689 6.726346e+07 4.550891e+07 2.905721e+07 4.326328e+07 3.553742e+05 4.256247e+07 4.397320e+07 4.651259e+07 349739.86 4.000010e+07 2.638481e+07 4.138738e+07 302617.39 4.516397e+07 4.119045e+07 3.534390e+07 2.814625e+05 5.117535e+07 4.106097e+07 3.326324e+07 3.110187e+05 4.623354e+07 3.254923e+07 4.358401e+07 127944.422 3.869743e+07 4.965955e+07 3.840183e+07 1.423000e+05 3.673574e+07 4.231491e+07 3.606191e+07 207071.76 4.698644e+07 2.851880e+07 5.277347e+07 2.319652e+05 3.992596e+07 4.476358e+07 3.850833e+07 2.116679e+05 4.060074e+07 2.989815e+07 4.176489e+07 2.114256e+05 4.422635e+07 3.943518e+07 4.268526e+07 5.269570e+07 4.385882e+07 3.542099e+07 3.534949e+07 4.269063e+07 3.416720e+07 5.605974e+07 4.077446e+07 4.289803e+07 5.944082e+07 5.526791e+07 3.725497e+07 4.016459e+07 4.327423e+07 3.494132e+07 3.165928e+07 3.127068e+07 3.677580e+07 4.283246e+07 3.784876e+07 4.123460e+07 4.634115e+07 3.572893e+07 4.497734e+07 2.866982e+07 3.949158e+07 4.349927e+07 2.764462e+07 4.020759e+07 3.794824e+07 3.709646e+07 5.025098e+07 4.909962e+07 3.544254e+07 3.907499e+07 2.872136e+07 2.040435e+07 3.389544e+07 4.728350e+07 7.185147e+07 6.957046e+07 3.554169e+07 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4.953107e+07 5.284088e+07 4.119785e+07 3.085771e+07 3.434192e+07 3.611286e+07 4.854987e+07 3.924394e+07 3.165103e+07 4.154610e+07 3.143742e+07 4.573153e+07 4.319503e+07 1.755455e+07 4.590659e+07 3.253448e+07 3.089886e+07 2.586149e+07 2.831576e+07 5.294204e+07 3.501003e+07 4.236433e+07 4.659188e+07 4.950001e+07 3.861894e+07 2.880294e+07 2.193460e+07 2.605756e+07 3.508031e+07 4.812974e+07 3.507142e+07 3.002741e+07 2.977467e+07 3.591559e+07 3.337600e+07 3.987448e+07 4.218165e+07 2.995541e+07 3.839909e+07 3.366596e+07 3.258367e+07 4.887469e+07 1.790834e+07 5.432702e+07 1.839233e+07 4.455175e+07 2.947999e+07 2.696324e+07 3.481361e+07 3.046372e+07 4.454388e+07 2.779383e+07 4.672185e+07 8.750448e+07 2.998463e+07 5.195990e+07 6.237816e+07 2.909437e+07 3.865092e+07 3.612063e+07 3.909773e+07 2.925594e+07 4.719526e+07 3.603304e+07 3.788196e+07 4.480000e+07 4.820551e+07 3.467574e+07 4.046074e+07 4.098490e+07 6.465931e+07 3.563843e+07 4.700168e+07 4.232704e+07 3.626891e+07 2.174949e+07 5.292287e+07 4.858442e+07 3.126407e+07 4.119092e+07 3.058648e+07 5.467711e+07 3.371322e+07 3.213077e+07 4.476588e+07 3.080232e+07 3.848546e+07 4.037158e+07 2.963440e+07 4.992420e+07 4.035772e+07 3.888890e+07 4.108769e+07 4.068887e+07 4.010295e+07 C6 H12 O6 P2_4.689 3.733892e+07 2.315659e+07 2.509156e+07 2.151247e+07 1.503050e+05 6.638859e+06 2.226083e+07 2.196855e+07 145896.61 2.089779e+07 1.750235e+07 2.131235e+07 135344.66 1.975152e+07 2.061172e+07 2.059261e+07 1.412833e+05 1.868664e+07 2.353075e+07 1.765246e+07 1.628156e+05 1.733626e+07 2.079906e+07 1.673227e+07 65426.645 2.305881e+07 2.048901e+07 2.074193e+07 6.915166e+04 1.995241e+07 2.022309e+07 1.843242e+07 100262.85 2.219558e+07 1.797433e+07 1.885421e+07 1.155010e+05 2.311351e+07 1.830152e+07 1.971735e+07 9.766549e+04 2.180041e+07 1.836516e+07 1.982600e+07 9.914129e+04 2.090906e+07 2.028260e+07 1.974010e+07 2.505773e+07 1.862575e+07 1.752102e+07 1.807139e+07 1.956082e+07 2.497666e+07 9.957317e+06 2.234044e+07 2.659367e+07 2.989501e+07 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2.017192e+07 2.058187e+07 1.515208e+07 1.798189e+07 1.999525e+07 1.862639e+07 1.239104e+07 2.612165e+07 1.743061e+07 1.681052e+07 2.727937e+07 2.916406e+07 1.926362e+07 3.115564e+07 1.774169e+07 1.802436e+07 1.545220e+07 2.081269e+07 1.850710e+07 1.615054e+07 2.061829e+07 3.341281e+07 1.947378e+07 2.192646e+07 2.244762e+07 2.446343e+07 1.319049e+07 2.353926e+07 2.462871e+07 1.495662e+07 1.220309e+07 2.289565e+07 2.300705e+07 1.255443e+07 1.798156e+07 1.693587e+07 2.247993e+07 1.903817e+07 1.507588e+07 2.304212e+07 1.513089e+07 1.984881e+07 1.973104e+07 1.177408e+07 2.177783e+07 1.924342e+07 2.214531e+07 2.127347e+07 2.099486e+07 1.906044e+07 C7 H13 Cl O2 S2_4.689 2.633117e+06 1.863306e+06 2.090598e+06 1.848928e+06 1.179866e+05 1.238590e+06 1.890112e+06 2.014334e+06 114445.36 1.608282e+06 2.067683e+06 2.001750e+06 109869.55 1.671577e+06 1.555504e+06 1.724113e+06 1.180927e+05 1.845584e+06 1.952238e+06 1.899424e+06 1.242493e+05 1.637949e+06 1.800251e+06 2.027373e+06 51359.875 1.712233e+06 1.759902e+06 1.689470e+06 6.734733e+04 1.782472e+06 1.862876e+06 2.053005e+06 101427.27 1.799320e+06 1.815092e+06 1.701137e+06 1.281330e+05 1.714712e+06 1.878913e+06 1.798351e+06 1.091700e+05 1.667471e+06 1.931855e+06 1.851829e+06 1.017886e+05 1.718084e+06 1.834710e+06 1.837859e+06 2.109932e+06 1.705976e+06 1.374853e+06 1.405019e+06 1.503865e+06 3.011266e+06 2.699371e+06 2.126081e+06 2.660666e+06 2.818930e+06 2.140772e+06 1.470353e+06 2.046151e+06 2.322320e+06 1.490714e+06 1.963659e+06 1.625459e+06 1.734719e+06 2.130050e+06 1.977655e+06 3.910088e+06 1.912924e+06 1.290469e+06 2.871379e+06 1.518147e+06 1.119705e+06 2.048566e+06 1.402661e+06 1.766793e+06 1.532984e+06 2.206738e+06 1.867996e+06 1.776962e+06 1.632966e+06 1.860834e+06 1.038043e+06 1.395609e+06 1.303503e+06 2.018278e+06 2.495424e+06 2.283281e+06 1.322387e+06 1.683180e+06 1.430164e+06 3.097316e+06 2.073926e+06 2.523466e+06 1.430203e+06 1.593442e+06 2.092291e+06 1.317243e+06 3.285193e+06 2.696611e+06 1.468416e+06 1.166593e+06 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2.659953e+05 1.486439e+06 1.950144e+06 9.587348e+05 1.373614e+06 1.125191e+06 2.598331e+06 1.637067e+06 1.748068e+06 1.943929e+06 1.294247e+06 1.416748e+06 1.074667e+06 8.465635e+05 7.701720e+05 1.318753e+06 2.653363e+06 1.296431e+06 1.619004e+06 2.869228e+06 1.709077e+06 2.252311e+06 1.983534e+06 2.027834e+06 1.522261e+06 1.487957e+06 1.490719e+06 2.046380e+06 1.460720e+06 1.008904e+06 1.718919e+06 6.563007e+05 1.715553e+06 1.827420e+06 8.817585e+05 1.393108e+06 1.855578e+06 2.306211e+06 5.856623e+05 1.774389e+06 2.452296e+06 1.188882e+06 2.545799e+06 2.151772e+06 1.248822e+06 1.615161e+06 1.714466e+06 1.569093e+06 1.203371e+06 2.009907e+06 1.111579e+06 1.830007e+06 2.524948e+06 2.213494e+06 1.035720e+06 1.255785e+06 2.461232e+06 2.286134e+06 1.189378e+06 2.052994e+06 2.207284e+06 2.108273e+06 1.007575e+06 2.234961e+06 1.656689e+06 1.166869e+06 2.025524e+06 1.644542e+06 2.498446e+06 2.042740e+06 1.578244e+06 1.948933e+06 1.158559e+06 1.483226e+06 1.340316e+06 6.733700e+05 1.322118e+06 1.594255e+06 2.325297e+06 1.356753e+06 1.512494e+06 1.969449e+06 C H N9 O3 S_4.689 8.960660e+06 7.363499e+06 7.537746e+06 7.577489e+06 1.130409e+05 4.418584e+06 9.116422e+06 8.998446e+06 142123.27 3.199606e+06 1.136435e+07 4.178981e+06 158690.60 2.545979e+06 9.438166e+06 8.681181e+06 1.513440e+05 8.710400e+06 4.106279e+06 3.544766e+06 1.456534e+05 1.027347e+07 8.568121e+06 9.048735e+06 52398.657 3.442702e+06 7.317200e+06 7.815609e+06 5.732989e+04 7.621200e+06 2.963406e+06 5.980166e+06 68827.92 1.261222e+07 5.746252e+06 6.069609e+06 7.845371e+04 6.883430e+06 8.054056e+06 6.923240e+06 7.557225e+04 7.612782e+06 7.400176e+06 7.092152e+06 1.101638e+05 3.137985e+06 7.736726e+06 8.286263e+06 1.196398e+07 1.202972e+07 6.748606e+06 6.019411e+06 5.820347e+06 7.696499e+06 3.506328e+06 9.319417e+06 4.692046e+06 5.350460e+06 6.735138e+06 8.581613e+06 7.188526e+06 2.765147e+06 1.006369e+07 4.738716e+06 4.889544e+06 6.657443e+06 9.459189e+06 5.262084e+06 1.730363e+07 8.581112e+06 6.848296e+06 4.798547e+06 6.291256e+06 8.094486e+06 8.489392e+06 8.445369e+06 9.156165e+06 8.591142e+06 3.070700e+06 7.151234e+06 9.499585e+06 8.056590e+06 4.386773e+06 6.284122e+06 2.971821e+06 5.642680e+06 1.242997e+07 1.854603e+07 1.230046e+07 7.927666e+06 5.623718e+06 1.104029e+07 3.865091e+06 8.427471e+06 7.458135e+06 1.149869e+07 6.327765e+06 7.906886e+06 8.500190e+06 6.132731e+06 1.308732e+07 7.498060e+06 6.331099e+06 7.169687e+06 6.188143e+06 6.871432e+06 5.826842e+06 8.278358e+06 2.999808e+06 6.317771e+06 3.128315e+06 1.000270e+07 1.184692e+07 4.346992e+06 7.647891e+06 9.493079e+06 8.353696e+06 1.056731e+07 9.919608e+06 1.805587e+06 8.326493e+06 9.439504e+06 9.852768e+06 5.143235e+06 1.574068e+06 2.360376e+06 1.904517e+06 9.962293e+06 3.125486e+06 1.385318e+07 1.002007e+07 2.521025e+06 4.164315e+06 8.748280e+06 1.242719e+07 1.188934e+07 6.222997e+06 9.521043e+06 2.482959e+06 2.449531e+06 7.194479e+06 7.327858e+06 1.237705e+07 1.227603e+07 1.199574e+07 7.428394e+06 8.417977e+06 8.720498e+06 9.518121e+06 6.025759e+06 6.113087e+06 6.954944e+06 1.162151e+07 2.146441e+06 3.688934e+06 1.059942e+07 7.139041e+06 4.110807e+06 7.594238e+06 3.225536e+06 3.674544e+06 4.436252e+06 4.938677e+06 7.398315e+06 8.041707e+06 4.079522e+06 6.747726e+06 9.314311e+06 7.267185e+06 6.097015e+06 6.042813e+06 6.191171e+06 2.519478e+06 3.561781e+06 8.045480e+06 3.405772e+06 2.701552e+06 6.942010e+06 2.749067e+06 1.210004e+07 2.932696e+06 1.014661e+07 9.959233e+06 6.162964e+06 1.057536e+07 3.894084e+06 9.592968e+06 9.152210e+06 1.173042e+07 8.824980e+06 5.718941e+06 9.383789e+06 3.603291e+06 4.005750e+06 4.220645e+06 7.074891e+06 1.248038e+07 7.388482e+06 6.574230e+06 1.966156e+07 1.209206e+07 1.085224e+07 6.381912e+06 1.012628e+07 3.042319e+06 1.206570e+07 8.615181e+06 7.110909e+06 4.158747e+06 6.420548e+06 7.263706e+06 3.984764e+06 4.349374e+06 6.572097e+06 6.041509e+06 7.611763e+06 7.640504e+06 5.945307e+06 7.425704e+06 1.246064e+07 1.213993e+07 7.906450e+06 1.154048e+07 1.439048e+07 8.454438e+06 1.147866e+07 5.269483e+06 6.671797e+06 5.589987e+06 7.170890e+06 8.140561e+06 2.941108e+06 7.348601e+06 1.299156e+07 7.289917e+06 5.918571e+06 1.012627e+07 3.083371e+06 5.905698e+06 8.479881e+06 1.035048e+07 3.120418e+06 5.354386e+06 9.458072e+06 1.074748e+07 2.775104e+06 7.488647e+06 5.445244e+06 1.355714e+07 3.359065e+06 7.818810e+06 3.687129e+06 2.249831e+06 7.406436e+06 7.862536e+06 4.360739e+06 8.951446e+06 5.269283e+06 1.078069e+07 6.201641e+06 6.669677e+06 8.154845e+06 115.96724_4.691 7.246393e+06 4.631955e+06 5.193054e+06 4.645051e+06 2.690125e+05 2.895702e+06 5.054932e+06 4.687316e+06 254512.47 4.038393e+06 5.056817e+06 4.479907e+06 297372.16 4.442823e+06 4.466220e+06 4.183933e+06 2.289921e+05 4.151320e+06 5.027100e+06 4.229466e+06 2.220415e+05 4.478184e+06 4.676022e+06 4.774224e+06 86321.512 4.224575e+06 4.656127e+06 4.458565e+06 1.049341e+05 4.076728e+06 4.596899e+06 4.613772e+06 156245.38 4.627078e+06 4.301436e+06 4.526538e+06 1.771537e+05 4.490603e+06 4.667059e+06 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2.313908e+06 2.055220e+06 2.871152e+06 1.114393e+06 2.500157e+06 1.317335e+06 2.311671e+06 2.771547e+06 1.924114e+06 2.093904e+06 2.381885e+06 2.145964e+06 9.974534e+05 2.367651e+06 2.717896e+06 1.983588e+06 2.957104e+06 3.545137e+06 2.402409e+06 2.963723e+06 1.948829e+06 2.285629e+06 1.618688e+06 2.113673e+06 2.021935e+06 2.148157e+06 2.586311e+06 2.967510e+06 2.249553e+06 2.268764e+06 2.648953e+06 2.801651e+06 1.846759e+06 2.197975e+06 2.328482e+06 2.031991e+06 1.707162e+06 2.440881e+06 2.076964e+06 1.736517e+06 2.365458e+06 2.096788e+06 3.164917e+06 1.994776e+06 1.699834e+06 3.013246e+06 1.735357e+06 2.239604e+06 1.991175e+06 1.156570e+06 2.572532e+06 2.074906e+06 2.683983e+06 2.246293e+06 2.605129e+06 2.514041e+06 C7 H5 O5 P_4.694 4.504222e+07 2.934834e+07 2.506880e+07 3.528458e+07 1.564010e+05 2.440793e+07 3.756895e+07 3.461615e+07 172931.98 1.600517e+07 3.393889e+07 3.367004e+07 344087.35 1.331072e+07 3.942343e+07 3.021777e+07 1.534440e+05 3.004171e+07 3.417904e+07 3.059492e+07 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3.024283e+06 2.998237e+06 3.671112e+06 3.586613e+06 1.605913e+05 2.275090e+06 3.378205e+06 3.251923e+06 149567.19 3.452124e+06 3.289662e+06 3.066003e+06 155323.52 3.426068e+06 3.037011e+06 3.323802e+06 1.595076e+05 3.155781e+06 3.359330e+06 3.254504e+06 1.707934e+05 3.088776e+06 2.936252e+06 3.126151e+06 65728.962 3.085698e+06 3.743277e+06 3.325393e+06 7.582474e+04 2.930698e+06 3.854722e+06 2.750017e+06 122985.11 2.862400e+06 3.628674e+06 3.602191e+06 1.588309e+05 2.854108e+06 3.380730e+06 2.955637e+06 1.307383e+05 2.849344e+06 3.107828e+06 3.704456e+06 1.171605e+05 3.133235e+06 3.318314e+06 3.150076e+06 3.781049e+06 2.053815e+06 3.080674e+06 2.796931e+06 3.387214e+06 3.955125e+06 3.724766e+06 2.274920e+06 2.616386e+06 3.042321e+06 2.670841e+06 2.856837e+06 2.925007e+06 2.697466e+06 2.264588e+06 2.020698e+06 2.601183e+06 3.416658e+06 3.161101e+06 3.302876e+06 3.369933e+06 3.441560e+06 2.659891e+06 3.731339e+06 2.181878e+06 3.377659e+06 3.266450e+06 2.918181e+06 4.296482e+06 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3.798377e+06 4.329107e+06 2.504198e+06 2.859478e+06 3.524230e+06 3.702753e+06 2.584475e+06 2.904365e+06 3.393918e+06 3.004060e+06 2.956031e+06 3.125912e+06 3.413556e+06 2.704286e+06 3.507389e+06 3.112902e+06 2.451945e+06 3.783859e+06 2.462164e+06 2.929140e+06 3.645427e+06 2.118435e+06 2.312431e+06 2.866560e+06 1.766747e+06 3.756977e+06 2.946420e+06 2.964127e+06 3.649305e+06 3.986303e+06 2.520821e+06 C5 H3 Cl N O3 P_4.711 1.543080e+07 1.804332e+07 1.869749e+07 1.410188e+07 2.991938e+05 1.079139e+07 1.747682e+07 1.576930e+07 270465.98 1.626259e+07 1.900132e+07 1.637142e+07 1018811.50 1.434542e+07 1.436523e+07 1.703850e+07 4.690088e+05 1.452091e+07 1.857982e+07 1.592393e+07 2.978711e+05 1.540143e+07 1.604739e+07 1.397078e+07 119409.710 1.476570e+07 1.740232e+07 1.717066e+07 1.352531e+05 1.594971e+07 1.899121e+07 1.554744e+07 216423.13 1.125457e+07 1.883664e+07 1.710796e+07 2.684168e+05 1.409055e+07 1.585345e+07 1.711187e+07 2.073118e+05 1.475934e+07 1.532789e+07 1.873325e+07 2.016861e+05 1.371252e+07 1.691930e+07 1.571577e+07 2.151443e+07 1.628315e+07 1.591022e+07 1.284275e+07 1.547638e+07 2.046741e+07 1.659267e+07 1.282648e+07 1.739394e+07 1.868780e+07 9.927234e+06 1.330307e+07 1.559573e+07 1.424742e+07 1.139039e+07 1.045289e+07 1.225452e+07 1.422877e+07 1.695535e+07 1.748123e+07 2.759693e+07 1.863648e+07 1.420971e+07 1.291191e+07 1.166626e+07 1.776787e+07 1.944688e+07 1.763875e+07 1.965595e+07 1.555657e+07 1.244561e+07 2.022458e+07 1.638188e+07 1.210699e+07 1.737789e+07 1.062502e+07 1.540642e+07 1.415847e+07 2.005582e+07 2.575398e+07 2.348601e+07 1.892530e+07 1.402168e+07 1.849723e+07 2.133010e+07 1.477212e+07 1.491240e+07 1.498286e+07 1.671863e+07 1.383729e+07 1.365291e+07 2.047648e+07 2.196582e+07 1.353368e+07 1.408514e+07 1.584682e+07 1.945192e+07 1.537303e+07 2.111633e+07 1.574283e+07 2.005903e+07 1.855628e+07 1.837482e+07 1.978673e+07 1.528176e+07 1.409219e+07 1.647277e+07 2.378399e+07 1.650830e+07 2.675526e+07 1.835977e+07 1.360951e+07 2.009372e+07 1.967376e+07 2.534348e+07 1.289625e+07 1.175236e+07 1.071913e+07 1.424894e+07 1.998347e+07 1.529285e+07 2.061978e+07 1.781889e+07 1.267500e+07 1.931268e+07 1.907795e+07 1.571495e+07 1.595018e+07 1.017744e+07 1.860172e+07 1.636964e+07 2.014151e+07 1.706137e+07 1.325348e+07 1.653176e+07 2.358730e+07 2.106580e+07 1.868219e+07 2.175942e+07 1.823970e+07 1.807097e+07 1.718753e+07 1.245782e+07 2.373339e+07 2.011699e+07 1.542222e+07 1.949416e+07 1.901667e+07 1.851491e+07 1.356090e+07 1.887143e+07 1.363634e+07 1.344369e+07 1.508545e+07 1.084745e+07 1.533209e+07 1.697988e+07 1.580964e+07 1.872030e+07 1.946974e+07 2.164876e+07 1.304634e+07 1.188747e+07 1.306122e+07 1.564284e+07 1.872055e+07 1.831978e+07 1.298717e+07 1.601533e+07 1.941286e+07 1.398714e+07 1.457132e+07 8.870589e+06 1.727437e+07 1.631367e+07 1.404749e+07 2.476087e+07 1.390460e+07 1.918979e+07 1.944976e+07 1.914802e+07 2.115793e+07 1.436284e+07 1.686644e+07 1.599244e+07 1.371084e+07 1.590821e+07 1.663433e+07 1.953133e+07 1.752540e+07 1.894307e+07 2.522768e+07 1.980030e+07 2.139081e+07 1.646690e+07 2.067455e+07 1.755037e+07 1.946643e+07 1.481935e+07 1.927540e+07 2.474975e+07 8.472437e+06 1.779574e+07 9.155680e+06 1.979357e+07 1.719100e+07 1.371572e+07 1.535360e+07 1.737863e+07 1.725283e+07 1.256836e+07 2.604420e+07 1.677849e+07 1.184330e+07 2.110570e+07 2.748960e+07 1.763311e+07 2.186516e+07 1.321457e+07 1.963005e+07 1.074189e+07 1.837203e+07 1.285608e+07 1.530842e+07 2.192205e+07 1.454832e+07 1.567429e+07 1.834212e+07 2.001927e+07 1.808546e+07 1.338081e+07 1.580756e+07 1.586419e+07 1.625358e+07 1.317299e+07 1.790965e+07 1.388456e+07 1.520985e+07 1.702505e+07 1.354777e+07 2.094127e+07 1.129027e+07 1.619517e+07 2.101452e+07 1.071138e+07 1.147182e+07 1.616219e+07 9.279424e+06 2.208072e+07 1.371273e+07 1.443063e+07 1.969957e+07 1.670246e+07 1.262562e+07 C14 H22 N2 O_4.721 1.640125e+05 2.183924e+06 2.399480e+06 2.022194e+06 1.491068e+05 1.451755e+06 2.263977e+06 2.586482e+06 163100.89 1.628406e+06 1.782734e+06 1.940990e+06 162675.73 2.022958e+06 2.367354e+06 2.259639e+06 1.532776e+05 1.989246e+06 2.035308e+06 1.941413e+06 1.652228e+05 1.997240e+06 1.932953e+06 2.434020e+06 69570.505 1.908959e+06 2.100139e+06 1.916159e+06 8.754986e+04 1.905588e+06 2.151771e+06 2.097926e+06 130572.45 2.105543e+06 2.104216e+06 2.095801e+06 1.590100e+05 2.129163e+06 2.140657e+06 1.840399e+06 1.314123e+05 1.856664e+06 1.953149e+06 2.455708e+06 1.186677e+05 1.890772e+06 2.059679e+06 2.076969e+06 1.662942e+05 1.333717e+05 1.330744e+05 1.705151e+05 1.447914e+05 8.876133e+05 1.435686e+05 6.436731e+05 1.330613e+08 5.560176e+05 1.398582e+06 1.367688e+07 1.623771e+05 1.695989e+05 1.189169e+05 1.976615e+08 1.603652e+05 1.383273e+05 1.284779e+05 2.752416e+07 1.785386e+05 1.453816e+05 1.328663e+05 8.786809e+07 2.354800e+07 1.438155e+05 1.672474e+05 1.523356e+05 1.450275e+05 1.331578e+05 1.396069e+05 1.757480e+05 1.384910e+05 1.193599e+05 1.706097e+05 1.175248e+05 1.154337e+05 1.369281e+05 1.673209e+05 1.684830e+05 1.635808e+05 1.306144e+05 1.480774e+05 1.560284e+05 1.730263e+05 1.287703e+05 1.469362e+05 1.456984e+05 1.679847e+05 1.755800e+05 7.786863e+06 1.654594e+05 1.447509e+05 1.589914e+05 1.440270e+05 1.443944e+05 1.649816e+05 1.511726e+05 1.408386e+05 1.442929e+05 1.490548e+05 1.696337e+05 1.517734e+05 6.928028e+07 1.672708e+07 1.511917e+05 1.357109e+05 1.386916e+05 1.349560e+05 1.975410e+05 1.591506e+05 1.331864e+05 1.694162e+05 1.907026e+05 1.488126e+05 1.409353e+05 1.565482e+05 1.833889e+05 1.142740e+05 1.672470e+05 1.115232e+05 1.677252e+05 1.580603e+05 1.704290e+05 1.438735e+05 1.628535e+05 1.312094e+05 1.530686e+05 1.458228e+05 1.505771e+05 1.437665e+05 1.411862e+05 1.562386e+05 1.551978e+05 1.445729e+05 1.776703e+05 1.578803e+05 1.559611e+05 1.631561e+05 1.636194e+05 1.348999e+05 1.591995e+05 1.096311e+05 1.679659e+05 1.516962e+05 1.360002e+05 3.398716e+06 1.485940e+05 1.661811e+05 1.163799e+05 1.397390e+05 1.486266e+05 1.361780e+05 1.480961e+05 1.242351e+05 1.369366e+05 1.861444e+05 1.212496e+05 1.879716e+05 1.750361e+05 1.778698e+05 1.788774e+05 1.137230e+05 1.362539e+07 3.409443e+07 1.552930e+05 1.392659e+05 1.519763e+05 6.086056e+05 1.613448e+05 1.360269e+05 1.521603e+05 1.624771e+05 1.461042e+05 1.184153e+05 1.283133e+05 1.492547e+05 1.642510e+05 1.405205e+05 1.297367e+05 1.900002e+05 1.854008e+05 1.495999e+05 1.382813e+05 1.454849e+05 1.514526e+05 1.542123e+05 1.303129e+05 1.709124e+05 1.439985e+05 1.521929e+05 1.647359e+05 1.390371e+05 1.517061e+05 1.621940e+05 1.326276e+05 1.172328e+05 1.411634e+05 1.574434e+05 1.254813e+05 1.653579e+05 1.280409e+05 1.816777e+05 1.444538e+05 1.595792e+05 1.549542e+05 1.200504e+05 1.269225e+05 1.291487e+05 1.422650e+05 1.315354e+05 1.670604e+05 1.437620e+05 1.163586e+05 1.792836e+05 1.906941e+05 1.340486e+05 1.297246e+05 1.447469e+05 1.497726e+05 1.178017e+05 1.296910e+05 1.302955e+05 1.507417e+05 1.757686e+05 1.513295e+05 1.447044e+05 1.680896e+05 1.616324e+05 1.914317e+05 1.165430e+05 1.329033e+05 1.447068e+05 1.264220e+05 1.444365e+05 1.433009e+05 1.381989e+05 1.247017e+05 1.698228e+05 1.527666e+05 1.583823e+05 1.163894e+05 1.134857e+05 1.677339e+05 1.072842e+05 1.340674e+05 1.301292e+05 1.099344e+05 1.327034e+05 1.803201e+05 1.342777e+05 1.691829e+05 1.671310e+05 1.348914e+05 C13 H25 N O4_4.726 5.629987e+06 2.988899e+06 2.838036e+06 2.723890e+06 1.675482e+05 1.722663e+06 2.655796e+06 3.194478e+06 165278.60 2.290913e+06 2.764618e+06 2.334906e+06 166253.65 2.623272e+06 2.881476e+06 2.764695e+06 1.619291e+05 2.388281e+06 2.810531e+06 2.490823e+06 1.644882e+05 2.231072e+06 2.690163e+06 3.278167e+06 63739.460 2.393462e+06 2.592708e+06 2.451185e+06 8.001398e+04 2.632498e+06 2.693514e+06 2.752321e+06 128379.38 2.608748e+06 2.594239e+06 2.546034e+06 1.534041e+05 2.511100e+06 2.638302e+06 2.601078e+06 1.117560e+05 2.477732e+06 2.905052e+06 2.789958e+06 1.030191e+05 2.581239e+06 2.416482e+06 2.698258e+06 1.608938e+05 2.691825e+06 3.421034e+06 3.700704e+06 2.648766e+06 1.244897e+06 2.223019e+06 1.374972e+06 3.531841e+06 2.216035e+06 3.818628e+06 3.045933e+06 4.642038e+06 3.319529e+06 2.203398e+06 5.948586e+06 1.612983e+06 6.964641e+06 3.187995e+06 7.251347e+05 7.719596e+05 1.360890e+06 8.788004e+05 2.205968e+06 1.680090e+06 1.141211e+07 2.791842e+06 1.263337e+06 5.770055e+06 8.813991e+05 2.917724e+06 2.502060e+06 2.830426e+06 3.148870e+06 3.114741e+06 5.390638e+06 1.417801e+06 2.959971e+06 6.662249e+05 2.753371e+06 3.749709e+06 1.795617e+06 6.200437e+06 3.861657e+06 1.440886e+06 2.110740e+06 2.932673e+06 3.520205e+06 2.076760e+06 1.789402e+06 1.220591e+06 3.505501e+06 1.945973e+06 1.733848e+06 1.730611e+06 2.036290e+06 2.692232e+06 5.163667e+06 3.146751e+06 2.697421e+06 1.317725e+06 6.660037e+06 1.468173e+06 1.293747e+06 1.404856e+06 1.251315e+06 3.301335e+06 2.057433e+06 5.914471e+06 2.948537e+06 2.544396e+06 2.813171e+06 1.595297e+06 3.703394e+06 1.016734e+06 1.779725e+06 1.189814e+06 1.910552e+06 2.345157e+06 2.670463e+06 2.078139e+06 3.265524e+06 3.628464e+06 2.113473e+06 1.050300e+06 2.519509e+06 1.516455e+06 1.052960e+07 2.187700e+06 9.202597e+05 1.345325e+06 2.376454e+06 1.917776e+06 1.575795e+06 3.633153e+06 8.859095e+05 3.832006e+06 2.690652e+06 3.779880e+06 1.452602e+06 1.849115e+06 1.379636e+06 1.017389e+06 3.267898e+06 1.351632e+06 1.759368e+06 3.330844e+06 2.889275e+06 1.862796e+06 4.295225e+06 4.071592e+06 1.288561e+06 2.661381e+06 3.859530e+06 1.724976e+06 1.250398e+06 2.437566e+06 4.317334e+06 4.532625e+06 1.902804e+06 3.505455e+06 3.019735e+06 1.405361e+06 8.364102e+05 8.092445e+05 1.002207e+06 1.450519e+06 3.050225e+06 7.339149e+06 1.858716e+07 2.077576e+06 1.981284e+06 2.444858e+05 2.837083e+06 1.617174e+06 2.963086e+06 2.030354e+06 3.332855e+06 1.472109e+06 2.955343e+06 3.789686e+06 3.460146e+06 2.216395e+06 1.215153e+06 1.163931e+06 1.390937e+06 1.358313e+05 1.882195e+06 1.804965e+06 4.550535e+06 4.138977e+06 2.482279e+06 5.742252e+06 3.242203e+06 1.618948e+06 2.055463e+06 1.823213e+06 3.499109e+06 4.765113e+06 2.099668e+06 5.570901e+06 1.091183e+06 5.423360e+06 2.513928e+06 2.887592e+06 1.230211e+06 3.524108e+06 3.427252e+06 5.020423e+05 1.842879e+06 2.339048e+06 1.982310e+06 2.252766e+06 2.144979e+06 2.536826e+06 4.383454e+06 3.229592e+06 5.457149e+06 3.963606e+06 7.666863e+05 1.577642e+06 1.151813e+06 5.244231e+06 1.806222e+06 2.011632e+06 2.414525e+06 9.303819e+06 8.807556e+06 1.701649e+06 2.298913e+06 5.785279e+06 3.202698e+06 2.917553e+06 1.463778e+06 2.349767e+06 3.757770e+06 1.544163e+06 4.027466e+06 3.003737e+06 6.938235e+06 4.579680e+06 1.402525e+06 1.618875e+06 8.829562e+06 2.983613e+06 9.072762e+05 2.994813e+06 6.419103e+06 5.304259e+06 1.719832e+06 2.566401e+06 1.111582e+06 3.099077e+06 2.429753e+06 C17 H33 N O5_4.745 3.002972e+06 1.356465e+06 1.511437e+06 1.171512e+06 2.178204e+05 9.305027e+05 1.303181e+06 1.303835e+06 197101.33 1.362291e+06 1.090279e+06 1.728082e+06 194702.57 1.114293e+06 1.117061e+06 1.392054e+06 1.865252e+05 1.145727e+06 1.268324e+06 1.194590e+06 1.800118e+05 1.194230e+06 1.291838e+06 1.640230e+06 76238.021 1.195452e+06 1.096413e+06 1.232772e+06 8.730261e+04 1.274719e+06 1.216925e+06 1.311950e+06 112730.44 1.436283e+06 1.275980e+06 1.257131e+06 1.623922e+05 1.086009e+06 1.357785e+06 1.233923e+06 1.256352e+05 1.137491e+06 1.360921e+06 1.495758e+06 1.129651e+05 1.163184e+06 1.219261e+06 1.270902e+06 6.045127e+05 2.015869e+06 2.439337e+06 1.363057e+06 7.740095e+05 1.759733e+05 4.730153e+05 1.603291e+05 5.857527e+05 6.329252e+05 1.170455e+06 8.268868e+05 1.324876e+06 2.212331e+06 1.169953e+06 4.076193e+06 5.460945e+05 4.098756e+06 1.200647e+06 3.823911e+05 1.500613e+05 6.037556e+05 2.493573e+05 6.211984e+05 1.481234e+06 4.365497e+06 6.311313e+05 1.743790e+05 2.543029e+06 1.644898e+05 9.850919e+05 2.617247e+06 1.356624e+06 1.310811e+06 1.881778e+06 4.291984e+06 5.089025e+05 8.189724e+05 1.391040e+05 2.754090e+06 3.809457e+06 1.125663e+06 1.516264e+06 2.433450e+06 1.612787e+05 2.976307e+05 3.021890e+06 2.157129e+06 3.039080e+05 2.021340e+05 6.973202e+05 3.083206e+06 3.200115e+05 6.871558e+05 8.401317e+05 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3.887328e+05 4.310717e+05 1.462862e+06 3.305997e+06 1.886385e+06 C7 H10 N6 O5_4.746 4.344728e+04 1.415778e+05 1.184341e+05 1.388869e+05 5.021696e+04 5.751567e+04 1.574427e+05 1.674519e+05 51647.13 1.156123e+05 1.490613e+05 1.030811e+05 73558.54 8.938119e+04 6.096547e+04 1.407043e+05 9.030640e+04 9.404939e+04 1.406449e+05 1.123219e+05 8.683641e+04 9.260807e+04 1.320381e+05 2.468000e+05 32689.472 8.195538e+04 1.015928e+05 1.166275e+05 5.320429e+04 9.446237e+04 1.053517e+05 1.643299e+05 66164.56 1.063837e+05 1.095722e+05 1.757401e+05 9.448337e+04 9.243743e+04 1.513173e+05 1.027692e+05 8.353722e+04 1.106576e+05 1.297126e+05 8.357598e+04 6.389121e+04 1.222416e+05 1.082544e+05 1.564550e+05 5.260213e+05 5.688799e+04 6.462416e+04 1.915348e+05 9.469461e+04 1.278119e+05 5.921201e+04 5.270600e+04 1.031642e+05 6.260328e+04 8.070243e+04 2.626498e+05 8.303716e+04 8.477579e+04 5.649470e+04 9.426566e+04 3.280549e+05 6.626021e+04 3.184915e+05 9.361998e+04 6.237510e+04 8.478768e+04 2.606653e+05 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3.996577e+04 9.305059e+04 8.679394e+04 6.748269e+04 3.374212e+04 7.492673e+04 8.681415e+04 8.917845e+04 7.711456e+04 9.088302e+04 1.752667e+05 6.520945e+04 8.837043e+04 4.729823e+04 3.480818e+04 1.885891e+05 1.205239e+05 2.137671e+05 4.800820e+04 7.341650e+04 1.482354e+05 9.520484e+04 8.766292e+04 6.462726e+04 5.613827e+04 2.817394e+05 1.092676e+05 1.378733e+05 5.456659e+04 3.537675e+04 6.967712e+04 3.335890e+04 1.265907e+05 5.974679e+04 4.378267e+05 1.168920e+05 6.404588e+04 C5 H2 N2 O4 S_4.75 9.569940e+04 7.400064e+05 7.725443e+04 4.094823e+06 9.725002e+04 2.781522e+06 3.270776e+06 4.872298e+06 66152.46 2.706407e+06 4.686492e+06 4.028785e+06 89094.60 2.529680e+05 8.044457e+04 8.178000e+04 1.041819e+05 9.076901e+04 6.717131e+04 5.618747e+06 9.859906e+04 3.203672e+06 2.613877e+06 3.139799e+06 29859.906 3.503139e+06 3.444107e+06 5.475629e+05 4.059546e+04 3.820371e+06 3.708580e+06 2.926821e+06 140068.50 3.208236e+06 3.119594e+06 2.512152e+06 8.904582e+04 4.161080e+06 5.312683e+06 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3.173728e+05 2.741680e+05 1.792450e+06 4.007365e+05 5.778138e+05 3.475400e+05 4.964493e+05 8.708354e+05 5.038834e+05 1.244123e+06 2.369534e+05 1.565752e+05 1.781092e+05 2.359237e+05 7.168204e+04 7.869416e+05 4.077478e+05 1.115010e+06 6.360653e+05 1.110362e+05 1.415518e+05 6.786842e+04 7.326859e+05 5.610364e+05 2.415044e+05 2.526192e+06 5.050562e+05 1.189016e+06 9.175907e+05 1.479719e+06 7.436627e+05 5.250607e+05 5.791747e+05 2.358438e+05 6.104917e+05 8.886856e+05 5.132056e+05 1.857609e+05 6.698305e+05 2.885794e+05 1.216044e+06 8.012583e+05 7.833839e+05 1.199074e+06 5.708868e+05 2.736720e+05 2.183364e+06 5.870762e+05 4.308148e+05 2.723480e+05 6.779566e+04 6.643047e+05 1.295603e+06 8.059133e+04 5.221781e+05 3.189692e+05 7.419357e+04 C18 H16 N2 O3 S2_4.851 1.639520e+05 8.023954e+05 7.529573e+05 8.258979e+05 1.409203e+05 1.357209e+06 8.157193e+05 1.045895e+06 124551.00 1.347783e+06 9.088645e+05 9.085645e+05 138700.83 6.513343e+05 9.384126e+05 1.167696e+06 1.194052e+05 1.027552e+06 7.650765e+05 8.152957e+05 1.166307e+05 8.879254e+05 1.104197e+06 1.140922e+06 27702.023 8.694897e+05 1.067579e+06 1.032436e+06 4.063841e+04 7.620769e+05 9.056059e+05 1.064241e+06 71975.25 8.224919e+05 1.003628e+06 8.407920e+05 8.850339e+04 1.026847e+06 9.451909e+05 1.205341e+06 7.744063e+04 9.485608e+05 6.713468e+05 9.677353e+05 7.947347e+04 9.844164e+05 1.100522e+06 8.789968e+05 1.360195e+06 8.812613e+05 1.130232e+05 1.230714e+06 1.058225e+06 8.935071e+05 4.487305e+05 1.198064e+06 5.435156e+05 6.146591e+05 1.138014e+05 1.973782e+06 9.119370e+05 6.750718e+05 6.065700e+05 1.123794e+05 1.307234e+06 1.121874e+06 1.543283e+06 2.093337e+05 2.981860e+05 1.438161e+05 2.085248e+06 4.935728e+05 6.323966e+05 9.954274e+05 1.467344e+05 1.389707e+06 3.761637e+05 5.724541e+05 1.177893e+05 1.039774e+06 9.757926e+05 7.582860e+05 2.120202e+05 8.195648e+05 5.589546e+05 4.096053e+05 4.255162e+05 1.851776e+05 1.735396e+05 1.738735e+05 8.955396e+05 2.134836e+06 8.299087e+05 2.388838e+05 1.110518e+06 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1.746205e+06 6.828788e+05 6.578178e+05 1.751188e+06 2.686001e+06 2.303918e+06 1.736595e+06 4.853168e+05 9.663780e+05 4.430534e+05 1.621951e+06 1.065870e+06 7.876834e+05 4.395518e+06 2.718344e+06 2.856389e+06 1.346123e+06 1.790991e+06 1.416468e+06 1.095426e+06 2.098533e+06 9.727306e+05 1.691920e+06 3.061735e+06 1.531414e+06 1.954921e+06 1.120970e+06 7.718355e+05 2.216845e+06 1.066364e+06 1.498053e+06 2.334151e+06 1.397003e+06 8.924802e+05 3.483170e+06 2.376820e+06 1.437814e+06 1.998283e+05 7.801799e+05 1.615636e+06 2.694298e+06 2.222571e+05 2.483559e+06 1.280433e+06 4.480229e+05 C5 H7 N4 O2 P_4.854 1.711592e+05 8.752669e+05 1.117814e+06 1.306813e+06 1.542556e+05 1.141696e+06 1.128998e+06 1.228973e+06 143997.15 1.205263e+06 1.131034e+06 1.200638e+06 153911.49 1.102066e+06 9.918022e+05 1.280093e+06 1.446578e+05 1.167760e+06 8.308902e+05 1.177494e+06 1.501726e+05 9.658917e+05 1.243388e+06 1.690702e+06 39053.502 1.041763e+06 7.573925e+05 1.213925e+06 6.062765e+04 1.084792e+06 1.187331e+06 1.254650e+06 102191.49 9.058713e+05 1.074077e+06 1.131692e+06 1.148231e+05 1.183399e+06 1.200340e+06 1.231138e+06 9.598812e+04 1.088262e+06 1.213799e+06 1.137986e+06 1.022105e+05 1.005280e+06 9.961874e+05 1.272237e+06 2.907656e+06 8.350058e+05 1.489014e+05 1.586253e+06 7.158631e+05 1.506151e+06 4.166773e+05 1.467353e+06 5.812460e+05 6.126730e+05 1.388943e+05 2.116232e+06 1.018722e+06 6.905869e+05 5.925828e+05 1.503434e+05 1.731999e+06 1.187354e+06 2.650848e+06 2.264094e+05 2.938958e+05 1.650738e+05 2.804706e+06 4.942445e+05 8.931016e+05 1.504408e+06 1.726189e+05 2.935860e+06 3.879386e+05 6.126267e+05 1.370233e+05 1.054678e+06 1.026893e+06 6.852591e+05 2.700385e+05 8.671366e+05 5.584193e+05 4.384600e+05 4.358733e+05 2.082072e+05 1.792153e+05 2.368302e+05 1.265867e+06 2.163342e+06 9.924527e+05 2.096037e+05 1.126839e+06 2.016447e+06 2.196845e+06 2.186796e+06 6.185503e+06 8.020199e+05 2.122265e+05 4.504377e+06 1.084557e+06 2.884003e+06 4.723210e+05 4.657791e+05 1.640020e+05 1.646632e+05 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8.599026e+05 1.265350e+05 1.539568e+05 1.315809e+05 2.697626e+05 3.328432e+05 1.538623e+06 2.762791e+05 2.584608e+05 8.490426e+06 1.273678e+05 1.589817e+05 5.421473e+06 3.960051e+05 2.432179e+05 2.870036e+05 6.143961e+06 2.022904e+05 2.173797e+05 4.129875e+05 1.590990e+06 9.084154e+05 1.788393e+05 1.244255e+05 3.616826e+05 3.722765e+05 1.613055e+05 2.086669e+05 4.683553e+05 6.150855e+05 2.215013e+05 5.714419e+05 2.121706e+05 1.569875e+06 3.601106e+05 1.768372e+05 4.591935e+05 1.576978e+05 1.469640e+05 9.178073e+05 3.067011e+05 1.433698e+05 6.963971e+05 2.070960e+05 2.342909e+05 8.655472e+05 1.683207e+05 4.677905e+05 7.848431e+05 2.338051e+05 4.880631e+05 2.390964e+05 3.486982e+05 2.136644e+05 6.918475e+05 7.684225e+05 1.229322e+06 1.117969e+06 1.398524e+05 1.052396e+06 1.044758e+06 2.368036e+05 2.836145e+05 1.723701e+05 1.007991e+06 1.239432e+06 4.172295e+05 9.360052e+05 1.224264e+05 5.947489e+05 1.030512e+06 1.920254e+05 2.119613e+05 1.384779e+05 2.366874e+06 1.735658e+05 3.289451e+05 C14 H17 N O8_4.859 1.589731e+07 7.734775e+05 5.442787e+05 7.998185e+05 3.853651e+05 6.241396e+05 7.411102e+05 7.536588e+05 337281.17 5.805138e+05 7.882533e+05 6.872471e+05 325995.12 7.337479e+05 7.293849e+05 7.111524e+05 3.025537e+05 6.267050e+05 6.679841e+05 8.442678e+05 3.519892e+05 5.276474e+05 7.157858e+05 8.069706e+05 100934.879 6.921793e+05 6.508222e+05 6.441772e+05 1.475278e+05 7.567053e+05 6.402317e+05 7.249475e+05 239123.63 6.831903e+05 7.615164e+05 7.511864e+05 2.919941e+05 7.105331e+05 5.478943e+05 7.490595e+05 2.409865e+05 6.032094e+05 8.290304e+05 7.966951e+05 2.186205e+05 6.097090e+05 6.219780e+05 7.472690e+05 2.679478e+05 3.055264e+05 3.060404e+05 3.805205e+05 3.814927e+05 3.859102e+05 2.730543e+05 2.752164e+05 3.160613e+05 3.039204e+05 3.455315e+05 2.629469e+05 3.813316e+05 2.975312e+05 2.733916e+05 3.905985e+05 3.843545e+05 2.936892e+05 3.138203e+05 3.793567e+05 2.953037e+05 3.429169e+05 3.360543e+05 3.113430e+05 2.153535e+06 4.395358e+07 3.748509e+05 3.637069e+05 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4.041671e+05 3.220238e+05 3.448530e+05 3.655952e+05 3.021334e+05 3.362305e+05 2.830989e+05 3.618745e+05 3.845954e+05 2.986421e+05 2.887871e+05 3.788910e+05 2.734425e+05 3.618579e+05 3.071282e+05 3.312917e+05 3.659121e+05 2.848358e+05 3.312056e+05 3.606794e+05 3.625421e+05 2.779645e+05 2.752999e+05 4.004049e+05 3.550930e+05 2.863290e+05 2.800567e+05 3.854110e+05 2.947766e+05 3.097859e+05 3.006800e+05 3.403694e+05 3.777299e+05 3.058805e+05 2.980474e+05 3.104744e+05 3.363019e+05 3.897651e+05 2.850660e+05 3.807414e+05 3.792620e+05 3.912930e+05 2.881216e+05 3.053039e+05 3.882507e+05 3.870913e+05 2.748894e+05 3.387205e+05 3.121099e+05 4.081836e+05 2.668833e+05 3.759120e+05 2.826076e+05 3.898938e+05 3.594521e+05 3.150958e+05 3.568023e+05 3.335963e+05 4.618842e+06 3.234541e+05 3.785097e+05 2.733159e+05 2.807027e+05 2.997722e+05 3.399906e+05 2.900311e+05 4.178810e+06 2.876419e+05 2.694912e+05 3.902980e+05 3.183683e+05 3.254312e+05 2.848879e+05 3.658686e+05 3.129929e+05 3.050627e+05 3.526079e+05 3.188046e+05 3.243366e+05 3.998307e+05 3.163854e+05 3.565470e+05 3.849895e+05 3.419207e+05 3.520286e+05 3.109464e+05 3.448839e+05 3.207703e+05 2.952932e+05 1.520667e+08 3.421627e+05 3.184038e+05 2.888986e+05 3.559463e+05 3.567736e+05 1.890258e+06 3.120289e+05 2.664625e+05 3.820803e+05 3.029188e+05 2.885967e+05 3.550793e+05 2.817389e+05 4.629570e+05 4.855709e+05 2.789065e+05 3.670235e+05 3.651317e+05 2.981828e+05 C8 H9 N O2_4.86 1.788579e+07 6.309901e+05 1.091584e+06 5.939838e+05 1.472315e+05 5.294261e+05 7.058986e+05 8.367782e+05 139834.64 6.997951e+05 6.608497e+05 8.473712e+05 142032.96 7.809463e+05 6.259458e+05 7.337765e+05 1.315125e+05 6.763014e+05 6.439765e+05 7.842704e+05 1.373740e+05 7.252650e+05 6.933086e+05 9.654165e+05 36788.388 5.598055e+05 7.604130e+05 7.288383e+05 5.409055e+04 6.833692e+05 6.747720e+05 8.856975e+05 92265.05 6.479640e+05 6.716239e+05 7.941800e+05 1.113136e+05 5.335804e+05 8.403662e+05 7.208390e+05 8.246057e+04 6.901941e+05 8.319540e+05 7.625845e+05 7.705753e+04 6.399948e+05 6.824090e+05 7.570916e+05 9.664263e+04 1.349938e+05 1.089415e+05 1.306062e+05 1.492217e+05 1.500556e+05 1.188594e+05 9.924508e+04 1.202641e+05 1.215166e+05 1.311624e+05 1.154317e+05 1.452286e+05 1.053431e+05 1.198625e+05 1.397589e+05 1.328439e+05 1.042076e+05 1.274907e+05 1.479124e+05 1.216342e+05 1.241019e+05 1.354687e+05 1.233890e+05 2.369482e+06 5.447257e+07 1.363937e+05 1.317563e+05 1.197064e+05 1.308360e+05 1.249797e+05 1.263545e+05 1.250936e+05 1.247765e+05 1.426895e+05 1.276716e+05 1.285088e+05 1.187350e+05 1.028327e+05 1.249164e+05 1.208171e+05 1.278514e+05 1.467764e+05 1.188420e+05 1.339170e+05 1.195968e+05 1.134055e+05 1.231019e+05 1.241753e+05 1.185952e+05 1.294710e+05 1.225076e+05 1.400029e+05 1.330742e+05 1.323275e+05 1.497644e+05 1.439192e+05 1.554538e+05 1.492953e+05 1.468010e+05 1.934073e+05 1.515553e+05 1.429652e+05 1.273378e+05 1.375676e+05 1.372285e+07 1.185864e+05 1.337319e+05 1.246144e+05 1.201647e+05 1.415067e+05 1.490546e+05 1.194417e+05 1.153224e+05 1.206073e+05 1.419295e+05 1.154210e+05 4.639497e+06 1.355941e+05 1.006323e+05 1.210452e+05 1.155977e+05 1.356294e+05 1.451973e+05 1.001124e+05 1.460096e+05 1.286440e+05 1.191079e+05 6.237831e+05 1.336574e+05 1.254383e+05 1.229679e+05 1.128579e+05 1.370039e+05 1.231418e+05 1.303263e+05 1.251389e+05 1.531570e+05 1.103776e+05 1.487775e+05 1.206297e+05 1.461245e+05 1.181397e+05 1.405664e+05 1.389887e+05 1.595429e+05 1.236056e+05 1.324003e+05 1.424415e+05 1.243257e+05 1.243402e+05 1.236276e+05 1.430081e+05 1.490514e+05 1.178403e+05 1.030255e+05 1.448744e+05 1.213201e+05 1.304454e+05 1.068330e+05 1.152219e+05 1.330538e+05 1.213981e+05 1.277568e+05 1.251800e+05 1.314921e+05 9.962443e+04 1.180034e+05 1.531630e+05 1.237792e+05 1.226129e+05 1.181914e+05 1.356485e+05 1.074379e+05 1.327105e+05 1.263060e+05 1.283613e+05 1.472686e+05 1.236496e+05 1.104703e+05 1.280740e+05 1.153381e+05 1.449899e+05 1.212320e+05 1.478250e+05 1.917483e+05 1.349478e+05 1.219578e+05 1.082371e+05 1.414665e+05 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2.893069e+07 3.191169e+07 3.901078e+07 4.171077e+07 3.487584e+07 3.771179e+07 3.981538e+07 4.404479e+07 4.538502e+07 3.178664e+07 3.430901e+07 3.778333e+07 3.991109e+07 4.311545e+07 3.702504e+07 3.738717e+07 4.056179e+07 4.495905e+07 2.983790e+07 3.727986e+07 3.312455e+07 4.551923e+07 4.101404e+07 4.751200e+07 4.708182e+07 3.501136e+07 4.441007e+07 3.314563e+07 4.381969e+07 4.033670e+07 4.700328e+07 4.149347e+07 C43 H90 O2 P2 S_4.939 1.372788e+06 5.246884e+05 7.465769e+05 4.567304e+05 1.637094e+05 5.055369e+05 3.907739e+05 5.297149e+05 157292.98 7.118069e+05 5.228997e+05 3.833228e+05 147872.23 7.358117e+05 5.179795e+05 4.097848e+05 1.405433e+05 6.027500e+05 6.633239e+05 5.815266e+05 1.388029e+05 5.581951e+05 4.501993e+05 3.172228e+05 37078.457 5.818731e+05 4.448265e+05 5.323744e+05 4.106478e+04 5.217961e+05 7.110939e+05 5.807299e+05 70514.48 4.537944e+05 5.239708e+05 6.546479e+05 1.099817e+05 5.126935e+05 5.133608e+05 5.843343e+05 9.610357e+04 5.196570e+05 4.606736e+05 4.617919e+05 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9.693359e+05 3.829127e+05 1.098128e+06 3.110402e+06 2.115345e+05 6.484608e+05 1.242990e+06 3.593138e+05 3.961009e+05 1.019739e+06 8.000611e+05 7.780399e+05 4.425443e+05 8.899300e+05 9.130142e+05 2.755522e+05 1.963500e+06 3.696338e+05 3.957988e+05 3.811914e+05 1.955511e+05 1.759171e+05 9.330855e+05 4.340553e+05 8.627680e+05 7.492287e+05 4.315697e+05 4.386432e+05 1.921112e+05 3.331247e+05 3.170015e+05 3.661087e+05 2.425387e+06 4.773375e+05 6.679998e+05 9.228311e+05 2.339513e+06 8.365202e+05 2.727619e+05 3.641751e+05 2.729404e+05 5.505476e+05 4.426965e+05 4.023923e+05 8.400439e+05 5.773727e+05 4.739348e+05 1.536645e+06 1.219417e+06 1.181199e+06 8.199550e+05 5.185225e+05 2.493806e+05 1.338927e+06 1.579394e+05 2.074384e+05 1.464177e+05 1.201185e+05 6.239388e+05 8.073537e+05 2.614923e+05 4.556351e+05 3.163709e+05 1.284663e+05 C48 H91 N3 O P2_4.942 3.751132e+06 3.426969e+06 3.249546e+06 3.149155e+06 1.492751e+05 2.707875e+06 2.914660e+06 2.884612e+06 174621.32 3.289145e+06 2.945286e+06 2.415554e+06 168378.02 3.790749e+06 2.860816e+06 2.688185e+06 1.460732e+05 3.369680e+06 3.865189e+06 3.033533e+06 1.371761e+05 3.333050e+06 2.274248e+06 3.336558e+05 32700.474 2.957224e+06 3.115997e+06 3.100266e+06 3.773597e+04 3.668406e+06 3.297022e+06 2.317313e+06 76178.89 3.038694e+06 3.230735e+06 3.242275e+06 1.152926e+05 3.250619e+06 3.027516e+06 2.450807e+06 8.780321e+04 3.402204e+06 2.671235e+06 3.006998e+06 9.574421e+04 3.870031e+06 4.442083e+06 1.469956e+06 4.215252e+06 3.808633e+06 3.849296e+06 3.802816e+06 5.054363e+06 5.555033e+06 1.276181e+06 4.725674e+06 5.133619e+06 3.259580e+06 3.063785e+06 5.206642e+06 2.810672e+06 3.678123e+06 3.873177e+06 3.190789e+06 3.098266e+06 3.582081e+06 2.541503e+06 3.218949e+06 2.604924e+06 4.548796e+06 2.282248e+06 4.738524e+06 4.069204e+06 2.485741e+06 2.171186e+06 3.708602e+06 4.456952e+06 3.099207e+06 2.837893e+06 3.577112e+06 4.393336e+06 3.094897e+06 3.400729e+06 2.052979e+06 3.192273e+06 3.152878e+06 3.935121e+06 5.042946e+06 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2.493034e+06 3.086629e+06 4.014571e+06 3.351992e+06 2.737763e+06 2.496056e+06 2.353128e+06 3.962268e+06 3.361934e+06 3.192708e+06 6.077667e+06 1.727843e+06 3.237063e+06 3.252619e+06 4.367756e+06 2.536653e+06 4.290759e+06 3.131738e+06 3.492594e+06 2.861352e+06 3.643433e+06 2.226055e+06 2.945683e+06 3.260900e+06 3.431322e+06 2.547661e+06 3.634495e+06 2.659147e+06 2.737985e+06 2.955449e+06 4.586605e+06 5.208397e+06 2.320116e+06 2.875663e+06 3.706989e+06 2.567783e+06 2.957199e+06 4.022890e+06 3.363811e+06 5.383432e+06 5.482959e+06 3.448277e+06 4.277733e+06 3.339419e+06 2.670904e+06 3.952777e+06 3.224918e+06 4.230835e+06 3.388212e+06 3.920961e+06 3.554553e+06 4.783071e+06 3.695719e+06 2.392938e+06 2.532604e+06 4.141496e+06 4.353206e+06 3.940352e+06 3.292684e+06 1.471817e+06 4.630139e+06 1.875542e+06 2.033099e+06 2.437166e+06 2.631641e+06 3.887806e+06 4.423412e+06 4.550115e+06 2.029282e+06 1.739069e+06 3.120167e+06 3.057484e+06 3.551844e+06 3.585259e+06 3.435418e+06 4.314010e+06 2.465046e+06 5.008890e+06 2.298883e+06 3.048064e+06 3.275264e+06 2.420370e+06 3.918804e+06 3.145737e+06 3.763236e+06 3.687888e+06 5.334855e+06 4.509909e+06 2.910143e+06 1.508104e+06 4.357259e+06 3.707430e+06 3.683246e+06 1.385594e+06 5.829113e+06 3.868330e+06 1.640520e+06 C22 Sphingomyelin (d18:1/22:0)_4.942 2.490526e+07 1.838367e+07 1.816351e+07 1.846476e+07 4.031398e+05 1.282919e+07 1.715191e+07 1.677797e+07 436779.83 2.184325e+07 1.277312e+07 1.587578e+07 434592.89 1.635015e+07 1.896273e+07 1.606269e+07 3.961804e+05 1.890067e+07 1.817757e+07 1.768107e+07 4.008074e+05 2.002366e+07 1.491166e+07 6.218829e+06 99194.671 2.234057e+07 1.816125e+07 1.635318e+07 1.065144e+05 2.155887e+07 1.630985e+07 1.662028e+07 207795.33 1.747229e+07 1.587336e+07 1.845875e+07 3.238317e+05 1.876607e+07 1.463618e+07 1.317199e+07 2.467372e+05 1.933024e+07 1.571648e+07 1.797927e+07 2.393173e+05 2.078694e+07 1.862464e+07 1.406982e+07 1.847071e+07 2.216985e+07 1.854794e+07 1.935748e+07 2.675693e+07 2.319329e+07 1.269392e+07 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1.662352e+07 2.080212e+07 1.587752e+07 1.946521e+07 1.397191e+07 1.348351e+07 1.981501e+07 1.734082e+07 1.914840e+07 1.670589e+07 2.002433e+07 1.738425e+07 1.987392e+07 9.338815e+06 1.031895e+07 1.488889e+07 1.231839e+07 1.684199e+07 2.061711e+07 1.932052e+07 1.789307e+07 1.893943e+07 1.557628e+07 1.647181e+07 1.693426e+07 1.481571e+07 1.896692e+07 1.843402e+07 2.240145e+07 1.369527e+07 1.155520e+07 2.218940e+07 1.618608e+07 1.459265e+07 2.094718e+07 1.563191e+07 2.168089e+07 1.974613e+07 1.321261e+07 1.331245e+07 2.165084e+07 2.348279e+07 1.825779e+07 2.653624e+07 1.468705e+07 1.992889e+07 1.708239e+07 2.089356e+07 1.694760e+07 2.339670e+07 1.517836e+07 1.746395e+07 1.546333e+07 1.767581e+07 1.607548e+07 1.487306e+07 1.501893e+07 1.922307e+07 1.815533e+07 1.846221e+07 1.581553e+07 2.012633e+07 1.535294e+07 2.151903e+07 9.153909e+06 1.590674e+07 1.784106e+07 1.417496e+07 1.284293e+07 1.751868e+07 1.719891e+07 1.333391e+07 2.411810e+07 2.517139e+07 1.562605e+07 1.851945e+07 1.810074e+07 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1.092838e+07 9.259289e+06 9.129918e+06 7.463555e+06 5.243668e+06 8.580527e+06 8.214582e+06 8.491169e+06 8.617383e+06 7.399378e+06 8.965156e+06 7.254784e+06 7.719642e+06 6.987476e+06 7.900875e+06 9.040333e+06 7.800203e+06 6.217642e+06 8.919632e+06 9.831048e+06 9.126873e+06 7.959951e+06 9.890284e+06 9.878926e+06 9.635872e+06 8.207786e+06 6.694514e+06 8.210584e+06 9.730419e+06 7.886222e+06 8.457250e+06 8.672981e+06 9.548505e+06 7.886486e+06 7.632091e+06 7.944184e+06 7.218530e+06 9.091661e+06 9.053077e+06 7.811298e+06 7.914136e+06 1.290380e+07 8.888033e+06 6.807179e+06 8.782479e+06 9.685476e+06 1.323460e+07 7.378194e+06 8.545810e+06 7.220218e+06 5.318166e+06 1.069128e+07 8.841572e+06 9.090456e+06 1.043384e+07 8.161318e+06 7.083583e+06 8.117072e+06 1.323797e+07 8.970381e+06 6.199659e+06 9.732104e+06 1.007902e+07 7.992070e+06 7.792914e+06 1.127988e+07 1.027271e+07 6.601824e+06 7.086339e+06 8.504029e+06 7.212734e+06 1.184086e+07 7.742495e+06 9.753139e+06 7.964937e+06 5.502654e+06 1.108496e+07 5.556465e+06 8.619664e+06 8.599454e+06 8.626875e+06 6.999240e+06 5.270560e+06 7.955104e+06 9.354333e+06 8.032785e+06 5.990966e+06 7.952826e+06 8.346062e+06 9.041940e+06 7.934776e+06 6.196524e+06 8.258679e+06 9.198400e+06 5.885141e+06 7.550400e+06 7.705659e+06 7.505615e+06 6.835694e+06 7.355466e+06 7.998904e+06 7.592068e+06 9.289231e+06 8.521636e+06 9.603039e+06 5.699030e+06 7.652613e+06 8.534791e+06 5.644748e+06 7.499614e+06 7.754954e+06 6.276678e+06 8.154526e+06 5.763444e+06 5.828447e+06 9.932676e+06 7.151700e+06 1.084057e+07 1.212021e+07 7.507637e+06 8.990366e+06 1.017176e+07 8.347324e+06 7.677993e+06 6.738867e+06 9.565530e+06 9.837898e+06 7.210508e+06 7.287398e+06 7.274616e+06 7.476033e+06 8.182502e+06 7.573697e+06 7.349709e+06 9.562598e+06 8.883510e+06 8.093049e+06 6.125373e+06 5.688917e+06 5.682018e+06 7.195343e+06 8.003451e+06 9.939397e+06 7.449504e+06 9.711821e+06 6.950901e+06 1.040113e+07 7.771404e+06 9.850887e+06 7.449810e+06 9.847813e+06 7.757463e+06 9.076060e+06 8.797535e+06 8.072266e+06 8.732337e+06 9.687022e+06 6.526767e+06 7.001573e+06 1.154178e+07 8.291148e+06 9.473075e+06 8.332707e+06 6.804686e+06 6.337931e+06 1.031439e+07 8.921172e+06 1.135329e+07 6.164154e+06 6.131629e+06 1.041061e+07 1.003666e+07 7.374461e+06 8.185049e+06 8.381639e+06 9.070719e+06 C20 H40 N O5 P_4.963 1.933209e+07 1.374205e+07 1.677824e+07 1.485374e+07 1.227067e+05 1.115073e+07 1.552792e+07 1.562766e+07 117687.87 1.397687e+07 1.499260e+07 1.489748e+07 108368.14 1.396378e+07 1.344993e+07 1.494476e+07 1.087167e+05 1.517229e+07 1.359280e+07 1.505072e+07 1.074335e+05 1.394522e+07 1.584824e+07 1.393222e+07 25450.232 1.381381e+07 1.501346e+07 1.381469e+07 2.865387e+04 1.491276e+07 1.485312e+07 1.455092e+07 60641.13 1.370328e+07 1.503743e+07 1.469536e+07 8.068093e+04 1.392153e+07 1.590550e+07 1.454816e+07 6.438306e+04 1.343830e+07 1.397999e+07 1.633839e+07 5.878433e+04 1.377377e+07 1.290221e+07 1.561426e+07 1.386188e+07 1.742544e+07 1.182192e+07 1.924897e+07 1.418104e+07 1.137207e+07 1.677117e+07 1.080593e+07 1.543214e+07 1.138512e+07 1.305138e+07 1.197820e+07 1.512259e+07 1.172628e+07 1.524365e+07 1.585799e+07 1.148739e+07 1.338230e+07 1.403542e+07 1.296001e+07 9.641306e+06 1.107636e+07 1.784629e+07 1.048756e+07 1.185064e+07 1.661916e+07 1.432176e+07 1.283752e+07 1.073774e+07 1.536931e+07 1.803034e+07 1.474414e+07 1.347189e+07 1.231856e+07 1.474339e+07 1.664019e+07 1.017741e+07 2.229085e+07 1.027706e+07 1.426109e+07 1.154732e+07 1.613471e+07 1.732529e+07 1.254432e+07 1.097420e+07 1.139959e+07 1.521185e+07 1.176988e+07 1.645155e+07 1.036425e+07 1.071271e+07 1.660839e+07 1.285425e+07 1.331375e+07 1.365284e+07 1.456486e+07 1.697966e+07 1.596645e+07 1.043300e+07 1.212245e+07 1.240066e+07 9.524693e+06 1.174263e+07 1.108733e+07 1.645949e+07 1.047322e+07 9.194151e+06 1.574759e+07 1.172101e+07 1.320177e+07 1.450965e+07 1.326867e+07 1.173711e+07 1.810347e+07 1.089833e+07 1.139399e+07 1.107243e+07 1.494224e+07 2.134538e+07 1.527956e+07 1.081277e+07 9.302770e+06 1.271391e+07 1.387563e+07 1.376252e+07 1.333417e+07 1.555407e+07 1.247290e+07 9.241396e+06 1.544538e+07 1.276866e+07 1.251375e+07 1.811858e+07 1.643394e+07 1.254599e+07 1.219434e+07 1.660635e+07 1.632813e+07 1.115479e+07 1.486259e+07 1.447271e+07 1.246447e+07 1.128773e+07 9.978815e+06 1.215685e+07 1.403331e+07 1.243158e+07 1.828361e+07 1.294519e+07 1.376037e+07 1.451109e+07 1.245791e+07 1.254524e+07 1.663135e+07 1.994556e+07 1.384616e+07 1.794789e+07 1.208695e+07 1.586495e+07 1.263970e+07 1.573657e+07 1.681421e+07 1.640083e+07 1.575186e+07 9.865099e+06 1.593572e+07 1.334041e+07 1.280458e+07 1.816023e+07 1.535078e+07 1.149655e+07 1.044996e+07 9.399729e+06 1.703454e+07 1.034912e+07 1.234780e+07 1.245746e+07 1.356921e+07 1.516785e+07 1.653887e+07 1.448314e+07 1.141927e+07 1.541678e+07 1.259153e+07 1.364775e+07 1.863820e+07 8.737337e+06 1.329720e+07 1.248146e+07 1.513149e+07 1.453422e+07 1.307619e+07 1.190054e+07 1.142936e+07 1.332303e+07 1.113199e+07 1.486384e+07 9.397829e+06 1.515044e+07 1.302207e+07 1.153327e+07 1.355999e+07 1.366491e+07 1.354035e+07 1.490438e+07 1.105754e+07 1.576451e+07 9.538793e+06 1.237559e+07 1.412351e+07 7.169667e+06 1.365842e+07 1.412506e+07 1.236238e+07 1.488340e+07 1.390289e+07 1.791153e+07 1.374733e+07 1.618007e+07 1.269920e+07 1.511417e+07 1.604159e+07 1.066830e+07 1.221400e+07 1.058092e+07 1.787758e+07 1.451556e+07 1.707175e+07 1.233853e+07 1.328483e+07 1.367555e+07 1.578932e+07 1.014278e+07 1.399617e+07 1.539351e+07 1.892376e+07 1.633303e+07 1.163684e+07 1.633798e+07 1.631630e+07 1.393648e+07 1.355320e+07 1.024147e+07 1.377733e+07 1.323800e+07 1.702784e+07 1.921182e+07 1.498645e+07 1.720815e+07 1.410508e+07 1.871904e+07 1.131952e+07 1.396969e+07 1.940153e+07 C15 H21 N O4_4.964 2.161314e+06 1.557392e+06 1.590950e+06 1.374689e+06 1.886112e+05 1.098470e+06 1.561562e+06 1.479877e+06 201646.78 1.339962e+06 1.438735e+06 1.645880e+06 197326.05 1.340783e+06 1.338301e+06 1.514692e+06 1.847198e+05 1.475313e+06 1.142697e+06 1.351585e+06 1.635799e+05 1.505205e+06 1.391470e+06 1.903910e+06 34212.552 1.197501e+06 1.469812e+06 1.192927e+06 4.108387e+04 1.819730e+06 1.223290e+06 1.343950e+06 97535.35 1.425577e+06 1.292646e+06 1.502950e+06 1.313550e+05 1.601133e+06 1.528310e+06 1.328166e+06 1.039003e+05 1.306694e+06 1.541447e+06 1.429202e+06 9.591806e+04 1.431470e+06 1.344221e+06 1.502390e+06 1.528869e+06 2.167930e+06 2.384584e+06 4.348718e+06 1.935601e+06 2.444274e+06 6.655889e+05 5.545434e+06 5.251774e+06 3.316750e+06 2.664011e+06 3.576809e+06 4.443844e+06 1.879006e+06 4.422476e+05 1.102934e+06 1.022804e+06 3.944564e+06 2.619500e+06 1.219156e+06 1.534285e+06 1.783678e+06 3.643283e+05 1.041671e+06 1.156012e+06 1.470285e+05 1.758337e+06 9.940788e+05 6.405292e+05 1.599705e+05 2.701322e+06 7.232777e+05 2.278757e+06 1.727910e+05 2.073916e+05 5.892079e+05 4.240509e+05 1.580703e+05 1.977855e+05 2.568067e+06 4.592587e+05 6.288895e+05 1.608922e+06 3.106958e+06 5.958686e+06 2.246121e+05 1.003235e+06 2.435828e+06 4.744655e+05 8.656502e+05 1.774631e+06 2.520277e+05 1.731376e+06 3.118511e+06 7.660234e+05 1.293311e+06 5.887983e+05 1.431545e+06 1.677582e+06 1.245558e+06 1.479262e+05 1.189128e+06 7.334164e+05 4.098293e+06 1.584278e+06 3.397348e+06 4.039959e+06 1.507700e+06 2.346879e+06 3.567075e+06 4.469057e+06 5.173609e+05 2.117417e+06 2.443410e+06 2.081956e+06 1.260510e+06 1.250246e+06 2.185676e+05 1.931641e+05 1.123742e+06 7.768810e+05 6.836244e+05 5.370097e+05 1.149848e+06 1.029011e+06 4.205127e+06 1.149203e+06 1.760224e+06 3.465367e+05 1.746004e+06 8.465469e+05 4.207512e+05 1.214916e+06 1.454291e+06 9.419895e+05 3.096294e+06 1.985057e+05 4.586808e+06 3.477274e+06 4.648272e+05 2.142512e+06 4.664453e+05 5.081535e+05 6.113361e+05 6.112108e+05 2.374313e+06 1.832214e+06 9.452003e+05 2.868839e+06 3.484769e+05 1.450252e+06 8.401009e+05 3.194091e+06 6.984641e+06 1.811392e+06 2.131366e+06 2.739191e+06 4.267894e+05 1.447950e+06 3.983394e+05 3.634200e+05 7.200650e+05 8.939037e+05 5.029584e+05 1.384969e+06 1.923482e+06 2.766013e+05 2.111390e+06 1.317456e+06 1.579493e+06 1.295187e+06 8.538788e+05 2.459194e+05 1.881774e+05 5.779629e+05 1.673535e+05 7.740849e+06 3.096861e+05 3.461240e+05 1.458044e+06 9.166931e+06 1.091744e+06 2.225477e+06 1.978217e+06 1.675799e+05 5.668814e+05 3.298344e+05 2.837726e+06 3.854277e+06 1.673598e+06 1.848289e+06 2.607763e+06 2.458686e+06 2.419206e+05 2.373182e+05 1.248320e+06 6.712880e+05 5.835910e+05 8.717882e+05 5.710999e+05 2.237940e+06 1.054728e+06 1.706890e+06 5.133666e+05 9.743669e+05 2.001141e+06 2.031560e+05 3.946770e+05 1.288486e+06 1.836745e+05 3.628373e+06 9.764597e+05 2.032433e+06 1.096256e+06 4.182619e+06 2.224589e+06 5.945138e+05 1.554998e+06 1.301556e+06 8.229417e+05 5.051509e+05 1.253241e+06 6.272299e+05 2.533511e+06 2.922342e+06 1.409069e+06 6.227053e+05 1.925013e+05 1.566347e+06 1.171956e+06 1.712550e+06 4.649724e+06 9.601814e+05 1.113381e+06 9.989506e+05 2.843692e+06 3.990984e+05 5.056267e+05 6.271008e+05 4.502913e+06 1.170138e+06 2.036257e+06 1.995364e+06 1.622998e+06 1.784254e+05 1.042667e+06 2.395252e+06 6.462665e+05 3.134757e+05 1.932744e+05 9.270552e+05 2.877517e+06 9.173550e+05 3.339009e+05 C42 H85 N3 O8_4.965 8.915521e+06 7.944515e+06 8.368512e+06 7.489447e+06 2.370919e+05 5.626776e+06 7.767307e+06 7.209328e+06 253246.56 7.596535e+06 6.829204e+06 6.909240e+06 229944.55 8.366017e+06 7.701590e+06 7.370109e+06 2.302242e+05 7.256408e+06 7.594288e+06 7.670601e+06 2.448054e+05 8.073732e+06 8.774792e+06 1.415382e+06 61793.346 9.279163e+06 8.020688e+06 8.170879e+06 6.097909e+04 7.850526e+06 7.666400e+06 7.084120e+06 125611.42 6.945426e+06 7.711958e+06 7.554634e+06 1.700313e+05 7.803556e+06 7.222253e+06 6.996660e+06 1.420200e+05 7.796138e+06 7.128935e+06 7.402567e+06 1.179029e+05 7.172921e+06 7.404209e+06 7.744154e+06 7.765511e+06 7.574812e+06 7.373761e+06 8.281905e+06 1.040051e+07 8.263784e+06 4.420736e+06 5.795446e+06 1.020609e+07 7.062493e+06 8.482154e+06 7.106854e+06 8.617031e+06 6.458172e+06 7.205845e+06 6.365400e+06 5.650272e+06 6.552129e+06 5.747753e+06 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7.586903e+06 1.043370e+07 8.337999e+06 9.446282e+06 1.058754e+07 6.263358e+06 7.009261e+06 6.917919e+06 1.012385e+07 9.213413e+06 1.176544e+07 8.264518e+06 8.114306e+06 8.260433e+06 1.119935e+07 6.099908e+06 9.132651e+06 9.695746e+06 1.215135e+07 8.355190e+06 7.333018e+06 9.148261e+06 1.104110e+07 8.905693e+06 8.218728e+06 6.817530e+06 8.448799e+06 9.283525e+06 1.184702e+07 1.307748e+07 9.958031e+06 1.124622e+07 6.983482e+06 1.349822e+07 7.360440e+06 8.702600e+06 1.382922e+07 C37 H84 N6 O4 P2_4.968 1.058026e+07 8.229304e+06 1.124580e+07 9.454475e+06 1.336760e+05 6.853518e+06 8.747045e+06 9.752958e+06 126971.36 8.193916e+06 1.009928e+07 9.034829e+06 111873.38 9.060528e+06 8.874260e+06 8.847091e+06 1.158531e+05 8.977868e+06 8.765229e+06 9.212091e+06 1.153393e+05 8.748069e+06 1.014374e+07 7.519443e+06 27239.729 9.506633e+06 9.115354e+06 9.635059e+06 3.060328e+04 8.892278e+06 8.272687e+06 1.012631e+07 64773.99 7.878406e+06 9.542154e+06 9.630335e+06 8.544567e+04 8.723888e+06 8.671808e+06 9.328757e+06 6.762245e+04 8.089083e+06 1.010676e+07 9.897431e+06 5.543675e+04 7.378714e+06 9.066315e+06 9.323458e+06 9.367771e+06 9.060065e+06 9.116120e+06 1.233821e+07 1.006835e+07 7.909800e+06 1.073972e+07 7.347196e+06 9.658145e+06 6.734263e+06 9.277281e+06 6.950168e+06 1.086637e+07 8.757820e+06 8.984123e+06 1.099027e+07 7.848500e+06 7.860203e+06 8.058624e+06 7.863573e+06 5.358304e+06 6.720194e+06 1.099092e+07 6.931332e+06 7.891609e+06 8.662737e+06 7.614677e+06 7.786153e+06 7.923609e+06 9.652811e+06 1.104540e+07 7.419499e+06 6.994154e+06 9.541282e+06 8.422517e+06 1.151045e+07 6.581800e+06 1.278085e+07 7.017263e+06 8.096384e+06 7.181727e+06 1.000634e+07 1.044421e+07 6.820041e+06 6.427451e+06 7.703770e+06 8.490401e+06 7.841416e+06 1.042403e+07 6.757896e+06 6.748252e+06 9.474829e+06 7.011733e+06 9.909432e+06 6.950182e+06 9.251892e+06 1.055135e+07 9.694941e+06 7.001459e+06 7.486540e+06 7.161495e+06 6.814739e+06 8.647350e+06 7.661929e+06 9.384178e+06 6.658462e+06 5.996289e+06 1.031328e+07 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1.144497e+07 5.336471e+06 8.625933e+06 5.743761e+06 9.774410e+06 9.758355e+06 7.951577e+06 6.769027e+06 6.040194e+06 8.001285e+06 7.702995e+06 1.022670e+07 6.278462e+06 9.974199e+06 8.124927e+06 6.918985e+06 6.948553e+06 8.399399e+06 7.774381e+06 9.149691e+06 5.376057e+06 8.608593e+06 6.606155e+06 7.519417e+06 8.383678e+06 4.115101e+06 8.232686e+06 9.700120e+06 8.675824e+06 8.615719e+06 9.121500e+06 1.087320e+07 8.160469e+06 9.959500e+06 8.774845e+06 9.162701e+06 1.126809e+07 5.355055e+06 7.583253e+06 6.677084e+06 1.062058e+07 9.584276e+06 1.105180e+07 8.794178e+06 7.233631e+06 9.205422e+06 1.186638e+07 6.593128e+06 1.065874e+07 1.006542e+07 1.222323e+07 6.876578e+06 7.793767e+06 8.466847e+06 1.209596e+07 8.272556e+06 8.627844e+06 4.320152e+06 9.015296e+06 9.531914e+06 1.191686e+07 1.267338e+07 9.772984e+06 1.171693e+07 8.842171e+06 1.075732e+07 7.604290e+06 8.707766e+06 1.321001e+07 C17 H41 N5 O4_4.968 1.360946e+07 1.203441e+07 1.243272e+07 1.141344e+07 1.273522e+05 8.275604e+06 1.121791e+07 1.028662e+07 132225.95 1.226758e+07 1.007972e+07 1.003987e+07 116398.08 1.285040e+07 1.153377e+07 1.036963e+07 1.196499e+05 1.184793e+07 1.157526e+07 1.141182e+07 1.320916e+05 1.197817e+07 1.201502e+07 2.590497e+06 33131.209 1.387483e+07 1.158574e+07 1.249151e+07 3.150025e+04 1.217656e+07 1.178430e+07 1.008225e+07 65404.16 1.048311e+07 1.143293e+07 1.215349e+07 8.973330e+04 1.045894e+07 1.144370e+07 9.667093e+06 7.527992e+04 1.142941e+07 1.093415e+07 1.136881e+07 6.520616e+04 1.134780e+07 1.264478e+07 9.734727e+06 1.243738e+07 1.050275e+07 1.211920e+07 1.096928e+07 1.594769e+07 1.309277e+07 7.044720e+06 9.699769e+06 1.556012e+07 1.087285e+07 1.050227e+07 1.026192e+07 1.267421e+07 8.512789e+06 1.096185e+07 8.484306e+06 8.543334e+06 1.014530e+07 9.063374e+06 1.018045e+07 7.827759e+06 1.395516e+07 9.258509e+06 1.352409e+07 9.991490e+06 9.095157e+06 9.179607e+06 9.506272e+06 1.493522e+07 1.312164e+07 1.092102e+07 8.324957e+06 1.133813e+07 1.310950e+07 9.725344e+06 8.924582e+06 1.078338e+07 8.815163e+06 1.134281e+07 1.294600e+07 1.293782e+07 1.139524e+07 8.813641e+06 1.069617e+07 1.166001e+07 1.598191e+07 8.853703e+06 8.907546e+06 8.842162e+06 8.591684e+06 9.616753e+06 1.098484e+07 1.120012e+07 1.339123e+07 1.053114e+07 9.488259e+06 6.530506e+06 5.861428e+06 1.175484e+07 9.939472e+06 7.644918e+06 1.149638e+07 1.041601e+07 1.148542e+07 9.200326e+06 1.416638e+07 1.100903e+07 1.135931e+07 1.073954e+07 1.047862e+07 1.087888e+07 1.000331e+07 1.145494e+07 9.489489e+06 1.132260e+07 1.042258e+07 1.111310e+07 1.091029e+07 1.071676e+07 1.198650e+07 7.638520e+06 1.073084e+07 1.348259e+07 8.727498e+06 1.009436e+07 9.227075e+06 9.893496e+06 1.389320e+07 9.911513e+06 9.471428e+06 1.206904e+07 7.932112e+06 1.011616e+07 1.390058e+07 9.785256e+06 1.033624e+07 1.440386e+07 1.137760e+07 7.808546e+06 1.109375e+07 1.016056e+07 1.318057e+07 1.035079e+07 1.088268e+07 1.174182e+07 1.120097e+07 1.030927e+07 1.385194e+07 9.979149e+06 8.366688e+06 1.209680e+07 1.059190e+07 1.116033e+07 8.546526e+06 9.615454e+06 1.651982e+07 1.015545e+07 7.840070e+06 8.798909e+06 1.060073e+07 9.499452e+06 8.692233e+06 9.987362e+06 9.663816e+06 1.155936e+07 1.435811e+07 1.010852e+07 1.335638e+07 7.595826e+06 9.373014e+06 9.858793e+06 1.311439e+07 6.218892e+06 1.158596e+07 8.387031e+06 1.130401e+07 1.035224e+07 8.831563e+06 7.897009e+06 1.343565e+07 1.137667e+07 1.017191e+07 1.083551e+07 1.315377e+07 7.807503e+06 9.206302e+06 7.290900e+06 9.997418e+06 1.339470e+07 1.080707e+07 1.045787e+07 9.683884e+06 7.629199e+06 8.033975e+06 1.272050e+07 9.059990e+06 1.667023e+07 1.461759e+07 1.239849e+07 1.325836e+07 9.569486e+06 9.704066e+06 1.341779e+07 9.017969e+06 1.394714e+07 9.884001e+06 9.854468e+06 1.161221e+07 8.920695e+06 1.048452e+07 7.033130e+06 1.229126e+07 1.352636e+07 1.133623e+07 1.079326e+07 1.029267e+07 6.248402e+06 7.007325e+06 9.422753e+06 7.426299e+06 1.041533e+07 1.529379e+07 1.243768e+07 8.539907e+06 8.810947e+06 1.182404e+07 8.855724e+06 9.275981e+06 1.248044e+07 1.147705e+07 1.242453e+07 1.048938e+07 1.531615e+07 8.782679e+06 1.617508e+07 1.151308e+07 1.063040e+07 1.290778e+07 1.177326e+07 1.403750e+07 1.072031e+07 1.217348e+07 9.147474e+06 1.374744e+07 1.198386e+07 1.171827e+07 8.531624e+06 1.337764e+07 1.426005e+07 1.198171e+07 7.482079e+06 1.686757e+07 9.572202e+06 6.855804e+06 SM 38:2;O2_4.968 3.386230e+07 2.514780e+07 2.994817e+07 2.641170e+07 2.592093e+05 1.658735e+07 2.751941e+07 2.869725e+07 249701.24 2.237235e+07 2.661213e+07 2.653638e+07 226994.58 2.395682e+07 2.478019e+07 2.482534e+07 2.361229e+05 2.521272e+07 2.432026e+07 2.774691e+07 2.391343e+05 2.428663e+07 2.824295e+07 1.980452e+07 57970.562 2.701648e+07 2.533836e+07 2.577522e+07 6.537233e+04 2.527778e+07 2.557221e+07 2.698508e+07 138812.79 2.370695e+07 2.537909e+07 2.574521e+07 1.823936e+05 2.332054e+07 2.623249e+07 2.552268e+07 1.406826e+05 2.444841e+07 2.523335e+07 2.858971e+07 1.211329e+05 2.461763e+07 2.447173e+07 2.457105e+07 2.654416e+07 2.877087e+07 2.286246e+07 3.350375e+07 2.601254e+07 1.948678e+07 2.754588e+07 2.374768e+07 2.684294e+07 1.867166e+07 2.947138e+07 2.181381e+07 2.991114e+07 2.511416e+07 2.708089e+07 2.671150e+07 2.036971e+07 2.458593e+07 2.234808e+07 2.201934e+07 1.580202e+07 1.719422e+07 3.337303e+07 1.670769e+07 2.416940e+07 2.333925e+07 2.376702e+07 2.158447e+07 1.763089e+07 2.657381e+07 3.742834e+07 2.424756e+07 2.592247e+07 2.398688e+07 2.003734e+07 3.108373e+07 1.676327e+07 3.206291e+07 1.905630e+07 2.271138e+07 1.733918e+07 2.511660e+07 2.918896e+07 2.320419e+07 1.829246e+07 2.346373e+07 2.597012e+07 1.673843e+07 2.595465e+07 1.723764e+07 1.861671e+07 2.356209e+07 2.120429e+07 2.437564e+07 2.210429e+07 2.361593e+07 3.074368e+07 3.225506e+07 1.470006e+07 2.138463e+07 2.106738e+07 1.666059e+07 2.233253e+07 2.027603e+07 2.698403e+07 1.681497e+07 1.716632e+07 2.835442e+07 1.874438e+07 2.047913e+07 2.640531e+07 2.354238e+07 1.825744e+07 2.679176e+07 1.360658e+07 2.017071e+07 1.772941e+07 2.589474e+07 3.622936e+07 2.787900e+07 1.906633e+07 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7.956393e+06 7.005040e+06 1.618136e+07 1.395333e+07 1.689834e+07 9.230555e+06 9.663473e+06 1.485452e+07 1.482665e+07 9.161068e+06 1.135333e+07 1.182376e+07 1.111399e+07 C42 H83 N3 O7_4.968 3.462134e+06 3.484494e+06 3.280490e+06 3.480765e+06 1.176457e+05 2.041888e+06 2.815791e+06 3.127806e+06 121167.23 3.337789e+06 2.937089e+06 2.756563e+06 106119.52 3.287570e+06 3.460399e+06 2.807841e+06 1.072499e+05 3.095324e+06 3.093559e+06 3.266156e+06 1.141299e+05 3.773978e+06 2.913073e+06 6.109223e+05 26824.555 3.914166e+06 3.527818e+06 3.438812e+06 2.664391e+04 2.960050e+06 3.291734e+06 3.085799e+06 54821.59 3.088216e+06 2.920102e+06 3.166087e+06 7.621518e+04 2.943800e+06 3.058208e+06 2.696245e+06 6.136401e+04 3.286049e+06 3.089608e+06 3.131757e+06 5.272152e+04 3.161510e+06 3.688102e+06 2.458968e+06 3.548241e+06 3.031943e+06 3.608099e+06 3.479105e+06 4.243944e+06 3.829798e+06 1.617061e+06 2.699897e+06 3.912695e+06 3.025633e+06 3.451114e+06 3.366377e+06 3.410834e+06 2.693390e+06 2.762085e+06 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1.310113e+07 4.841710e+06 8.284544e+06 1.932232e+07 7.226059e+06 7.136674e+06 1.561830e+07 4.796171e+06 1.026566e+07 1.062215e+07 6.652149e+06 8.977899e+06 7.633446e+06 8.997627e+06 1.190721e+07 1.460832e+07 1.111329e+07 1.178724e+07 8.763492e+06 8.785984e+05 7.091101e+06 5.559773e+06 7.226175e+06 1.271296e+07 8.477886e+06 5.688393e+06 1.271696e+07 1.391919e+07 1.454518e+07 5.830957e+06 7.281177e+06 2.557781e+06 6.119149e+06 7.224501e+06 7.049275e+06 2.735763e+07 1.208608e+07 1.522789e+07 1.579181e+07 1.668000e+07 1.981588e+07 1.352448e+07 1.444686e+07 1.223695e+07 1.652796e+07 1.651227e+07 3.105656e+06 2.702103e+07 1.087929e+07 7.100790e+06 7.662140e+06 1.084123e+07 6.479159e+06 9.714329e+06 1.069248e+07 7.834899e+06 4.465976e+06 1.079311e+07 1.159839e+07 2.331439e+07 2.045945e+07 1.180435e+07 1.418739e+07 9.768470e+06 1.064947e+07 1.466717e+07 8.327558e+06 8.271359e+06 6.154038e+06 1.314895e+07 1.373832e+07 1.643221e+07 1.053476e+07 4.448758e+07 5.849804e+06 2.085473e+07 2.245666e+07 5.286960e+06 1.829896e+07 2.374732e+07 8.997564e+06 3.553022e+06 1.803555e+07 7.414218e+06 5.113427e+06 1.310902e+07 1.148421e+07 1.552283e+07 2.236382e+07 5.559654e+06 2.226059e+07 1.840239e+07 1.323615e+07 1.261261e+07 4.199815e+06 7.786567e+06 7.786020e+06 1.233252e+07 1.277672e+07 2.969135e+07 1.594702e+07 C41 H81 N2 O5 P_4.993 3.841489e+07 2.850432e+07 2.801535e+07 2.541669e+07 1.368110e+05 1.818566e+07 2.297539e+07 2.716386e+07 137629.55 2.269491e+07 2.632184e+07 2.265030e+07 134820.91 2.541020e+07 2.547926e+07 2.310686e+07 1.113967e+05 2.663024e+07 2.621827e+07 2.680167e+07 1.148575e+05 2.840624e+07 2.539283e+07 8.852150e+06 29594.719 2.644092e+07 3.063944e+07 2.982855e+07 2.982687e+04 2.323392e+07 2.082090e+07 2.578260e+07 66150.80 2.641797e+07 2.468216e+07 2.589855e+07 8.035081e+04 2.387350e+07 2.528257e+07 2.370591e+07 6.440891e+04 2.474499e+07 2.401671e+07 2.749377e+07 5.629955e+04 2.386670e+07 2.894916e+07 2.089680e+07 2.341798e+07 2.506521e+07 2.446090e+07 2.425515e+07 2.922334e+07 2.026483e+07 1.661613e+07 2.066461e+07 2.938603e+07 1.713456e+07 2.562472e+07 2.007779e+07 2.490147e+07 2.575076e+07 2.102990e+07 2.105584e+07 1.878418e+07 2.609836e+07 1.705348e+07 2.350606e+07 1.698323e+07 2.396018e+07 2.289345e+07 2.371726e+07 3.350125e+07 2.155151e+07 2.235217e+07 2.365555e+07 2.625688e+07 2.600644e+07 1.931224e+07 1.862317e+07 3.076412e+07 2.706097e+07 2.326113e+07 1.863336e+07 2.110175e+07 2.077799e+07 2.170570e+07 2.624183e+07 2.607400e+07 2.690067e+07 2.116424e+07 2.315923e+07 2.723041e+07 2.913898e+07 1.994234e+07 1.879013e+07 2.140861e+07 2.235500e+07 2.487898e+07 2.190174e+07 3.325046e+07 3.123812e+07 2.677173e+07 2.291126e+07 2.209923e+07 2.151472e+07 2.490152e+07 2.692203e+07 1.866911e+07 2.150211e+07 2.472666e+07 2.322047e+07 1.729452e+07 2.027531e+07 2.172851e+07 2.855623e+07 2.460451e+07 2.000494e+07 3.260708e+07 2.119919e+07 1.593560e+07 2.004263e+07 1.961412e+07 2.015234e+07 2.296924e+07 2.654579e+07 2.964910e+07 2.568574e+07 2.351609e+07 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1.904727e+07 3.099426e+07 2.872231e+07 2.892091e+07 2.998917e+07 2.402800e+07 2.673834e+07 2.706482e+07 2.757533e+07 2.870562e+07 3.143717e+07 2.541821e+07 3.123167e+07 2.594931e+07 2.895605e+07 2.642705e+07 2.385591e+07 2.511944e+07 2.113929e+07 2.441548e+07 2.546288e+07 2.474887e+07 3.747683e+07 3.069261e+07 2.001080e+07 1.679328e+07 1.844891e+07 3.478540e+07 1.644911e+07 2.836633e+07 1.890407e+07 2.243918e+07 2.935868e+07 3.240249e+07 2.027490e+07 2.810763e+07 2.071002e+07 1.993442e+07 2.575916e+07 3.561283e+07 1.710317e+07 2.765090e+07 1.372894e+07 2.888325e+07 3.240652e+07 2.287045e+07 2.544321e+07 2.633548e+07 2.438854e+07 1.765725e+07 2.460800e+07 1.346532e+07 2.099819e+07 2.263384e+07 1.853167e+07 2.638857e+07 2.324925e+07 2.878627e+07 2.517727e+07 2.222072e+07 3.496707e+07 1.865630e+07 1.832424e+07 2.179873e+07 1.324433e+07 1.910711e+07 2.480072e+07 2.583792e+07 2.597714e+07 2.651651e+07 3.972069e+07 2.417250e+07 2.822308e+07 2.485430e+07 2.826674e+07 2.877726e+07 2.105042e+07 2.184622e+07 2.040198e+07 3.024333e+07 3.152974e+07 3.392164e+07 2.238882e+07 2.485542e+07 2.252786e+07 3.081901e+07 1.647015e+07 2.492116e+07 2.214244e+07 3.674542e+07 2.474887e+07 2.240223e+07 2.848952e+07 3.296177e+07 2.779359e+07 2.401455e+07 1.845739e+07 2.269762e+07 2.361801e+07 2.404096e+07 4.479149e+07 2.876432e+07 2.779667e+07 2.253651e+07 2.946440e+07 1.800219e+07 2.381603e+07 3.722743e+07 N-oleoylsphingosine-1-phosphocholine_4.995 1.016057e+08 6.358629e+07 6.595169e+07 6.350322e+07 2.671498e+05 4.288891e+07 6.264658e+07 6.858450e+07 253558.78 5.481265e+07 6.118036e+07 6.678622e+07 264338.44 5.913397e+07 5.537985e+07 5.890030e+07 2.381808e+05 5.879158e+07 6.008929e+07 6.596932e+07 2.325129e+05 5.643581e+07 6.533862e+07 5.768666e+07 56164.690 6.040965e+07 6.332777e+07 5.655109e+07 6.731145e+04 5.942405e+07 5.589108e+07 7.064188e+07 166133.53 5.826577e+07 5.854766e+07 6.133186e+07 2.021571e+05 5.566268e+07 6.213447e+07 6.520490e+07 1.535848e+05 5.454935e+07 6.322037e+07 6.509954e+07 1.251159e+05 5.695910e+07 5.479547e+07 6.410550e+07 5.546063e+07 6.149031e+07 5.613226e+07 7.412678e+07 6.513795e+07 4.440747e+07 6.520875e+07 5.288180e+07 5.381456e+07 4.579605e+07 7.378721e+07 4.541556e+07 7.556715e+07 5.956532e+07 5.453092e+07 7.732278e+07 5.951274e+07 4.696189e+07 5.404482e+07 5.875141e+07 3.712044e+07 4.027208e+07 7.326877e+07 4.480111e+07 5.925482e+07 5.757851e+07 5.862628e+07 4.516463e+07 4.905799e+07 5.836628e+07 6.709459e+07 6.177993e+07 6.388313e+07 4.888005e+07 6.303832e+07 6.850751e+07 3.645343e+07 6.991420e+07 4.628469e+07 4.957733e+07 5.177078e+07 5.586356e+07 7.662240e+07 6.286765e+07 5.519721e+07 3.821880e+07 6.071404e+07 4.192801e+07 5.552330e+07 4.660451e+07 4.266781e+07 5.538674e+07 6.723145e+07 5.815395e+07 4.664219e+07 6.969662e+07 8.141909e+07 9.593953e+07 4.195076e+07 5.168067e+07 3.716479e+07 4.443795e+07 5.467380e+07 4.843552e+07 6.180079e+07 3.607247e+07 4.361351e+07 6.454007e+07 4.510914e+07 4.085014e+07 7.260222e+07 6.214797e+07 3.704920e+07 6.469672e+07 2.590591e+07 4.782066e+07 4.433440e+07 5.509156e+07 6.780760e+07 5.009634e+07 5.883347e+07 4.605186e+07 4.630830e+07 6.928139e+07 4.382943e+07 5.546310e+07 5.017139e+07 4.155971e+07 5.164013e+07 6.175457e+07 4.910296e+07 5.185164e+07 6.956398e+07 4.836976e+07 5.213626e+07 4.073019e+07 6.380774e+07 7.694615e+07 5.967191e+07 4.690242e+07 4.533507e+07 5.836532e+07 5.598023e+07 3.164785e+07 4.699005e+07 5.221886e+07 4.251464e+07 7.983022e+07 6.963989e+07 6.903201e+07 7.288133e+07 6.121518e+07 6.383002e+07 7.802674e+07 6.258340e+07 6.342356e+07 8.606627e+07 6.311741e+07 7.491305e+07 5.369385e+07 6.623932e+07 7.044955e+07 6.308314e+07 5.981015e+07 4.384373e+07 5.924347e+07 5.575577e+07 5.769221e+07 9.489657e+07 6.479897e+07 4.444255e+07 3.995397e+07 4.364087e+07 8.635526e+07 3.743520e+07 6.263299e+07 4.502584e+07 5.641072e+07 8.237850e+07 7.537956e+07 5.109044e+07 6.400428e+07 5.613394e+07 4.922858e+07 6.661632e+07 8.364281e+07 3.702792e+07 6.498623e+07 3.021636e+07 7.720433e+07 8.987471e+07 4.890648e+07 6.430554e+07 6.068588e+07 5.612434e+07 3.967470e+07 6.084931e+07 2.941655e+07 5.385696e+07 5.660894e+07 4.447317e+07 6.295010e+07 5.741963e+07 6.924956e+07 6.456206e+07 5.798190e+07 7.771313e+07 3.684005e+07 3.996049e+07 5.367241e+07 3.100915e+07 5.207539e+07 5.978699e+07 6.469700e+07 6.354564e+07 6.287390e+07 8.371890e+07 5.528448e+07 7.433483e+07 5.204504e+07 6.041409e+07 6.890726e+07 5.047012e+07 4.889927e+07 5.073077e+07 7.466182e+07 8.515282e+07 8.330460e+07 4.518818e+07 6.332743e+07 5.719942e+07 6.068109e+07 3.884625e+07 6.182605e+07 5.931020e+07 8.703464e+07 5.949959e+07 5.375800e+07 6.873366e+07 1.032283e+08 5.910321e+07 6.035990e+07 4.196453e+07 5.397221e+07 6.270038e+07 5.789792e+07 1.144120e+08 6.793305e+07 6.873557e+07 4.936226e+07 7.445657e+07 3.987316e+07 5.877581e+07 9.046198e+07 C7 H N3 O_5.004 1.343628e+06 1.120780e+06 1.043959e+06 1.071144e+06 9.716730e+04 5.887353e+05 9.575822e+05 1.089152e+06 106298.70 7.168892e+05 9.498573e+05 7.524359e+05 112449.55 1.420502e+06 1.200303e+06 6.804336e+05 1.206955e+05 5.145547e+05 6.943654e+05 1.329422e+06 1.375897e+05 7.645969e+05 3.478473e+05 1.594873e+06 30232.797 1.289272e+06 9.467715e+05 9.638896e+05 3.983619e+04 2.603875e+05 1.012642e+06 3.461095e+05 84818.53 1.306064e+06 6.066547e+05 1.243353e+06 8.122961e+04 9.544700e+05 8.152569e+05 2.185979e+05 6.733670e+04 1.003463e+06 1.207190e+05 1.138317e+06 6.354207e+04 1.055040e+06 6.948430e+05 7.054487e+05 1.434442e+05 1.072307e+06 3.074774e+05 5.223229e+05 1.706323e+05 4.572482e+05 8.188290e+05 2.759156e+06 8.485310e+06 6.694584e+06 2.283277e+06 2.477782e+06 4.141122e+05 2.891492e+05 1.303074e+05 1.658709e+05 5.875162e+05 4.549781e+05 1.785965e+06 1.515289e+05 1.388686e+05 1.815267e+06 8.506263e+05 1.487439e+06 1.470401e+06 5.543537e+05 2.229221e+06 2.266187e+06 6.409402e+05 3.688015e+06 1.317317e+06 2.363912e+05 1.363049e+06 2.721456e+05 8.694976e+05 3.216502e+05 1.520679e+06 8.617023e+05 6.986632e+05 3.927904e+05 7.617678e+05 1.021487e+06 2.221753e+05 4.979137e+05 2.039986e+06 6.860657e+05 1.417756e+06 1.213564e+06 7.658846e+05 2.332302e+06 9.897998e+05 4.921130e+05 1.890247e+05 1.686891e+05 1.432692e+05 4.504605e+05 1.367567e+05 2.632584e+05 5.639758e+05 2.943937e+05 1.468238e+06 2.874761e+05 6.079431e+05 3.722982e+06 5.214414e+05 1.263116e+06 5.979975e+05 8.399906e+05 1.627972e+06 1.453338e+06 1.606515e+05 5.176777e+06 1.516208e+05 6.867651e+05 7.021905e+05 1.061329e+06 2.363626e+05 1.183871e+05 1.308728e+05 1.904852e+05 1.067986e+06 9.272670e+05 2.975257e+06 1.035439e+06 9.477979e+05 1.644782e+06 4.830517e+05 5.075414e+05 1.397597e+06 1.071132e+06 6.850842e+05 8.975051e+05 1.657975e+05 2.019578e+06 2.837147e+05 2.202429e+05 6.994186e+05 1.190425e+06 1.099221e+05 1.607305e+05 7.900964e+05 6.908005e+05 1.344010e+06 4.580706e+05 1.380915e+06 9.726088e+05 1.190244e+06 6.443632e+05 5.382819e+05 2.222302e+05 4.430012e+05 1.882563e+06 7.286912e+05 6.846738e+05 1.234670e+06 2.093672e+06 7.372989e+05 2.890181e+05 1.245917e+06 2.661214e+05 8.645085e+05 3.592972e+05 9.689711e+05 8.605490e+05 2.402898e+06 2.481213e+06 6.697987e+05 5.699483e+05 9.152049e+05 7.039694e+05 1.355196e+06 8.377265e+05 4.704346e+05 1.336969e+06 1.976190e+06 9.215600e+05 5.866331e+05 1.035812e+06 1.177790e+06 9.934633e+05 1.061658e+05 1.266485e+05 1.488876e+06 8.010946e+05 2.053141e+06 2.698184e+05 2.370687e+05 7.331090e+05 6.545730e+05 1.010026e+06 1.801883e+05 1.036630e+06 4.431290e+05 2.387244e+06 1.753736e+06 1.700337e+06 1.426267e+06 5.933510e+05 1.993374e+06 1.361846e+06 6.248493e+05 2.128224e+05 1.382972e+05 2.971529e+05 1.244561e+06 1.911500e+06 5.781857e+06 1.205234e+06 5.664835e+05 4.664727e+05 9.187538e+05 1.685803e+06 1.190570e+06 1.153265e+06 4.400968e+05 6.956033e+05 1.046712e+06 5.211813e+05 9.706805e+05 1.923478e+05 4.241975e+06 5.666563e+05 1.001021e+06 1.636706e+05 1.073276e+06 1.159394e+06 2.257932e+05 6.344881e+05 1.496311e+06 5.808525e+05 5.857638e+05 9.335264e+05 9.460428e+05 4.951578e+05 1.239422e+06 2.690401e+06 5.415527e+05 4.792762e+05 3.013511e+06 4.938143e+05 1.017070e+06 5.463137e+05 1.619330e+06 2.927091e+05 1.668620e+06 7.965801e+05 7.792587e+05 7.613067e+05 1.221401e+05 4.059378e+05 1.125365e+06 1.055704e+06 1.760332e+05 7.601274e+05 1488.08773_5.008 3.291027e+06 1.935604e+06 1.997456e+06 1.743415e+06 7.942739e+04 1.203292e+06 1.678168e+06 2.175328e+06 84913.51 1.582991e+06 1.440214e+06 1.791671e+06 94934.70 2.129028e+06 1.616073e+06 1.218072e+06 7.944272e+04 1.928271e+06 1.766445e+06 1.731875e+06 7.952924e+04 2.134793e+06 2.104655e+06 3.834750e+05 19244.754 2.314953e+06 1.957889e+06 1.745026e+06 2.124050e+04 1.809809e+06 1.783325e+06 1.885977e+06 52908.70 1.306972e+06 1.798013e+06 2.027381e+06 5.725092e+04 1.601642e+06 1.788090e+06 1.496324e+06 5.096332e+04 1.893323e+06 1.797431e+06 1.654281e+06 4.322216e+04 1.917390e+06 1.574335e+06 1.804434e+06 1.595812e+06 2.019401e+06 1.878112e+06 1.944315e+06 2.048672e+06 1.983948e+06 1.013993e+06 1.596108e+06 2.067150e+06 1.230139e+06 1.524179e+06 1.389877e+06 1.623548e+06 2.220001e+06 1.355270e+06 1.542177e+06 2.271068e+06 1.946834e+06 1.369274e+06 1.997276e+06 1.352914e+06 1.647199e+06 1.320852e+06 1.880690e+06 2.039980e+06 1.878530e+06 1.601230e+06 1.569610e+06 1.947838e+06 1.595054e+06 1.307043e+06 1.446959e+06 1.634234e+06 1.744354e+06 2.269092e+06 1.683203e+06 1.276411e+06 1.426654e+06 1.319150e+06 1.906315e+06 1.565089e+06 1.448927e+06 1.277844e+06 2.067273e+06 1.810991e+06 2.032510e+06 1.402954e+06 1.411042e+06 1.928644e+06 1.576980e+06 1.554298e+06 1.433482e+06 2.149752e+06 2.090449e+06 1.640162e+06 1.816991e+06 2.221021e+06 1.181657e+06 2.358503e+06 2.015211e+06 1.668962e+06 1.853158e+06 2.037072e+06 1.124058e+06 1.333778e+06 1.464037e+06 1.613421e+06 1.869875e+06 1.388529e+06 1.566037e+06 2.313792e+06 1.794623e+06 1.351203e+06 1.746180e+06 1.283971e+06 1.447848e+06 1.369502e+06 2.216625e+06 2.168256e+06 2.193974e+06 1.286554e+06 1.414663e+06 1.800301e+06 1.985972e+06 2.008782e+06 1.643110e+06 1.734799e+06 1.430755e+06 1.342973e+06 1.767237e+06 1.928096e+06 1.413833e+06 1.717680e+06 1.464482e+06 1.685608e+06 1.440995e+06 2.451393e+06 1.850371e+06 1.618028e+06 1.663148e+06 1.118539e+06 2.001101e+06 1.862407e+06 1.399816e+06 1.352165e+06 1.903714e+06 1.486014e+06 2.958286e+06 1.730773e+06 2.668098e+06 1.730185e+06 1.843687e+06 2.539369e+06 1.464796e+06 1.880871e+06 2.175924e+06 1.780440e+06 1.729003e+06 2.068148e+06 1.590145e+06 1.543844e+06 9.878894e+05 1.830678e+06 1.138948e+06 1.573346e+06 1.641237e+06 1.724401e+06 1.797563e+06 2.030039e+06 1.541741e+06 1.366355e+06 1.268216e+06 6.601535e+05 1.947230e+06 1.421695e+06 1.409648e+06 1.295367e+06 1.465445e+06 1.481980e+06 2.107849e+06 1.674742e+06 2.455737e+06 2.246960e+06 1.483209e+06 1.850875e+06 1.632853e+06 7.595778e+05 2.144009e+06 8.024707e+05 1.417444e+06 2.532758e+06 1.419764e+06 1.962676e+06 1.088898e+06 1.535860e+06 1.221917e+06 2.355950e+06 1.538990e+06 1.526206e+06 2.005434e+06 1.316768e+06 1.675049e+06 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8.768966e+07 8.214990e+07 6.642856e+07 7.936455e+07 6.438296e+07 1.422874e+08 4.954091e+07 8.146526e+07 8.080634e+07 6.206889e+07 9.482385e+07 4.967274e+07 1.952992e+08 7.532780e+07 5.901969e+07 6.559481e+07 9.567662e+07 7.461125e+07 6.539166e+07 5.790901e+07 7.998841e+07 7.181494e+07 9.117467e+07 6.104550e+07 1.233730e+08 7.481401e+07 2.741613e+08 8.818870e+07 7.427973e+07 9.990277e+07 2.160132e+08 8.667885e+07 7.448329e+07 6.525459e+07 8.007646e+07 8.638109e+07 7.497960e+07 6.920374e+07 7.284307e+07 7.859980e+07 9.923554e+07 1.184105e+08 8.151829e+07 1.767644e+08 1.023662e+08 1.814674e+08 8.764758e+07 1.428182e+08 9.916905e+07 7.950547e+07 C73 H151 N8 O14 P S2_5.037 5.236001e+07 1.956900e+07 2.344879e+07 2.964700e+07 1.305914e+05 1.495010e+07 2.155563e+07 2.666888e+07 119579.45 2.263876e+07 1.954542e+07 2.721048e+07 108010.72 2.174333e+07 2.011424e+07 2.232027e+07 1.190408e+05 2.250267e+07 2.240828e+07 2.279502e+07 1.272999e+05 2.319461e+07 2.635079e+07 1.116009e+07 21860.514 2.447490e+07 2.607665e+07 2.331702e+07 3.481018e+04 2.206262e+07 2.366987e+07 2.424085e+07 78530.11 2.060673e+07 2.227174e+07 2.318966e+07 8.420331e+04 1.778843e+07 2.500376e+07 2.380500e+07 7.093022e+04 2.119747e+07 2.103358e+07 2.628543e+07 7.563207e+04 2.271829e+07 2.293300e+07 1.979814e+07 2.105229e+07 2.264413e+07 3.041796e+07 2.080167e+07 1.858181e+07 2.332725e+07 1.769801e+07 3.186799e+07 2.748547e+07 2.222417e+07 2.190847e+07 2.536483e+07 2.057965e+07 2.733903e+07 2.606031e+07 2.713600e+07 1.840385e+07 2.542573e+07 1.925104e+07 2.456547e+07 1.990353e+07 2.790461e+07 2.418391e+07 2.814154e+07 3.792224e+07 2.187200e+07 2.207920e+07 2.080036e+07 1.765767e+07 2.557635e+07 1.796556e+07 1.886133e+07 1.238955e+07 1.970764e+07 1.483889e+07 2.437838e+07 2.128267e+07 1.828610e+07 2.224220e+07 2.467222e+07 2.180322e+07 2.056071e+07 1.836917e+07 1.748354e+07 2.019434e+07 2.609727e+07 2.126195e+07 1.849837e+07 2.806612e+07 1.919772e+07 2.485146e+07 1.937687e+07 2.054448e+07 2.245910e+07 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1.548210e+07 1.310586e+07 1.313018e+07 1.904769e+07 1.507671e+07 1.306236e+07 1.025836e+07 7.492463e+06 1.594506e+07 1.083979e+07 1.455530e+07 8.939506e+06 1.443225e+07 1.602713e+07 1.114549e+07 1.200323e+07 1.097416e+07 1.254278e+07 1.370642e+07 1.092097e+07 1.686623e+07 6.675076e+06 1.633997e+07 1.106982e+07 1.693877e+07 1.497084e+07 1.162027e+07 1.575421e+07 1.096081e+07 1.596175e+07 1.081420e+07 1.177795e+07 8.538027e+06 1.257610e+07 1.313730e+07 8.747564e+06 1.043623e+07 1.464244e+07 1.503445e+07 1.707922e+07 1.578582e+07 1.439385e+07 1.318063e+07 1.103432e+07 1.369081e+07 5.788159e+06 1.031475e+07 1.307099e+07 1.538450e+07 1.417558e+07 1.134911e+07 1.656505e+07 1.121996e+07 1.419120e+07 1.247006e+07 1.583255e+07 1.871650e+07 1.218066e+07 1.108603e+07 1.256571e+07 1.454950e+07 1.577809e+07 1.602584e+07 1.408633e+07 1.733931e+07 1.348453e+07 1.394614e+07 1.356871e+07 1.574300e+07 1.367260e+07 1.689876e+07 1.403456e+07 1.031288e+07 1.597326e+07 1.633298e+07 1.658975e+07 1.392345e+07 1.348277e+07 1.515163e+07 1.209523e+07 1.445183e+07 2.332171e+07 1.498206e+07 1.300495e+07 1.024935e+07 1.565791e+07 1.316369e+07 1.442234e+07 1.772271e+07 C73 H145 N9 O15 P2 S2_5.041 4.331606e+06 2.814188e+06 3.393253e+06 3.209209e+06 1.260236e+05 1.601065e+06 2.641939e+06 2.684170e+06 135674.75 2.684683e+06 2.664087e+06 2.506886e+06 113791.04 2.594590e+06 3.716738e+06 2.219834e+06 1.095859e+05 2.619434e+06 3.261655e+06 2.514220e+06 1.180939e+05 2.784077e+06 2.815144e+06 2.103505e+06 21850.335 2.983076e+06 2.718499e+06 2.861369e+06 3.705811e+04 2.757638e+06 2.841035e+06 2.399445e+06 77664.94 2.714012e+06 2.821612e+06 2.464094e+06 7.449378e+04 2.896927e+06 2.887845e+06 3.614063e+06 6.860058e+04 2.503878e+06 2.285067e+06 2.224836e+06 9.045300e+04 2.808112e+06 2.999324e+06 2.744150e+06 2.280072e+06 3.216348e+06 3.346776e+06 2.204242e+06 2.151088e+06 2.539208e+06 1.783509e+06 3.161388e+06 3.445746e+06 2.079966e+06 1.517589e+06 2.198274e+06 2.093266e+06 1.917321e+06 2.371988e+06 2.852474e+06 1.971475e+06 3.561426e+06 1.846032e+06 2.844810e+06 2.737728e+06 3.809504e+06 2.598489e+06 3.007077e+06 3.087953e+06 2.084881e+06 1.645024e+06 3.200146e+06 2.085648e+06 3.050752e+06 2.066085e+06 2.719685e+06 2.028859e+06 2.125470e+06 2.675746e+06 2.163169e+06 3.043557e+06 2.672122e+06 3.457774e+06 2.902325e+06 2.864336e+06 2.883021e+06 1.908047e+06 1.979639e+06 3.261425e+06 2.936553e+06 2.499403e+06 2.262152e+06 2.907108e+06 2.651797e+06 2.334999e+06 2.622042e+06 2.217053e+06 2.385222e+06 3.426090e+06 2.939757e+06 2.660144e+06 2.909550e+06 2.993907e+06 3.617341e+06 3.674290e+06 4.777865e+06 2.887003e+06 3.367864e+06 2.304011e+06 2.625338e+06 2.605204e+06 3.595453e+06 3.164052e+06 3.010253e+06 3.396865e+06 1.358109e+06 2.916198e+06 2.723591e+06 3.687332e+06 2.865712e+06 2.502006e+06 3.017967e+06 3.730040e+06 3.296638e+06 2.088375e+06 2.176793e+06 2.866734e+06 2.703597e+06 3.495380e+06 2.464703e+06 2.716288e+06 1.949357e+06 2.022572e+06 3.130577e+06 2.872524e+06 2.733338e+06 1.761247e+06 2.852024e+06 2.194339e+06 3.303535e+06 3.865384e+06 2.361526e+06 2.226357e+06 3.370977e+06 3.043144e+06 2.347113e+06 1.958620e+06 4.006248e+06 1.980899e+06 2.522690e+06 3.124179e+06 2.817078e+06 2.708144e+06 3.565937e+06 2.327749e+06 2.251546e+06 3.281235e+06 1.720144e+06 3.023122e+06 2.380912e+06 9.405494e+05 2.641943e+06 2.363348e+06 1.670578e+06 2.043464e+06 1.900926e+06 2.887418e+06 2.651603e+06 1.897916e+06 1.972470e+06 3.174892e+06 2.139345e+06 2.645213e+06 2.283615e+06 2.035045e+06 2.252394e+06 1.229757e+06 2.758304e+06 2.852519e+06 1.558365e+06 2.444630e+06 2.476512e+06 2.878076e+06 2.090965e+06 3.649423e+06 2.914009e+06 3.174438e+06 1.847347e+06 2.565883e+06 2.285123e+06 1.415024e+06 2.793271e+06 2.896579e+06 2.061821e+06 1.829332e+06 2.336938e+06 1.582815e+06 1.692863e+06 2.896891e+06 2.231228e+06 2.793087e+06 2.309688e+06 2.742282e+06 4.974802e+06 3.096154e+06 2.396561e+06 1.976733e+06 3.168204e+06 2.526881e+06 2.402629e+06 2.253687e+06 1.997802e+06 3.494029e+06 2.201964e+06 2.093739e+06 2.435295e+06 2.146087e+06 2.917699e+06 2.379181e+06 2.721241e+06 2.093738e+06 2.710320e+06 2.251225e+06 2.596535e+06 2.447317e+06 2.959374e+06 2.165430e+06 2.789665e+06 3.158809e+06 1.728943e+06 2.620134e+06 1.875460e+06 3.774067e+06 2.722789e+06 3.223520e+06 3.213431e+06 3.076791e+06 3.294206e+06 2.681352e+06 2.378255e+06 2.208954e+06 2.795558e+06 2.270705e+06 1.731200e+06 1.729611e+06 1.502333e+06 2.289095e+06 2.619246e+06 2.949473e+06 2.886294e+06 2.413592e+06 1.779553e+06 3.144883e+06 2.858665e+06 2.216592e+06 1.809539e+06 3.474044e+06 2.576982e+06 "(9Z,21R,33R,44Z)-24,27,30-Trihydroxy-24,30-dioxido-18,36-dioxo-19,23,25,29,31,35-hexaoxa-24lambda~5~,30lambda~5~-diphosphatripentaconta-9,44-diene-21,33-diyl (9Z,9'Z)bis(-9-octadecenoate)_5.042" 1.556855e+07 7.089094e+06 7.372252e+06 8.276982e+06 1.187361e+05 5.149066e+06 5.285332e+06 7.951140e+06 104335.79 7.846357e+06 6.017148e+06 1.019328e+07 93515.52 5.600385e+06 5.824497e+06 6.472901e+06 1.061470e+05 7.889993e+06 8.719865e+06 4.170463e+06 1.220312e+05 6.463568e+06 6.852433e+06 7.736790e+06 19490.435 7.761727e+06 6.890604e+06 7.198708e+06 3.305439e+04 6.905315e+06 6.267382e+06 6.620063e+06 73429.86 6.919185e+06 8.799787e+06 6.007637e+06 7.983286e+04 7.714127e+06 5.520704e+06 7.583625e+06 7.259150e+04 7.133477e+06 7.131293e+06 6.704069e+06 7.529233e+04 7.090412e+06 6.501198e+06 7.439983e+06 8.172726e+06 6.017127e+06 5.645375e+06 8.283158e+06 5.703241e+06 5.367568e+06 7.310926e+06 8.133351e+06 8.392709e+06 8.054660e+06 1.008536e+07 7.111612e+06 5.893236e+06 7.495317e+06 7.925490e+06 1.095034e+07 7.012318e+06 4.197660e+06 7.758280e+06 5.492309e+06 6.326771e+06 5.667793e+06 7.498365e+06 7.776841e+06 8.543750e+06 8.725842e+06 8.450703e+06 5.193027e+06 5.683649e+06 9.802639e+06 8.158690e+06 5.580321e+06 4.671581e+06 6.443423e+06 5.442326e+06 5.082276e+06 6.057977e+06 7.712985e+06 6.473904e+06 6.830634e+06 8.471912e+06 7.398858e+06 8.693774e+06 6.517945e+06 5.891591e+06 7.354191e+06 7.111830e+06 5.481462e+06 5.877495e+06 5.619028e+06 4.709820e+06 4.586877e+06 4.641474e+06 5.376170e+06 4.714861e+06 5.987265e+06 8.246817e+06 1.056104e+07 5.589649e+06 8.266553e+06 3.435559e+06 5.276946e+06 5.092428e+06 7.267323e+06 6.596104e+06 7.429832e+06 4.552450e+06 9.789392e+06 6.200975e+06 3.684707e+06 7.084027e+06 7.745570e+06 6.233159e+06 6.520370e+06 3.933021e+06 6.223946e+06 3.463796e+06 5.291693e+06 5.449389e+06 6.463131e+06 7.154873e+06 5.316597e+06 7.309334e+06 1.248439e+07 5.849915e+06 6.420569e+06 5.274612e+06 4.929770e+06 6.487406e+06 6.362700e+06 6.873698e+06 7.813510e+06 7.886296e+06 8.242149e+06 6.156399e+06 4.573240e+06 6.307983e+06 5.914576e+06 4.594660e+06 7.443748e+06 3.745682e+06 4.303471e+06 5.391807e+06 3.402268e+06 5.299966e+06 5.968729e+06 4.647054e+06 7.005577e+06 6.249851e+06 3.414240e+06 6.851583e+06 5.691131e+06 5.108180e+06 9.304638e+06 7.561326e+06 6.875791e+06 9.625593e+06 7.119051e+06 8.310959e+06 7.915285e+06 8.036948e+06 1.068217e+07 5.180686e+06 7.318167e+06 5.351102e+06 6.902926e+06 7.375516e+06 5.924958e+06 9.636798e+06 6.019642e+06 4.549952e+06 4.788138e+06 3.926951e+06 7.704496e+06 6.882784e+06 5.073019e+06 5.810536e+06 6.576192e+06 9.960489e+06 5.678745e+06 6.016061e+06 6.328806e+06 6.243527e+06 5.712573e+06 6.314550e+06 8.065863e+06 3.128200e+06 4.473111e+06 6.224085e+06 5.466874e+06 6.461229e+06 6.193840e+06 6.428762e+06 5.660654e+06 7.921325e+06 5.203916e+06 7.574775e+06 4.559687e+06 6.416309e+06 7.120098e+06 6.263555e+06 5.381462e+06 6.979950e+06 8.606954e+06 1.110846e+07 5.347260e+06 7.363527e+06 7.694491e+06 7.040789e+06 8.126271e+06 4.861222e+06 6.046707e+06 5.133243e+06 6.377747e+06 6.841255e+06 6.465413e+06 8.231052e+06 4.395199e+06 8.183504e+06 5.761559e+06 8.830496e+06 5.273214e+06 6.785510e+06 6.491416e+06 5.616693e+06 8.730510e+06 7.059810e+06 8.360626e+06 5.738337e+06 8.893451e+06 6.271127e+06 8.025430e+06 6.427596e+06 5.326027e+06 6.907792e+06 4.911374e+06 7.070056e+06 5.940971e+06 5.786483e+06 8.443872e+06 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4.764388e+06 1.920007e+05 3.908415e+06 4.891256e+06 5.309607e+06 189317.68 4.457345e+06 6.388568e+06 4.514327e+06 197065.21 4.980826e+06 4.370204e+06 4.963242e+06 1.993176e+05 4.416081e+06 5.582421e+06 5.425187e+06 1.963625e+05 5.316165e+06 5.506048e+06 3.931515e+06 33035.387 3.164623e+06 6.274902e+06 5.872499e+06 5.155317e+04 4.830876e+06 4.355577e+06 4.252351e+06 102576.45 5.547296e+06 5.193679e+06 5.218656e+06 1.095014e+05 4.681640e+06 5.404274e+06 4.818149e+06 1.006083e+05 5.260214e+06 4.365064e+06 5.376148e+06 1.261955e+05 4.940457e+06 4.308572e+06 5.457155e+06 4.164383e+06 6.916664e+06 5.070934e+06 3.869840e+06 3.816160e+06 4.286348e+06 4.463654e+06 4.843083e+06 4.286296e+06 4.306412e+06 3.462930e+06 4.294486e+06 3.899279e+06 5.610887e+06 6.287962e+06 5.062054e+06 4.716198e+06 4.663003e+06 4.844853e+06 2.779432e+06 7.580841e+06 5.555605e+06 4.554898e+06 5.968478e+06 5.616519e+06 4.850864e+06 5.608311e+06 5.065274e+06 5.356977e+06 4.458449e+06 4.644183e+06 4.874627e+06 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5.870965e+06 6.228605e+06 5.091694e+06 4.668811e+06 3.109118e+06 5.620584e+06 4.902282e+06 3.717004e+06 4.803799e+06 3.031249e+06 3.650011e+06 3.924477e+06 4.859938e+06 5.813219e+06 4.890636e+06 4.591702e+06 5.203368e+06 5.318278e+06 3.919809e+06 5.196049e+06 3.577961e+06 6.113440e+06 4.131936e+06 2.209811e+06 4.593092e+06 5.931203e+06 3.069751e+06 6.269577e+06 2.748227e+06 5.688748e+06 4.746693e+06 4.934656e+06 5.158850e+06 5.447098e+06 3.620245e+06 3.500847e+06 4.197483e+06 3.036882e+06 5.252773e+06 4.047497e+06 2.844788e+06 4.302510e+06 4.938084e+06 4.047259e+06 3.988860e+06 3.634692e+06 5.272864e+06 5.942907e+06 3.045245e+06 5.352876e+06 6.404735e+06 3.186274e+06 3.505419e+06 4.408893e+06 5.489563e+06 4.962400e+06 5.418374e+06 3.769874e+06 4.311868e+06 4.292584e+06 4.306011e+06 4.286955e+06 5.981934e+06 3.790933e+06 4.547929e+06 5.495892e+06 4.442769e+06 5.352178e+06 4.620423e+06 3.648711e+06 4.648843e+06 4.976300e+06 5.972183e+06 4.741729e+06 5.935528e+06 4.432593e+06 4.237412e+06 5.327261e+06 4.690343e+06 5.870848e+06 3.924830e+06 5.445279e+06 5.642153e+06 6.050223e+06 5.200899e+06 4.514226e+06 4.634807e+06 5.496937e+06 4.712673e+06 3.517832e+06 3.823233e+06 4.116060e+06 3.444176e+06 4.645444e+06 4.581111e+06 5.505606e+06 4.424146e+06 4.177092e+06 3.912277e+06 6.172446e+06 4.005233e+06 4.752720e+06 5.387110e+06 8.529412e+06 4.996895e+06 "2-Aminoethyl (2S,3R,4E)-2-(docosanoylamino)-3-hydroxy-4-tetradecen-1-yl hydrogen phosphate_5.056" 3.930498e+07 2.258224e+07 2.389669e+07 2.088313e+07 2.544526e+05 1.206853e+07 2.084269e+07 2.209062e+07 256111.66 2.089008e+07 2.030112e+07 2.177595e+07 253039.30 2.121184e+07 1.804912e+07 2.118378e+07 2.554619e+05 1.901352e+07 2.051672e+07 2.279554e+07 2.559380e+05 1.833372e+07 2.253068e+07 1.715235e+07 43167.830 2.136906e+07 2.130118e+07 2.104559e+07 7.930487e+04 1.973039e+07 2.168353e+07 1.977487e+07 180705.82 1.890598e+07 2.299647e+07 1.884493e+07 2.018433e+05 1.965025e+07 2.112222e+07 1.943473e+07 1.615844e+05 1.926026e+07 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2.515090e+07 1.068135e+07 1.278240e+07 9.854740e+06 2.063015e+07 1.653613e+07 1.634758e+07 2.086798e+07 2.007259e+07 1.734488e+07 1.404221e+07 1.973431e+07 2.078097e+07 1.459469e+07 1.278466e+07 1.554979e+07 2.313373e+07 1.520561e+07 1.808015e+07 1.581232e+07 1.730374e+07 1.377915e+07 2.105300e+07 2.314845e+07 1.753461e+07 2.605065e+07 2.665011e+07 1.652470e+07 2.280482e+07 1.780350e+07 2.244485e+07 2.078549e+07 1.575621e+07 2.195292e+07 2.134425e+07 1.575025e+07 3.489029e+07 2.390646e+07 1.976288e+07 1.626817e+07 1.511186e+07 1.461938e+07 1.942691e+07 1.742954e+07 2.118981e+07 1.750531e+07 2.085790e+07 2.780682e+07 2.101589e+07 1.459552e+07 1.549788e+07 1.914460e+07 1.774528e+07 2.318288e+07 1.740607e+07 2.295519e+07 1.923270e+07 2.729442e+07 1.668674e+07 1.164748e+07 1.811962e+07 1.144526e+07 2.238281e+07 1.541392e+07 1.839132e+07 1.428540e+07 1.721194e+07 2.219385e+07 2.254498e+07 1.682601e+07 1.752496e+07 1.547971e+07 2.926672e+07 2.011804e+07 1.846393e+07 1.082435e+07 1.769077e+07 1.730317e+07 2.452875e+07 2.436968e+07 1.767625e+07 1.465776e+07 1.271385e+07 3.099904e+07 1.784123e+07 2.605297e+07 1.949272e+07 1.790827e+07 2.201654e+07 1.221747e+07 2.194315e+07 2.440806e+07 1.956046e+07 2.441650e+07 2.325195e+07 1.777100e+07 1.983410e+07 1.532451e+07 1.505141e+07 1.216012e+07 1.733062e+07 3.077054e+07 1.965532e+07 1.878174e+07 1.966855e+07 1.313683e+07 1.428852e+07 2.550634e+07 1.953159e+07 2.711866e+07 3.307236e+07 1.131064e+07 1.336732e+07 1.450960e+07 2.613748e+07 1.883131e+07 2.337554e+07 2.781722e+07 2.442608e+07 2.285260e+07 2.205801e+07 1.829644e+07 2.568059e+07 2.126102e+07 3.276632e+07 2.297344e+07 1.988354e+07 1.774546e+07 2.820481e+07 2.423945e+07 2.461713e+07 1.562201e+07 1.896693e+07 2.362688e+07 3.001412e+07 3.463322e+07 2.485461e+07 2.786615e+07 2.092843e+07 2.078697e+07 2.500187e+07 2.327920e+07 1.774814e+07 C33 H69 N9 O5_5.059 1.054735e+07 5.918665e+06 6.189226e+06 5.597457e+06 1.246815e+05 3.853657e+06 4.972174e+06 6.883913e+06 122099.86 5.686668e+06 5.591338e+06 6.067707e+06 122183.65 5.023296e+06 4.847080e+06 5.800050e+06 1.232641e+05 5.205218e+06 5.880953e+06 5.721263e+06 1.227656e+05 5.187182e+06 5.898617e+06 4.867176e+06 20280.509 5.737518e+06 5.886303e+06 5.768596e+06 3.659577e+04 5.297274e+06 5.163617e+06 5.976460e+06 81467.02 5.485787e+06 5.908308e+06 5.715896e+06 9.233978e+04 4.495189e+06 5.439197e+06 6.035315e+06 7.454624e+04 5.360237e+06 5.671870e+06 6.116271e+06 7.673472e+04 5.033178e+06 5.645089e+06 5.389909e+06 5.320695e+06 5.346240e+06 5.477217e+06 5.796142e+06 5.756202e+06 5.237432e+06 5.379475e+06 5.809211e+06 4.858255e+06 7.182476e+06 8.550147e+06 3.999524e+06 7.573070e+06 5.972656e+06 6.461306e+06 5.975417e+06 5.491771e+06 4.579953e+06 3.986881e+06 5.749139e+06 3.285907e+06 5.489081e+06 4.500866e+06 6.859388e+06 7.660152e+06 4.101668e+06 4.850375e+06 4.067488e+06 6.875434e+06 5.664003e+06 8.867871e+06 4.558575e+06 5.022949e+06 5.882944e+06 3.851026e+06 5.571114e+06 5.269761e+06 4.289021e+06 7.330202e+06 5.043559e+06 6.707819e+06 4.970656e+06 4.464118e+06 5.640060e+06 5.021552e+06 5.901794e+06 4.631525e+06 2.805726e+06 3.922440e+06 4.811853e+06 5.608801e+06 5.018338e+06 6.336155e+06 6.446873e+06 3.799438e+06 5.049278e+06 4.101247e+06 5.457828e+06 3.911838e+06 4.133438e+06 2.934219e+06 4.778123e+06 6.243979e+06 4.694812e+06 5.948258e+06 4.309624e+06 3.916656e+06 4.542286e+06 4.870992e+06 3.895222e+06 5.499839e+06 6.061306e+06 3.022547e+06 3.800529e+06 4.406881e+06 5.367487e+06 5.567027e+06 4.627565e+06 5.898066e+06 5.149403e+06 4.689665e+06 3.858828e+06 4.822275e+06 5.049547e+06 5.492672e+06 4.063125e+06 4.344481e+06 6.107746e+06 4.828258e+06 4.906795e+06 4.100481e+06 4.139509e+06 4.752822e+06 5.569812e+06 6.086794e+06 4.086962e+06 6.879036e+06 6.897054e+06 4.063415e+06 5.777917e+06 4.592560e+06 6.030184e+06 4.526920e+06 4.550362e+06 6.238997e+06 5.708141e+06 4.638522e+06 7.447009e+06 6.329288e+06 4.841765e+06 4.975141e+06 4.059557e+06 4.002638e+06 5.211043e+06 4.635674e+06 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5.467130e+06 5.901383e+06 5.771157e+06 7.997497e+06 6.195268e+06 5.490242e+06 5.231906e+06 7.205598e+06 6.663984e+06 6.263190e+06 4.643595e+06 5.079292e+06 5.838740e+06 6.466414e+06 9.729431e+06 5.412377e+06 7.370808e+06 6.019470e+06 5.630621e+06 6.275757e+06 6.132224e+06 4.730320e+06 1429.00681_5.065 2.295596e+06 1.218477e+06 1.167679e+06 1.105645e+06 8.960579e+04 4.934743e+05 1.326105e+06 1.157765e+06 93998.98 1.231989e+06 9.766680e+05 1.107794e+06 99875.34 1.020690e+06 1.010974e+06 1.022878e+06 9.516699e+04 8.242176e+05 1.326274e+06 1.139277e+06 7.773805e+04 8.037760e+05 1.217118e+06 1.609706e+06 12964.074 8.238837e+05 8.074970e+05 9.130921e+05 2.641446e+04 1.229142e+06 8.863714e+05 1.254809e+06 56372.85 1.165160e+06 1.040547e+06 1.113801e+06 6.314685e+04 9.255700e+05 1.121796e+06 1.171818e+06 5.412407e+04 9.941910e+05 1.061305e+06 1.181763e+06 5.870510e+04 1.057654e+06 8.426793e+05 1.221397e+06 1.647957e+06 1.087157e+06 7.060457e+05 1.128277e+06 1.486440e+06 7.335655e+05 2.062323e+06 1.592418e+06 8.241711e+05 1.679118e+06 2.614252e+06 9.723392e+05 1.409132e+06 9.320127e+05 1.574361e+06 1.674316e+06 1.392201e+06 7.267196e+05 1.145233e+06 7.868359e+05 4.605633e+05 6.013052e+05 1.139996e+06 9.398963e+05 1.002601e+06 5.818603e+05 1.038677e+06 7.453906e+05 1.334892e+06 1.311907e+06 1.903547e+06 9.217850e+05 1.624435e+06 1.362224e+06 1.108226e+06 1.468802e+06 6.687051e+05 1.079531e+06 1.620483e+06 1.313365e+06 1.355358e+06 9.857979e+05 1.557434e+06 1.027785e+06 7.092778e+05 8.231015e+05 1.037920e+06 3.551315e+05 8.447123e+05 9.238196e+05 7.530992e+05 9.471239e+05 1.037523e+06 1.010999e+06 6.689272e+05 7.633269e+05 4.596270e+05 1.604190e+06 4.284365e+05 6.070856e+05 2.222655e+05 7.626443e+05 5.866130e+05 1.050629e+06 1.303188e+06 3.876454e+05 5.744850e+05 7.699708e+05 7.804535e+05 2.767145e+05 8.333846e+05 1.154176e+06 3.810321e+05 5.065842e+05 2.311680e+05 9.414287e+05 7.431801e+05 8.642284e+05 5.073764e+05 9.619356e+05 1.837371e+06 7.593163e+05 9.495330e+05 1.064864e+06 5.932375e+05 8.188232e+05 9.503473e+05 8.510719e+05 1.294849e+06 9.148863e+05 6.979016e+05 6.895101e+05 9.275744e+05 1.040712e+06 1.308422e+06 6.160034e+05 6.573138e+05 8.248239e+05 6.671640e+05 1.183611e+06 1.196161e+06 6.892081e+05 7.425819e+05 5.302867e+05 8.848536e+05 8.590660e+05 4.583116e+05 1.366853e+06 8.279084e+05 6.049551e+05 1.004466e+06 7.877875e+05 3.801295e+05 1.029900e+06 8.835896e+05 1.358433e+06 1.307492e+06 1.284595e+06 9.666831e+05 1.810948e+06 1.132242e+06 1.610011e+06 9.441657e+05 1.331379e+06 1.126242e+06 1.526581e+06 1.007410e+06 1.122045e+06 1.587056e+06 9.749462e+05 1.249931e+06 7.755839e+05 1.764307e+05 1.684530e+06 7.826854e+05 1.336601e+06 3.848631e+05 8.981854e+05 1.223475e+06 1.026148e+06 6.757169e+05 8.567746e+05 5.723713e+05 1.960541e+06 7.245780e+05 1.045341e+06 8.745191e+04 8.870120e+05 8.735684e+05 1.475018e+06 1.295604e+06 8.852861e+05 1.559584e+06 7.811679e+05 2.472308e+06 9.416157e+05 1.607351e+06 8.631837e+05 8.821331e+05 6.444762e+05 4.108793e+05 9.319871e+05 1.289579e+06 1.321535e+06 1.690789e+06 1.225601e+06 1.616174e+06 1.363408e+06 6.235733e+05 1.041181e+06 3.121495e+05 7.713763e+05 1.102294e+06 8.377380e+05 6.874407e+05 9.660554e+05 1.050588e+06 4.273066e+05 1.197063e+06 7.019024e+05 2.127364e+06 1.984461e+06 9.159062e+05 2.637110e+05 5.768821e+05 1.721519e+06 9.987378e+05 1.277546e+06 1.550893e+06 1.533561e+06 1.195869e+06 1.268535e+06 1.282089e+06 1.029307e+06 1.266500e+06 1.892907e+06 2.545535e+06 8.303566e+05 1.609484e+06 1.416439e+06 1.941444e+06 1.802590e+06 1.246035e+06 1.032422e+06 9.369636e+05 1.471172e+06 2.510543e+06 1.491120e+06 1.287465e+06 5.537938e+05 1.614054e+06 8.723155e+05 9.645802e+05 1.329053e+06 C39 H77 N O10 S2_5.067 2.192717e+07 9.725080e+06 1.183649e+07 1.135791e+07 1.340017e+05 5.728420e+06 8.612074e+06 1.060531e+07 134013.29 1.006679e+07 1.138654e+07 9.693343e+06 129603.42 9.132081e+06 9.865876e+06 9.642082e+06 1.285540e+05 9.281723e+06 9.039598e+06 8.848279e+06 1.228254e+05 1.120172e+07 9.831152e+06 1.014091e+07 19645.209 1.154613e+07 7.510411e+06 9.190538e+06 3.820823e+04 1.095347e+07 9.314048e+06 9.029492e+06 83092.81 1.079366e+07 9.557049e+06 1.019794e+07 9.111685e+04 9.365916e+06 9.722613e+06 1.143882e+07 7.666973e+04 8.498532e+06 9.437636e+06 1.087024e+07 8.395974e+04 9.220302e+06 8.830262e+06 1.041254e+07 8.590455e+06 9.664928e+06 8.618785e+06 9.785296e+06 1.026877e+07 1.220963e+07 1.118774e+07 7.849166e+06 9.320555e+06 9.402930e+06 1.079329e+07 6.945164e+06 1.306956e+07 1.144201e+07 1.201968e+07 8.882809e+06 9.667240e+06 7.652105e+06 6.687073e+06 8.772561e+06 7.422277e+06 1.033655e+07 9.132531e+06 1.258464e+07 1.273380e+07 7.693065e+06 7.017203e+06 7.694829e+06 1.052282e+07 9.904759e+06 1.345778e+07 8.239815e+06 7.371873e+06 1.155855e+07 8.410597e+06 6.906295e+06 9.519854e+06 5.187658e+06 1.490980e+07 1.050270e+07 1.265737e+07 1.043277e+07 9.392907e+06 9.514237e+06 8.671828e+06 1.021537e+07 8.437162e+06 5.743652e+06 6.702292e+06 9.145718e+06 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4.048730e+07 3.979307e+07 5.378935e+07 5.837942e+07 4.518848e+07 4.664341e+07 4.416030e+07 6.983459e+07 4.701534e+07 5.469631e+07 4.863163e+07 4.357990e+07 7.706983e+07 8.883504e+07 3.854120e+07 7.588507e+07 4.347963e+07 5.909848e+07 5.507397e+07 5.149578e+07 3.881680e+07 3.822019e+07 5.140050e+07 2.712174e+07 5.508732e+07 3.554311e+07 6.113356e+07 6.443973e+07 2.869207e+07 5.462051e+07 2.698054e+07 5.766893e+07 5.448462e+07 7.513801e+07 3.379662e+07 5.014829e+07 6.045035e+07 4.038851e+07 4.636592e+07 4.166089e+07 3.579063e+07 6.014399e+07 4.908282e+07 5.996573e+07 4.132191e+07 5.269086e+07 3.790915e+07 5.012936e+07 5.314560e+07 4.436663e+07 2.148561e+07 3.677367e+07 3.276946e+07 3.571987e+07 4.462169e+07 4.796339e+07 6.701561e+07 3.450037e+07 3.876943e+07 3.570228e+07 5.340462e+07 2.577583e+07 3.909859e+07 2.552387e+07 5.074547e+07 5.339920e+07 4.254800e+07 5.739818e+07 3.784694e+07 3.038099e+07 3.648020e+07 4.005018e+07 1.921290e+07 4.418759e+07 6.187882e+07 2.268026e+07 2.624717e+07 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4.333819e+07 4.401986e+07 3.490261e+07 8.698636e+07 4.327572e+07 5.783495e+07 4.728765e+07 3.956750e+07 4.008967e+07 2.752099e+07 5.335357e+07 6.642062e+07 4.834184e+07 6.300502e+07 6.227919e+07 5.412668e+07 5.852542e+07 3.225313e+07 3.048960e+07 2.667875e+07 4.211776e+07 5.159652e+07 3.471375e+07 3.253317e+07 3.681398e+07 3.253931e+07 2.254856e+07 5.800041e+07 2.742968e+07 7.323548e+07 8.476865e+07 4.018701e+07 1.947541e+07 3.365451e+07 6.546517e+07 5.030675e+07 4.054516e+07 7.811156e+07 6.554289e+07 4.914902e+07 5.462245e+07 5.575886e+07 4.307003e+07 6.219327e+07 7.165185e+07 5.794227e+07 4.656680e+07 6.316377e+07 7.442419e+07 5.770299e+07 6.102283e+07 3.971439e+07 4.731849e+07 3.789099e+07 5.782234e+07 8.597360e+07 5.559848e+07 6.177479e+07 4.190412e+07 4.391854e+07 5.329193e+07 5.456732e+07 4.266107e+07 C35 H77 N8 O3 P S3_5.074 7.151784e+06 4.878280e+06 4.797471e+06 4.734725e+06 1.475740e+05 3.358425e+06 4.536352e+06 5.874508e+06 167414.89 4.057547e+06 3.735485e+06 4.141846e+06 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5.540158e+06 3.655650e+06 4.308147e+06 5.316936e+06 4.964451e+06 4.231195e+06 2.417447e+06 3.102746e+06 3.056856e+06 4.811491e+06 4.773942e+06 5.756772e+06 4.355031e+06 4.426703e+06 4.712442e+06 4.257112e+06 4.057529e+06 2.842945e+06 3.687292e+06 3.042667e+06 4.370160e+06 5.259326e+06 4.549720e+06 4.817962e+06 3.469910e+06 2.959007e+06 3.692964e+06 4.036058e+06 3.410480e+06 4.228122e+06 4.887314e+06 2.709995e+06 3.225510e+06 2.981184e+06 4.042640e+06 4.648405e+06 3.856659e+06 4.423576e+06 4.209605e+06 4.053989e+06 3.850909e+06 4.435266e+06 4.428639e+06 3.444679e+06 3.385420e+06 3.756728e+06 5.983767e+06 3.677127e+06 3.691866e+06 6.438722e+06 4.242482e+06 7.360108e+06 4.477515e+06 5.116237e+06 4.854895e+06 5.351460e+06 5.643733e+06 3.958229e+06 4.179792e+06 3.849137e+06 4.808255e+06 4.397708e+06 4.245544e+06 6.329110e+06 5.356339e+06 4.606060e+06 5.532362e+06 5.143038e+06 4.238076e+06 4.602735e+06 3.425843e+06 3.611128e+06 4.524826e+06 5.048621e+06 5.169977e+06 3.541186e+06 3.905994e+06 5.199438e+06 4.513957e+06 2.923342e+06 2.808777e+06 3.941321e+06 4.862569e+06 4.767760e+06 3.226550e+06 4.381856e+06 4.980395e+06 6.028789e+06 4.181610e+06 2.948162e+06 4.254843e+06 2.449242e+06 5.172673e+06 5.362450e+06 5.143450e+06 3.575173e+06 3.810568e+06 5.532970e+06 4.991743e+06 4.706787e+06 4.827820e+06 3.605231e+06 5.966515e+06 4.022276e+06 4.097204e+06 2.701247e+06 4.122587e+06 4.010379e+06 6.493250e+06 4.459132e+06 5.195416e+06 4.057327e+06 3.122677e+06 6.324482e+06 4.322777e+06 5.322213e+06 4.672535e+06 4.366115e+06 4.305932e+06 3.809151e+06 5.785049e+06 4.267722e+06 4.190938e+06 5.065923e+06 4.140273e+06 4.375646e+06 5.506331e+06 4.100011e+06 3.394165e+06 2.683656e+06 4.731343e+06 6.592059e+06 4.407258e+06 4.575210e+06 5.025884e+06 4.002493e+06 3.626854e+06 5.016294e+06 4.991829e+06 6.428183e+06 6.315690e+06 2.831720e+06 3.415567e+06 3.176363e+06 5.200968e+06 5.330334e+06 4.543718e+06 6.208996e+06 4.366822e+06 4.231382e+06 7.378494e+06 4.242920e+06 5.006232e+06 4.479495e+06 9.178777e+06 6.584569e+06 3.436330e+06 4.471352e+06 5.658333e+06 5.869845e+06 4.923742e+06 3.860231e+06 4.142736e+06 4.964486e+06 5.040325e+06 6.340192e+06 4.640622e+06 5.698975e+06 5.177818e+06 4.603891e+06 6.006530e+06 4.675045e+06 4.142952e+06 C32 H73 N10 O P S_5.074 2.325236e+06 1.382059e+06 1.302056e+06 1.372888e+06 7.017682e+04 9.896799e+05 1.134839e+06 1.628368e+06 76223.72 1.212446e+06 1.357447e+06 1.215457e+06 76598.32 1.273659e+06 1.291864e+06 1.294344e+06 7.614399e+04 1.083446e+06 1.321226e+06 1.447735e+06 7.082620e+04 1.166065e+06 1.471614e+06 1.224851e+06 12198.381 1.172413e+06 1.265277e+06 1.277919e+06 2.389286e+04 1.327866e+06 1.090843e+06 1.532177e+06 46783.43 1.240463e+06 1.495571e+06 1.279243e+06 6.466640e+04 9.677508e+05 1.429893e+06 1.153453e+06 5.595184e+04 1.160964e+06 1.292235e+06 1.570007e+06 5.379407e+04 1.251327e+06 1.135360e+06 1.329242e+06 1.382334e+06 1.234483e+06 1.247573e+06 1.427746e+06 1.543370e+06 1.254166e+06 1.502348e+06 1.278573e+06 1.066783e+06 2.042241e+06 2.387151e+06 8.754909e+05 1.723694e+06 1.151738e+06 1.558422e+06 1.544821e+06 1.580641e+06 9.259740e+05 9.909290e+05 1.778464e+06 9.930329e+05 1.397179e+06 9.474642e+05 1.481462e+06 1.357493e+06 9.977462e+05 1.446885e+06 6.894410e+05 1.251470e+06 1.420127e+06 1.855440e+06 1.283249e+06 1.439991e+06 1.452893e+06 9.063162e+05 1.476211e+06 1.243342e+06 1.100636e+06 1.627226e+06 1.149505e+06 1.794590e+06 8.823966e+05 9.800708e+05 1.218334e+06 9.783856e+05 1.285182e+06 1.198713e+06 5.657800e+05 1.061739e+06 1.159079e+06 1.259970e+06 1.234905e+06 1.178279e+06 1.418705e+06 8.982278e+05 1.037006e+06 1.306044e+06 1.184032e+06 8.555070e+05 6.364639e+05 6.067338e+05 1.002919e+06 1.371262e+06 1.159599e+06 1.433975e+06 9.872670e+05 7.909024e+05 1.050518e+06 9.572913e+05 4.753986e+05 1.307100e+06 1.896012e+06 7.099636e+05 7.473751e+05 5.416567e+05 1.474510e+06 1.307462e+06 7.631734e+05 9.731353e+05 9.682444e+05 1.167728e+06 8.327458e+05 1.055948e+06 1.252812e+06 7.901450e+05 9.030512e+05 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2.218148e+06 1.448562e+05 1.243862e+06 1.950212e+06 2.084800e+06 112878.09 1.618068e+06 1.801408e+06 2.078786e+06 123661.79 1.757545e+06 1.707899e+06 2.004010e+06 1.140624e+05 1.535739e+06 2.017175e+06 1.752068e+06 1.147746e+05 1.708933e+06 1.821188e+06 2.222868e+06 17127.477 1.500245e+06 1.882941e+06 1.834500e+06 3.736941e+04 1.735651e+06 1.821286e+06 2.202633e+06 81773.85 1.584091e+06 1.723740e+06 1.985541e+06 1.008875e+05 1.599046e+06 1.764328e+06 2.110022e+06 6.726285e+04 1.619548e+06 2.017857e+06 1.972911e+06 7.070450e+04 1.526385e+06 1.739659e+06 1.938580e+06 2.165665e+06 1.380981e+06 9.452945e+05 2.451712e+06 3.062407e+06 1.825651e+06 2.109925e+06 3.106104e+06 9.387238e+05 3.577422e+06 4.350382e+06 1.294536e+06 2.249504e+06 1.121935e+06 1.799404e+06 1.889887e+06 2.174105e+06 1.299432e+06 1.206223e+06 2.825612e+06 7.429364e+05 1.617356e+06 1.016215e+06 1.589652e+06 2.036334e+06 8.945040e+05 1.783127e+06 7.391202e+05 3.028538e+06 3.002658e+06 2.437767e+06 4.405111e+05 2.057025e+06 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1.279397e+06 2.341326e+06 1.796705e+06 1.952796e+06 1.659828e+06 2.446159e+06 9.754370e+05 3.401241e+06 2.634832e+06 2.363975e+06 2.269080e+06 4.911547e+06 2.733026e+06 2.877215e+06 3.791144e+06 1.718106e+06 1.027561e+06 1.389890e+06 1.742284e+06 4.203613e+06 2.094498e+06 2.148680e+06 1.448440e+06 1.427010e+06 2.153480e+06 1.401771e+06 1.306526e+06 C42 H66 N2 O3_5.114 3.042319e+06 1.772514e+06 2.057971e+06 1.799955e+06 2.287818e+05 1.115605e+06 1.612924e+06 1.810685e+06 184899.06 1.509192e+06 1.858548e+06 2.199871e+06 207512.17 1.538596e+06 1.442986e+06 1.884567e+06 1.953225e+05 1.275277e+06 1.947565e+06 1.758777e+06 1.899177e+05 1.446187e+06 1.691126e+06 2.147081e+06 27815.071 1.473626e+06 1.816757e+06 1.607240e+06 6.361699e+04 1.442576e+06 1.715452e+06 1.900836e+06 138736.59 1.648014e+06 1.880886e+06 1.672999e+06 1.778262e+05 1.525320e+06 1.566470e+06 1.954450e+06 1.183521e+05 1.237635e+06 2.072924e+06 2.042510e+06 1.242919e+05 1.403146e+06 1.508455e+06 1.792395e+06 2.194418e+06 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2.189817e+06 3.970459e+06 1.377961e+06 7.564751e+05 4.549280e+05 7.086975e+05 1.409022e+06 2.445439e+06 1.479060e+06 2.908040e+06 1.890799e+06 1.620036e+06 2.114639e+06 1.553843e+06 1.257915e+06 5.140846e+05 1.189572e+06 2.661894e+06 8.109911e+05 5.899305e+05 8.008802e+05 7.253042e+05 2.452224e+05 2.013752e+06 1.104008e+06 3.604370e+06 3.958072e+06 1.336497e+06 4.243149e+05 7.306045e+05 3.310726e+06 9.185753e+05 1.227993e+06 2.660197e+06 1.753678e+06 2.085783e+06 1.282926e+06 2.042464e+06 7.572119e+05 4.251959e+06 2.304488e+06 2.874291e+06 2.197472e+06 5.156682e+06 2.322335e+06 3.331949e+06 4.071221e+06 2.144333e+06 9.092769e+05 1.295792e+06 1.867982e+06 4.277801e+06 2.161638e+06 2.013520e+06 1.391620e+06 1.288711e+06 2.126468e+06 1.028162e+06 1.477726e+06 C33 H73 N7 O P2 S3_5.118 4.301395e+06 1.791190e+06 2.502038e+06 2.387417e+06 1.461116e+05 1.468488e+06 2.063952e+06 2.230020e+06 109614.58 2.323580e+06 2.221512e+06 2.201639e+06 123216.97 1.857829e+06 2.052554e+06 2.273330e+06 1.132423e+05 1.796804e+06 2.072643e+06 2.175216e+06 1.092790e+05 2.136194e+06 2.236713e+06 2.096964e+06 16145.521 1.872524e+06 2.333857e+06 1.950342e+06 3.468185e+04 2.062556e+06 2.119960e+06 2.233752e+06 73198.09 2.044483e+06 1.756309e+06 2.659273e+06 8.923011e+04 1.923745e+06 2.370002e+06 1.706569e+06 6.529792e+04 1.863371e+06 2.350202e+06 2.383789e+06 7.540619e+04 1.871379e+06 1.972661e+06 2.197899e+06 2.117868e+06 2.212518e+06 1.119807e+06 2.611637e+06 4.003381e+06 2.275274e+06 2.371301e+06 2.749841e+06 1.099238e+06 3.893260e+06 4.250142e+06 1.410271e+06 2.534125e+06 1.710686e+06 2.545845e+06 2.204966e+06 2.807988e+06 1.352169e+06 1.712602e+06 2.495814e+06 7.658566e+05 2.024802e+06 1.420748e+06 1.990701e+06 1.722786e+06 9.053764e+05 2.656716e+06 1.058707e+06 3.585485e+06 3.406069e+06 2.479555e+06 9.538442e+05 2.290395e+06 3.473987e+06 1.698633e+06 3.384876e+06 1.660782e+06 8.995030e+05 2.950077e+06 2.413377e+06 3.140900e+06 2.285787e+06 1.942991e+06 1.921066e+06 1.531582e+06 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2.189298e+06 3.526051e+06 4.915013e+06 2.363553e+06 1.144046e+06 1.784361e+06 1.830545e+06 3.893994e+06 2.656202e+06 2.794816e+06 2.273120e+06 1.718255e+06 2.390159e+06 1.635127e+06 1.886570e+06 C9 H17 N O3_5.164 5.246842e+05 1.356735e+06 1.200708e+06 1.667968e+06 3.616309e+05 1.349543e+06 2.004267e+06 2.216665e+06 170854.27 1.528884e+06 1.666495e+06 2.077033e+06 150718.13 1.327274e+06 1.528720e+06 1.972628e+06 1.683325e+05 9.815426e+05 1.768212e+06 2.482972e+06 1.653510e+05 8.251252e+05 1.816538e+06 2.084084e+06 23131.742 1.158990e+06 1.850702e+06 2.103858e+06 5.542087e+04 9.034988e+05 1.977719e+06 1.741891e+06 93826.89 9.670929e+05 2.575961e+06 2.037633e+06 1.279209e+05 6.674936e+05 1.988303e+06 2.019225e+06 1.018207e+05 8.334137e+05 2.102198e+06 2.352298e+06 1.171407e+05 8.009218e+05 1.701026e+06 1.734084e+06 7.896760e+05 7.482227e+05 8.487072e+05 4.523493e+06 1.044697e+06 1.412818e+06 2.808802e+06 2.915899e+06 1.509586e+06 2.742360e+06 4.301512e+06 1.273341e+06 2.683580e+06 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1.108731e+06 1.722336e+06 1.356121e+06 1.570972e+06 2.327164e+06 1.883336e+06 1.765858e+06 5.149785e+05 3.523102e+05 1.211271e+06 1.743967e+06 8.818367e+05 1.914513e+05 1.119680e+06 1.870945e+06 1.114960e+06 8.483240e+05 1.540954e+06 1.260229e+06 7.779197e+05 1.048858e+06 4.826587e+05 7.619767e+05 1.115472e+06 1.997925e+06 9.586696e+05 9.830320e+05 9.052252e+05 1.573859e+06 1.459175e+06 5.227291e+05 7.770437e+05 1.546045e+06 3.644546e+05 1.424896e+06 9.877435e+05 1.554478e+06 1.246495e+06 2.178146e+06 1.440158e+06 1.334315e+06 7.284922e+05 2.175939e+05 7.985567e+05 8.328622e+05 1.166722e+06 7.612881e+05 2.861333e+05 1.614556e+06 1.733820e+06 1.930624e+06 5.635265e+05 4.332764e+05 1.274878e+06 1.660539e+05 8.890388e+05 1.735115e+05 1.408667e+06 3.044051e+06 1.384845e+06 1.047688e+06 1.043440e+06 2.305384e+06 5.337381e+05 5.113931e+05 1.557489e+06 1.923346e+06 1.171260e+06 1.078874e+06 2.734352e+05 1.231242e+06 2.716881e+05 1.301007e+06 1.112995e+06 7.732306e+05 7.670849e+05 8.225854e+05 1.543073e+06 5.015823e+05 8.085260e+05 1.318921e+06 1.239411e+06 8.648410e+05 1.422341e+06 1.635530e+06 1.078945e+06 8.880588e+05 8.302022e+05 7.901416e+05 9.658654e+05 1.113273e+06 1.761914e+06 1.341147e+06 7.337792e+05 6.266142e+05 1.654820e+06 2.010191e+06 5.003144e+05 2.875559e+06 1.403318e+06 1.103881e+06 1.613207e+06 3.093897e+06 1.275507e+06 6.467948e+05 2.180634e+06 1.055358e+06 5.983441e+05 1.896801e+06 1.790045e+06 2.179487e+06 1.296424e+06 1.074594e+06 2.463874e+06 1.577371e+06 9.133963e+06 2.529775e+06 5.536464e+05 1.670268e+06 1.339836e+06 1.987696e+06 5.768888e+05 1.378278e+06 2.157597e+06 C40 H38 N6_5.182 1.068437e+06 8.843406e+05 5.917058e+05 9.222792e+05 1.274657e+05 5.056490e+05 8.738789e+05 1.033592e+06 91223.56 6.609087e+05 8.083835e+05 8.169760e+05 95448.86 6.149622e+05 7.324027e+05 9.075833e+05 9.674880e+04 6.697872e+05 8.214679e+05 7.657599e+05 9.224483e+04 6.978925e+05 7.732854e+05 9.544009e+05 12518.293 6.952755e+05 7.352509e+05 9.246878e+05 2.904816e+04 5.887636e+05 8.185706e+05 6.954940e+05 54433.97 7.992539e+05 8.808133e+05 8.592017e+05 7.736020e+04 6.277904e+05 6.824378e+05 9.224313e+05 5.954371e+04 6.807579e+05 8.595423e+05 8.529847e+05 6.816528e+04 5.980151e+05 8.203354e+05 7.772687e+05 9.283220e+05 8.822676e+05 2.102089e+05 1.685156e+06 5.011182e+05 7.843860e+05 8.868139e+05 1.618561e+06 9.993508e+05 1.571921e+06 1.494004e+06 6.492464e+05 8.919147e+05 1.933904e+06 1.431934e+06 1.361156e+06 9.014653e+05 4.664105e+05 8.098171e+05 5.267302e+05 8.584339e+05 1.234114e+06 7.945236e+05 1.054126e+06 1.728943e+06 9.157205e+05 1.454386e+06 9.669032e+05 7.711804e+05 1.109125e+06 1.482856e+06 1.085108e+06 2.667414e+05 3.482272e+05 2.885407e+05 7.299472e+05 7.222788e+05 9.659684e+05 1.429759e+06 3.607226e+05 6.496517e+05 7.712697e+05 5.451987e+05 4.828132e+05 7.233280e+05 5.371298e+05 9.001525e+05 6.202097e+05 3.156179e+05 1.298033e+06 3.106410e+05 6.068062e+05 6.241752e+05 5.907021e+05 8.329011e+05 3.272718e+05 6.068797e+05 8.106788e+05 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4.512914e+05 7.489582e+05 7.774284e+05 1.114513e+06 5.785246e+05 1.238731e+06 7.480985e+05 3.716259e+05 1.032142e+06 5.284621e+05 7.649422e+05 1.504094e+05 4.721116e+05 5.463016e+05 6.373321e+05 4.889006e+05 9.655182e+05 4.477823e+05 5.736390e+05 7.994930e+05 7.827961e+05 1.243437e+06 1.025102e+05 4.339246e+05 4.534205e+05 7.913005e+05 1.181529e+06 7.908732e+05 9.441340e+05 6.156120e+05 5.945048e+05 3.172785e+05 5.110766e+05 4.780247e+05 6.547944e+05 3.678831e+05 9.107417e+05 9.058587e+05 9.479716e+05 9.773420e+05 8.367477e+05 1.213721e+06 7.434997e+05 1.116031e+06 8.277275e+05 8.794542e+05 9.811999e+05 2.682009e+05 8.293811e+05 7.587028e+05 7.648564e+05 4.811516e+05 1.082900e+06 1.146098e+06 1.008079e+06 5.179586e+05 8.372526e+05 7.993893e+05 9.614781e+05 7.468010e+05 6.565284e+05 2.975109e+05 5.670922e+05 8.166831e+05 7.926164e+05 5.114269e+05 6.819682e+05 4.516116e+05 7.947526e+05 5.159070e+05 1.285102e+06 9.232675e+05 9.111821e+05 1.065495e+06 9.423072e+05 6.577589e+05 2.569311e+05 8.747642e+05 1.434149e+06 C26 H54 N O6 P_5.19 2.158091e+06 1.273218e+06 1.285822e+06 1.096260e+06 1.516496e+05 6.194837e+05 1.272193e+06 1.410236e+06 136741.14 8.603495e+05 1.236798e+06 1.408605e+06 118092.93 1.095619e+06 9.613597e+05 1.151949e+06 1.291511e+05 7.446638e+05 1.193386e+06 1.199463e+06 1.108351e+05 1.065055e+06 1.250242e+06 1.269940e+06 14241.209 1.076022e+06 1.062983e+06 9.662864e+05 3.388004e+04 1.382395e+06 1.076612e+06 1.189306e+06 69654.00 1.031924e+06 1.192292e+06 1.031018e+06 9.792629e+04 9.606116e+05 1.212249e+06 1.237657e+06 6.167043e+04 8.985258e+05 1.418532e+06 1.348178e+06 7.150175e+04 8.816508e+05 1.004783e+06 1.187510e+06 9.510324e+05 1.250871e+06 5.734497e+05 2.329628e+06 6.959218e+05 1.382535e+06 1.383613e+06 2.159022e+06 1.382467e+06 2.441345e+06 2.329227e+06 9.982018e+05 1.258526e+06 2.629116e+06 1.768811e+06 2.066278e+06 1.319855e+06 6.692794e+05 1.339886e+06 6.137315e+05 1.201935e+06 1.541253e+06 2.341145e+06 1.655418e+06 2.016445e+06 1.102165e+06 1.279256e+06 1.010530e+06 1.267822e+06 1.375116e+06 2.396355e+06 1.505116e+06 5.337712e+05 5.847135e+05 3.427212e+05 1.301532e+06 1.370536e+06 1.030637e+06 1.757514e+06 3.891451e+05 8.085642e+05 7.701661e+05 7.005068e+05 8.324764e+05 5.254620e+05 5.291221e+05 8.826034e+05 1.084364e+06 4.856970e+05 1.511248e+06 6.489316e+05 1.104665e+06 8.665952e+05 8.852581e+05 8.780884e+05 6.107839e+05 9.519641e+05 1.349212e+06 6.042123e+05 5.757789e+05 9.170031e+05 9.641863e+05 8.814084e+05 7.122306e+05 5.507616e+05 1.137283e+06 1.261305e+06 9.345177e+05 7.999980e+05 1.266684e+06 9.582393e+05 1.194058e+06 3.510991e+05 3.567062e+05 3.473938e+05 8.356809e+05 1.044674e+06 9.373765e+05 1.130149e+06 7.300288e+05 9.365854e+05 1.046015e+06 1.401683e+06 2.319247e+06 1.048959e+06 2.058957e+06 1.506575e+06 9.188660e+05 1.396934e+06 1.721637e+06 9.150870e+05 2.481129e+06 1.037289e+06 4.331150e+05 1.687803e+06 6.438921e+05 1.103056e+06 1.214352e+06 5.319976e+05 1.369302e+06 8.435336e+05 4.257666e+05 1.303816e+06 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1.368001e+06 5.114655e+06 C23 H50 N3 O5 P S3_5.249 5.861381e+07 1.821072e+07 2.020606e+07 2.240771e+07 1.692347e+05 1.380065e+07 2.258929e+07 2.542823e+07 123948.19 1.755442e+07 1.888666e+07 2.189008e+07 118729.76 2.088672e+07 1.711387e+07 1.871433e+07 1.204943e+05 2.055161e+07 1.820035e+07 2.053500e+07 1.122230e+05 1.870282e+07 2.276192e+07 2.476783e+07 15935.930 1.558183e+07 2.108745e+07 1.895151e+07 3.410635e+04 1.817207e+07 1.987418e+07 1.912244e+07 80558.88 2.132970e+07 2.158535e+07 1.738518e+07 9.410142e+04 2.054521e+07 2.036768e+07 2.068872e+07 7.208663e+04 1.952011e+07 1.930333e+07 2.240327e+07 8.154917e+04 1.883913e+07 1.845413e+07 2.077335e+07 1.321259e+07 3.004294e+07 1.995593e+07 2.553766e+07 1.525135e+07 2.050305e+07 2.208596e+07 2.554458e+07 3.011463e+07 2.896392e+07 2.869983e+07 1.890917e+07 3.128923e+07 3.183811e+07 2.180061e+07 3.140686e+07 2.375556e+07 1.115089e+07 2.601896e+07 1.534700e+07 1.840410e+07 1.861126e+07 2.209300e+07 2.477032e+07 2.764698e+07 2.785661e+07 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2.031049e+07 1.372326e+07 1.807255e+07 1.614168e+07 1.462362e+07 2.249411e+07 1.739545e+07 2.672258e+07 1.953608e+07 1.717060e+07 1.659894e+07 1.546727e+07 3.103005e+07 2.194184e+07 2.240198e+07 2.027948e+07 1.489138e+07 1.105894e+07 1.976748e+07 2.182710e+07 1.300449e+07 9.275086e+06 1.702971e+07 1.999889e+07 1.942599e+07 3.019056e+07 1.562765e+07 1.817254e+07 1.076671e+07 3.069771e+07 1.967312e+07 2.374953e+07 2.902879e+07 1.908940e+07 1.485216e+07 1.556546e+07 1.502769e+07 1.527044e+07 1.803618e+07 3.822597e+07 1.662870e+07 2.334497e+07 2.141299e+07 3.223705e+07 1.943472e+07 1.397670e+07 1.922460e+07 1.691010e+07 1.152862e+07 2.786067e+07 1.834859e+07 2.192142e+07 1.407674e+07 1.635675e+07 1.202058e+07 2.083100e+07 4.793176e+07 2.528212e+07 2.199326e+07 1.665066e+07 3.020761e+07 1.903074e+07 1.149363e+07 1.645861e+07 2.521829e+07 C14 H16 N6 O2_5.253 9.160009e+05 4.785357e+05 2.822778e+05 3.475575e+05 3.051651e+05 3.695732e+05 3.288056e+05 8.733018e+05 198980.84 2.565529e+05 4.554704e+05 5.295746e+05 193226.11 2.332024e+05 6.146433e+05 3.579893e+05 2.161851e+05 2.418144e+05 6.781514e+05 6.805249e+05 2.013150e+05 2.899651e+05 2.733448e+05 4.390024e+05 28685.782 5.729151e+05 1.495746e+05 6.848221e+05 4.032834e+04 2.938874e+05 3.967222e+05 1.663974e+05 104697.75 4.272748e+05 1.845368e+05 1.701180e+05 1.309161e+05 7.007515e+05 2.289947e+05 5.114724e+05 7.577511e+04 6.189966e+05 2.543980e+05 6.582268e+05 7.352561e+04 3.128892e+05 4.343158e+05 1.008320e+05 9.715611e+04 3.239973e+05 4.931135e+05 1.634350e+06 1.171625e+06 1.056711e+06 2.288104e+05 1.045734e+05 2.268131e+05 2.395806e+05 2.154047e+06 2.173269e+05 1.783718e+06 1.564249e+05 2.595065e+05 1.759638e+05 3.580148e+05 5.610979e+05 2.375138e+05 1.308803e+06 1.407617e+06 1.476764e+05 6.285711e+05 2.384825e+05 1.002134e+05 6.057457e+05 1.375305e+06 1.018353e+06 2.294157e+05 2.198648e+05 1.338540e+06 1.162905e+06 1.891234e+05 2.342370e+05 1.697503e+05 2.448158e+06 2.252683e+05 7.408270e+05 3.651540e+05 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2.458478e+06 2.262099e+06 1.492506e+05 2.388121e+06 2.226635e+06 2.418094e+06 105027.91 2.104111e+06 3.820623e+06 2.204701e+06 100802.99 1.875808e+06 2.068500e+06 2.147565e+06 1.014028e+05 2.659516e+06 2.270037e+06 2.775462e+06 9.049224e+04 2.071208e+06 2.476650e+06 2.763977e+06 13359.844 1.965348e+06 2.183205e+06 3.526723e+06 2.787215e+04 2.240700e+06 1.576779e+06 2.357596e+06 75914.60 2.153152e+06 2.694512e+06 2.508500e+06 9.502280e+04 2.361226e+06 1.920464e+06 2.840147e+06 6.946516e+04 2.491906e+06 2.085446e+06 2.743337e+06 8.719598e+04 2.719585e+06 1.548957e+06 2.720130e+06 2.883628e+06 2.201400e+06 3.097664e+06 3.152888e+06 2.368511e+06 2.816974e+06 3.312961e+06 4.216946e+06 2.238723e+06 1.518427e+06 4.437301e+06 1.955750e+06 2.175489e+06 5.929948e+06 3.437810e+06 2.973291e+06 2.817169e+06 2.112303e+06 2.413902e+06 2.457005e+06 3.189686e+06 1.950595e+06 3.201824e+06 2.669410e+06 3.212237e+06 2.627385e+06 2.438387e+06 3.705541e+06 3.416107e+06 3.058573e+06 1.800317e+06 2.711493e+06 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1.770862e+06 1.459974e+06 1.979144e+06 2.689179e+06 1.811183e+06 2.110292e+06 2.720341e+06 2.597925e+06 2.085992e+06 3.189999e+06 2.932512e+06 1.519599e+06 1.802421e+06 3.171644e+06 3.351270e+06 2.375471e+06 2.093343e+06 1.801700e+06 2.414944e+06 2.132697e+06 2.299670e+06 2.972642e+06 8.584148e+05 2.035799e+06 3.083490e+06 2.661502e+06 1.478019e+06 1.587274e+06 1.494031e+06 3.164219e+06 3.095879e+06 2.437005e+06 2.749062e+06 2.370857e+06 2.304667e+06 1.751623e+06 2.962127e+06 6.351730e+05 2.021721e+06 2.841393e+06 1.516258e+06 1.346382e+06 2.348082e+06 2.372258e+06 1.191922e+06 2.523229e+06 3.859434e+06 3.882940e+06 2.289712e+06 1.379870e+06 2.235003e+06 2.200391e+06 2.907648e+06 2.585937e+06 1.709992e+06 2.898132e+06 3.742942e+06 2.368205e+06 2.244399e+06 2.745443e+06 3.088930e+06 1.959141e+06 1.863592e+06 2.079804e+06 2.396544e+06 2.468893e+06 2.583280e+06 1.402801e+06 1.915484e+06 3.116343e+06 1.301031e+06 3.038842e+06 2.521543e+06 2.193273e+06 2.476041e+06 2.622854e+06 2.981463e+06 1.918622e+06 4.552517e+06 3.489709e+06 2.635840e+06 2.474202e+06 2.859275e+06 3.039949e+06 2.783593e+06 1.570188e+06 2.305914e+06 2.175083e+06 1.261156e+06 2.828650e+06 2.683784e+06 3.145462e+06 2.551225e+06 1.662137e+06 2.516661e+06 1.256532e+06 3.496068e+06 3.125401e+06 3.597004e+06 3.040134e+06 3.120656e+06 2.534855e+06 7.229377e+05 2.190707e+06 2.712688e+06 LPC O-16:1 (but missing M+H-18 m/z)_5.263 1.982121e+07 9.331724e+06 6.802304e+06 1.180071e+07 1.801583e+05 7.693510e+06 1.018578e+07 1.172291e+07 124002.49 9.557579e+06 7.695667e+06 1.148208e+07 117907.92 9.394381e+06 8.905383e+06 9.689735e+06 1.221450e+05 7.758420e+06 9.879118e+06 9.601874e+06 1.123403e+05 7.978244e+06 1.069068e+07 1.217241e+07 16805.175 7.683836e+06 9.587981e+06 9.430670e+06 3.502065e+04 8.570835e+06 9.425160e+06 1.054464e+07 85760.64 8.675472e+06 9.772263e+06 9.737430e+06 1.064721e+05 8.912036e+06 8.879655e+06 1.089227e+07 7.287589e+04 7.872034e+06 1.036182e+07 1.074592e+07 7.693647e+04 8.422101e+06 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1.611428e+06 1.095076e+06 1.507556e+06 1.829917e+06 C18 H44 N10 O8 P2 S_5.274 4.462266e+06 2.000934e+06 1.838914e+06 1.994256e+06 1.885213e+05 1.622944e+06 2.345565e+06 2.443092e+06 121817.96 1.895753e+06 2.005988e+06 2.490776e+06 105650.33 1.544376e+06 1.878352e+06 2.432283e+06 1.121882e+05 1.517665e+06 1.800355e+06 2.576709e+06 1.046726e+05 1.834617e+06 1.904616e+06 2.318350e+06 15928.747 1.826316e+06 2.167028e+06 2.169138e+06 3.150753e+04 1.496557e+06 1.891540e+06 2.403703e+06 71781.75 1.734360e+06 2.222777e+06 2.294358e+06 8.876884e+04 1.739957e+06 2.017903e+06 2.418074e+06 7.135380e+04 1.636236e+06 2.097415e+06 2.064556e+06 9.640161e+04 1.677597e+06 1.940192e+06 2.247663e+06 1.372365e+06 2.171498e+06 2.312542e+06 1.676293e+06 2.149801e+06 1.561824e+06 1.604294e+06 2.006531e+06 2.273585e+06 2.135250e+06 3.281196e+06 1.316345e+06 1.408302e+06 1.534773e+06 1.687141e+06 2.804794e+06 3.457203e+06 1.479177e+06 2.348226e+06 1.459190e+06 1.764888e+06 2.078662e+06 2.318280e+06 2.737550e+06 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1.842103e+06 119421.20 1.585794e+06 1.544433e+06 1.931183e+06 103582.66 1.485323e+06 1.529957e+06 1.665654e+06 9.845304e+04 1.444583e+06 1.507801e+06 1.480046e+06 8.155965e+04 2.730230e+06 1.573774e+06 1.512186e+06 13894.023 1.269958e+06 2.073809e+06 1.603302e+06 2.537267e+04 1.472028e+06 1.663016e+06 1.447948e+06 53739.19 1.867745e+06 1.562414e+06 1.108175e+06 6.370797e+04 2.677765e+06 1.790387e+06 1.653802e+06 5.221969e+04 1.534871e+06 1.133172e+06 1.631260e+06 7.151767e+04 1.987186e+06 1.965587e+06 1.461152e+06 9.535273e+05 1.926875e+06 1.537324e+06 8.855867e+05 1.284453e+06 1.381536e+06 1.717711e+06 1.404725e+06 2.289889e+06 1.747608e+06 8.720123e+05 1.239413e+06 1.350772e+06 1.878937e+06 1.708625e+06 1.379361e+06 9.625641e+05 1.171287e+06 1.535116e+06 1.352094e+06 1.428196e+06 1.293344e+06 1.118989e+06 1.441361e+06 1.154537e+06 1.480145e+06 1.772444e+06 1.752751e+06 8.653299e+05 1.279177e+06 1.121737e+06 1.979851e+06 1.455707e+06 1.061979e+06 1.065066e+06 1.386412e+06 1.618346e+06 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4.419614e+05 1.236804e+05 6.826283e+05 1.330885e+05 8.488893e+04 8.509144e+04 1.238190e+05 6.466677e+05 5.747820e+05 1.120966e+05 1.321518e+05 1.168797e+06 4.150889e+05 1.882655e+05 8.940877e+04 1.717423e+05 2.814511e+05 2.144437e+05 3.258743e+05 1.912014e+05 8.742256e+04 4.901294e+05 1.568454e+05 5.140008e+05 2.693807e+05 1.371781e+05 9.153326e+04 1.389191e+05 1.406600e+05 1.773030e+05 2.401337e+05 1.690040e+05 3.216157e+05 1.244853e+05 2.668028e+05 2.034400e+05 2.547782e+05 4.236894e+05 8.234764e+05 1.909578e+05 1.766970e+05 1.409708e+05 1.758026e+05 1.248283e+05 2.450452e+05 2.362813e+05 1.173126e+05 1.520279e+06 1.266836e+06 2.972268e+05 1.449525e+05 1.030316e+05 1.265488e+05 1.379027e+05 1.046418e+05 C25 H56 N3 O13 P3_5.279 2.190310e+05 1.452091e+05 1.030319e+05 1.360914e+05 1.292405e+05 2.606060e+05 2.801075e+05 2.889156e+05 62241.43 1.699483e+05 2.154428e+05 2.490645e+05 52570.73 6.311278e+04 1.945234e+05 1.782220e+05 6.254999e+04 6.563700e+04 1.725728e+05 1.899962e+05 6.564792e+04 7.383211e+04 2.969303e+05 2.755894e+05 11378.510 1.511521e+05 1.660020e+05 2.144368e+05 2.767144e+04 2.608229e+05 1.333222e+05 2.975723e+05 69031.86 1.327096e+05 2.895921e+05 1.710981e+05 8.288229e+04 1.889853e+05 1.826437e+05 3.083051e+05 5.718644e+04 2.654452e+05 1.354961e+05 2.046820e+05 8.134827e+04 1.710958e+05 1.388864e+05 2.877217e+05 4.311549e+05 7.086091e+04 1.495098e+05 1.995654e+06 5.502235e+05 4.300946e+05 1.667733e+05 4.828032e+05 7.701762e+04 1.310872e+05 1.269242e+05 1.185253e+06 3.391017e+05 1.114720e+05 7.542218e+04 1.196472e+05 1.100943e+06 4.947973e+05 1.427699e+05 1.611351e+05 3.081102e+05 9.745472e+04 1.876271e+06 2.695609e+05 3.941431e+05 9.117770e+05 1.118867e+05 5.769597e+05 7.679501e+04 6.624806e+05 7.751042e+04 3.568591e+05 1.577763e+05 6.069901e+05 1.080607e+05 3.997277e+05 1.029680e+05 3.541040e+05 1.620496e+05 6.717810e+04 1.942579e+05 2.431036e+05 1.247869e+05 9.290819e+05 2.362996e+05 6.030241e+04 1.217817e+05 9.005083e+05 1.111941e+06 1.033819e+05 9.939226e+05 6.290777e+04 1.601437e+05 3.038138e+05 1.250247e+05 4.552620e+05 1.197164e+05 1.332614e+05 1.219682e+05 1.689950e+05 1.024409e+05 3.652964e+05 1.514924e+05 8.568508e+04 2.222676e+05 9.068243e+05 1.561640e+06 9.734121e+04 1.691033e+05 2.437307e+05 1.246424e+05 1.812020e+05 1.484215e+05 9.950410e+04 1.083300e+05 1.484407e+05 1.135433e+05 1.063488e+05 1.106787e+05 9.650872e+04 9.053807e+04 6.697827e+04 1.181580e+05 1.212920e+05 9.701032e+04 1.298255e+05 6.722039e+04 1.034934e+05 9.305294e+04 8.862252e+04 2.242466e+05 7.640024e+04 1.152250e+05 1.094294e+05 6.072179e+04 9.599089e+04 8.862661e+04 2.602382e+05 3.828818e+05 1.307567e+05 6.214688e+04 1.129789e+05 5.362005e+04 1.218809e+05 7.703773e+04 3.818767e+05 1.155738e+05 1.136505e+05 1.862954e+05 9.527812e+04 1.391557e+05 1.879781e+05 3.293059e+05 1.810533e+05 8.776125e+04 2.033923e+05 3.256566e+05 6.887436e+04 1.529690e+05 1.884371e+05 1.711226e+05 1.103676e+05 1.092577e+05 1.217478e+05 1.036750e+05 1.894072e+05 1.321190e+05 4.222553e+05 4.139134e+05 7.555771e+05 1.858625e+05 4.721714e+05 2.396587e+05 1.697817e+05 7.289948e+04 3.774985e+05 4.928955e+05 2.632470e+05 1.985395e+05 9.139898e+04 6.818620e+04 1.544560e+05 2.182465e+05 5.044267e+05 8.067282e+05 8.118034e+05 1.898344e+05 1.407926e+05 1.234961e+05 1.138097e+05 3.027127e+05 1.206923e+05 1.295808e+05 7.224897e+04 1.097229e+05 1.058210e+05 2.318436e+05 7.933458e+05 1.596317e+05 2.408986e+05 7.321184e+04 2.994849e+05 5.073519e+05 8.289734e+04 1.515615e+05 1.400400e+05 9.862451e+05 6.979725e+05 2.198997e+05 2.581281e+05 1.460229e+06 2.645065e+05 1.514611e+05 1.305329e+05 1.109195e+05 1.353849e+05 1.644580e+05 6.591190e+04 3.292946e+05 2.955073e+05 8.474302e+05 2.645299e+05 1.189370e+06 6.542404e+05 2.147622e+05 2.624693e+05 5.384376e+05 1.204850e+05 1.174561e+05 2.556225e+05 1.114436e+05 2.274063e+05 2.002503e+05 7.259024e+04 9.365066e+04 8.431453e+04 6.855986e+05 1.102038e+06 4.012982e+05 1.555788e+05 1.177391e+05 3.051580e+05 2.515758e+05 3.196567e+05 2.567973e+05 9.795339e+04 7.504729e+05 1.714020e+06 7.351346e+04 1.246354e+05 7.187087e+04 1.093884e+05 1.206973e+05 8.558697e+04 C25 H39 N3 O12_5.279 6.790135e+07 4.068123e+07 2.816242e+07 4.789786e+07 1.647589e+05 3.552127e+07 4.189085e+07 3.788915e+07 119437.92 4.997572e+07 4.202795e+07 3.171657e+07 105655.41 3.515336e+07 4.757858e+07 3.423680e+07 1.076058e+05 4.091834e+07 3.888997e+07 4.637105e+07 1.030665e+05 3.900501e+07 3.655728e+07 3.901846e+07 16114.320 3.976038e+07 4.587169e+07 3.954041e+07 2.868018e+04 2.839548e+07 4.322836e+07 3.269468e+07 63688.15 4.430335e+07 5.062707e+07 4.240527e+07 8.972012e+04 3.091729e+07 3.969047e+07 4.519762e+07 7.521139e+04 3.401118e+07 3.721356e+07 4.138303e+07 1.026530e+05 3.649171e+07 4.628158e+07 3.699559e+07 2.580469e+07 5.876237e+07 3.482149e+07 3.735270e+07 2.433049e+07 4.444702e+07 3.501367e+07 5.681202e+07 8.590274e+07 6.333241e+07 3.481021e+07 4.365111e+07 4.094917e+07 7.053440e+07 3.451940e+07 6.890294e+07 3.328481e+07 2.903334e+07 4.217734e+07 2.474382e+07 3.638145e+07 4.339553e+07 2.428228e+07 3.414244e+07 4.679788e+07 4.461589e+07 6.318425e+07 6.008039e+07 2.202807e+07 3.526720e+07 4.672426e+07 5.180844e+07 3.680039e+07 2.402881e+07 1.552538e+07 3.279328e+07 3.729380e+07 6.512822e+07 6.152512e+07 3.897944e+07 3.030428e+07 6.037147e+07 2.943671e+07 3.314834e+07 4.222518e+07 4.464837e+07 4.606636e+07 3.263496e+07 4.120107e+07 3.464483e+07 3.958191e+07 3.193438e+07 3.643397e+07 5.427492e+07 3.307711e+07 4.134730e+07 3.205865e+07 5.111797e+07 2.432364e+07 3.628888e+07 3.715532e+07 3.236079e+07 3.228004e+07 3.245603e+07 3.084843e+07 4.745001e+07 4.143033e+07 4.191130e+07 4.072379e+07 5.101852e+07 2.941025e+07 4.434957e+07 4.019530e+07 3.497468e+07 3.267602e+07 6.912449e+07 3.975948e+07 7.274594e+07 3.581110e+07 3.672199e+07 3.186881e+07 2.017778e+07 3.865031e+07 3.692208e+07 4.821073e+07 3.519256e+07 5.793728e+07 3.650591e+07 2.941358e+07 4.457797e+07 4.314119e+07 4.296852e+07 3.905000e+07 3.763511e+07 3.183134e+07 3.099097e+07 6.998963e+07 4.185707e+07 4.702574e+07 4.790639e+07 5.920995e+07 2.896070e+07 3.730533e+07 3.248983e+07 4.094251e+07 2.951331e+07 3.954901e+07 6.253342e+07 5.666908e+07 3.497821e+07 2.783730e+07 5.817297e+07 3.068179e+07 2.373682e+07 4.251283e+07 4.264442e+07 3.203409e+07 4.410508e+07 6.136945e+07 3.516602e+07 4.123209e+07 4.182812e+07 5.048764e+07 4.248672e+07 4.040288e+07 2.199389e+07 4.797838e+07 2.491482e+07 4.567652e+07 4.680255e+07 3.785864e+07 3.589351e+07 2.166563e+07 5.793543e+07 4.954796e+07 3.055463e+07 2.667726e+07 3.499536e+07 4.655005e+07 2.780573e+07 2.545103e+07 3.745453e+07 3.664741e+07 4.197878e+07 2.136335e+07 2.793305e+07 2.051450e+07 3.299069e+07 4.959426e+07 3.829674e+07 2.973095e+07 3.007292e+07 3.189913e+07 2.833471e+07 2.782136e+07 3.403051e+07 3.808287e+07 5.749384e+07 4.355439e+07 4.856959e+07 3.420128e+07 3.446775e+07 2.636358e+07 3.658049e+07 3.098493e+07 2.569671e+07 2.964578e+07 3.763644e+07 5.103602e+07 2.673225e+07 2.501779e+07 3.484984e+07 4.817236e+07 4.962098e+07 3.939865e+07 3.859986e+07 3.358044e+07 2.771213e+07 5.616702e+07 6.781515e+07 3.336705e+07 6.511361e+07 2.732745e+07 4.194586e+07 2.864140e+07 2.511124e+07 2.846965e+07 4.332176e+07 5.866495e+07 3.590280e+07 3.030776e+07 2.983953e+07 3.610903e+07 3.750342e+07 2.501846e+07 4.324356e+07 3.745246e+07 3.177056e+07 3.523277e+07 3.099421e+07 3.453324e+07 3.336114e+07 3.511051e+07 2.828463e+07 3.868323e+07 4.301386e+07 6.096381e+07 2.557808e+07 3.843407e+07 3.731345e+07 5.758883e+07 3.284134e+07 5.559253e+07 4.986063e+07 C34 H37 N7 O3 S_5.28 7.525071e+06 2.359207e+06 2.733002e+06 3.717518e+06 1.869119e+05 2.308858e+06 4.821579e+06 4.130229e+06 137462.43 2.389243e+06 3.161413e+06 3.390222e+06 135725.21 2.760524e+06 2.857879e+06 3.245783e+06 1.408554e+05 2.801028e+06 2.750218e+06 4.205992e+06 1.169417e+05 2.142665e+06 2.776029e+06 6.171094e+06 15178.849 1.855587e+06 3.004289e+06 3.255724e+06 3.359072e+04 2.205575e+06 2.966939e+06 3.459507e+06 93271.69 2.789072e+06 3.210973e+06 3.480114e+06 1.059929e+05 3.391080e+06 2.741017e+06 3.954366e+06 7.728838e+04 2.885121e+06 2.962382e+06 3.550805e+06 1.070533e+05 2.946394e+06 2.657493e+06 3.543430e+06 1.740834e+06 3.891940e+06 1.538127e+06 2.723005e+06 2.922864e+06 3.579741e+06 3.710605e+06 5.723567e+06 2.513238e+06 5.354119e+06 3.938284e+06 3.003142e+06 4.297233e+06 2.338470e+06 3.723261e+06 3.807139e+06 4.094217e+06 1.927088e+06 4.324515e+06 2.809710e+06 3.470724e+06 2.845840e+06 2.475787e+06 3.139635e+06 4.948863e+06 2.649222e+06 4.236833e+06 2.988293e+06 3.323163e+06 3.981945e+06 4.538946e+06 3.537689e+06 4.987253e+06 1.814312e+06 1.726305e+06 4.668803e+06 2.715116e+06 2.697846e+06 1.724860e+06 2.185197e+06 2.430218e+06 1.517067e+06 3.197736e+06 2.464984e+06 2.341910e+06 2.879182e+06 3.365612e+06 2.618961e+06 2.220652e+06 4.630740e+06 1.984055e+06 2.886024e+06 2.730798e+06 2.197646e+06 2.520531e+06 2.341625e+06 2.259017e+06 3.140000e+06 2.546241e+06 1.354677e+06 2.584300e+06 3.803294e+06 2.722229e+06 2.959680e+06 2.815370e+06 2.807073e+06 3.162593e+06 2.791690e+06 3.758062e+06 2.453595e+06 3.132991e+06 3.838207e+06 1.707572e+06 1.524099e+06 1.495521e+06 3.699496e+06 2.464776e+06 2.215332e+06 2.767704e+06 1.795740e+06 2.323254e+06 3.538459e+06 3.621779e+06 4.040915e+06 1.474987e+06 2.606433e+06 3.092917e+06 2.387440e+06 2.016306e+06 2.324456e+06 2.619978e+06 2.980404e+06 3.176284e+06 3.505121e+06 4.838833e+06 2.266713e+06 2.725634e+06 4.220767e+06 1.769372e+06 3.534936e+06 3.759246e+06 1.453661e+06 2.000119e+06 3.183671e+06 1.860372e+06 2.442281e+06 2.158102e+06 3.220902e+06 2.815722e+06 3.837661e+06 2.071250e+06 2.058336e+06 1.742361e+06 2.814840e+06 2.331665e+06 3.602003e+06 2.387953e+06 3.675838e+06 2.989660e+06 2.242678e+06 2.024837e+06 2.351261e+06 3.699917e+06 3.476696e+06 2.751636e+06 1.509308e+06 2.981182e+06 3.387537e+06 8.330034e+06 2.642277e+06 2.899542e+06 3.252297e+06 1.509563e+06 2.685081e+06 3.932120e+06 2.957349e+06 1.925719e+06 8.061687e+05 4.173188e+06 3.171653e+06 3.990474e+06 2.437001e+06 1.853449e+06 3.213838e+06 2.080306e+06 2.177995e+06 6.762963e+05 2.065326e+06 2.596353e+06 3.605902e+06 3.093210e+06 2.506133e+06 2.555952e+06 1.604265e+06 3.206429e+06 2.194769e+06 4.998569e+06 2.689872e+06 1.966776e+06 2.231052e+06 1.570020e+06 2.579206e+06 3.630429e+06 3.335159e+06 1.476649e+06 2.572342e+06 2.143539e+06 2.393841e+06 3.176208e+06 2.196621e+06 2.218781e+06 1.470357e+06 3.386566e+06 2.412184e+06 4.032128e+06 2.191677e+06 2.120711e+06 3.928172e+06 3.731947e+06 2.565832e+06 3.611845e+06 3.175643e+06 5.149139e+06 2.503940e+06 1.330614e+06 2.294452e+06 1.868855e+06 2.150679e+06 4.047312e+06 2.690622e+06 3.319865e+06 2.426140e+06 3.304407e+06 2.315248e+06 1.602654e+06 2.879264e+06 2.527937e+06 1.979137e+06 3.250621e+06 3.797078e+06 3.265409e+06 2.475003e+06 2.915967e+06 2.884471e+06 4.354923e+06 4.469457e+06 2.476418e+06 2.471953e+06 3.545325e+06 3.333796e+06 2.753822e+06 1.865641e+06 1.945094e+06 3.854658e+06 PC O-20:1_5.28 7.209432e+06 3.223958e+06 2.934096e+06 3.697639e+06 3.788765e+05 2.476927e+06 4.065804e+06 4.336581e+06 221584.65 3.206034e+06 3.559865e+06 4.412525e+06 202468.74 2.833523e+06 3.019264e+06 3.536577e+06 2.445397e+05 2.889659e+06 3.351906e+06 4.027036e+06 2.536458e+05 2.848754e+06 3.569582e+06 4.553793e+06 36007.075 3.028087e+06 3.213549e+06 3.569113e+06 6.742622e+04 2.888838e+06 3.662671e+06 3.844411e+06 159326.64 3.071272e+06 3.378196e+06 3.958145e+06 2.084000e+05 3.338254e+06 3.119429e+06 3.930303e+06 1.480729e+05 2.718728e+06 3.918467e+06 4.099335e+06 1.820804e+05 3.045457e+06 2.679258e+06 3.953065e+06 3.489645e+06 3.529474e+06 2.028974e+06 6.251391e+06 2.573532e+06 3.251956e+06 4.163597e+06 6.793162e+06 5.303904e+06 9.213823e+06 6.765267e+06 4.236738e+06 4.262898e+06 4.591029e+06 4.136968e+06 5.802256e+06 4.059687e+06 2.343472e+06 4.466300e+06 2.870064e+06 4.165572e+06 4.427038e+06 4.397626e+06 4.253073e+06 4.741542e+06 4.377317e+06 4.878083e+06 3.494895e+06 3.286976e+06 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2.886660e+06 2.568518e+06 3.105049e+06 2.279393e+06 2.605099e+06 4.810575e+06 2.802728e+06 2.514594e+06 3.392535e+06 4.888554e+06 3.519040e+06 2.362360e+06 3.064956e+06 2.128301e+06 2.732419e+06 4.268772e+06 3.953632e+06 2.941473e+06 2.587804e+06 2.824820e+06 2.769356e+06 2.797805e+06 8.546302e+06 2.915130e+06 5.486821e+06 2.839620e+06 3.767148e+06 2.941637e+06 1.308190e+06 2.762022e+06 5.277525e+06 C23 H34 N10 O13 S_5.283 3.806012e+06 1.649924e+06 1.500931e+06 1.386562e+06 1.404760e+05 1.385217e+06 1.694509e+06 1.260067e+06 107150.17 1.927321e+06 8.613903e+05 1.664718e+06 85092.18 1.816594e+06 1.581333e+06 1.502306e+06 8.415611e+04 1.529470e+06 1.291210e+06 1.428566e+06 8.341659e+04 1.653323e+06 1.579346e+06 1.447897e+06 12312.195 1.510951e+06 1.495461e+06 1.740594e+06 2.140033e+04 1.471352e+06 1.285720e+06 1.288322e+06 48196.79 1.793429e+06 1.368321e+06 1.436270e+06 6.621088e+04 1.893195e+06 1.489797e+06 1.593238e+06 5.266808e+04 1.278525e+06 1.275130e+06 1.649558e+06 7.069496e+04 1.584070e+06 1.744475e+06 1.303911e+06 1.163085e+06 1.917525e+06 1.659426e+06 1.193875e+06 2.035189e+06 1.623763e+06 1.399390e+06 8.007215e+05 9.517526e+05 8.416311e+05 1.450219e+06 1.029926e+06 1.324497e+06 1.172014e+06 1.394511e+06 7.086211e+05 1.532131e+06 1.870112e+06 1.390880e+06 1.618195e+06 1.880460e+06 1.407556e+06 1.534775e+06 1.175894e+06 1.244306e+06 1.950005e+06 1.390052e+06 1.297809e+06 1.760567e+06 1.486153e+06 9.796715e+05 2.367606e+06 1.577664e+06 1.703984e+06 1.733601e+06 1.551861e+06 1.458496e+06 1.437949e+06 1.439140e+06 1.412628e+06 1.988017e+06 2.448707e+06 1.510692e+06 1.315714e+06 1.431432e+06 1.738423e+06 1.642590e+06 1.402734e+06 1.347855e+06 1.450124e+06 1.233277e+06 1.743935e+06 1.602413e+06 1.032000e+06 1.550919e+06 1.842393e+06 1.588420e+06 1.475528e+06 1.601080e+06 2.036485e+06 1.502438e+06 1.330840e+06 2.018017e+06 1.472337e+06 1.769436e+06 1.219952e+06 1.266161e+06 1.659418e+06 1.528952e+06 1.700044e+06 1.791235e+06 1.392134e+06 1.539449e+06 1.850014e+06 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1.193371e+06 2.201527e+06 1.506369e+06 1.769587e+06 1.359751e+06 2.124726e+06 1.265536e+06 1.651522e+06 1.683586e+06 1.500073e+06 1.301104e+06 1.932688e+06 1.435418e+06 1.806769e+06 2.069984e+06 1.116582e+06 1.474178e+06 1.345135e+06 1.644465e+06 9.438650e+05 2.171009e+06 1.702746e+06 1.248222e+06 2.044974e+06 1.520888e+06 1.680426e+06 1.633390e+06 1.127611e+06 8.225279e+05 1.348235e+06 1.684432e+06 2.009913e+06 1.694704e+06 1.902614e+06 1.285646e+06 1.836115e+06 1.992790e+06 1.645744e+06 1.498232e+06 2.235387e+06 2.126467e+06 1.250068e+06 1.915340e+06 1.447049e+06 2.002343e+06 1.987681e+06 1.502321e+06 1.657534e+06 1.024497e+06 1.585731e+06 1.877021e+06 1.571061e+06 1.513500e+06 1.549787e+06 1.498881e+06 1.541185e+06 1.448973e+06 1.670341e+06 1.923044e+06 1.825712e+06 1.125259e+06 9.686327e+05 1.565607e+06 "(2R)-3-Hydroxy-2-[(9Z,12E)-9,12-octadecadienoyloxy]propyl 2-(trimethylammonio)ethyl phosphate_5.283" 6.403335e+07 5.090828e+07 4.838854e+07 5.569366e+07 2.106171e+05 3.637305e+07 5.509776e+07 6.037317e+07 156898.27 4.714520e+07 4.750135e+07 5.959661e+07 140820.14 4.488958e+07 5.045379e+07 5.202783e+07 1.577242e+05 4.669772e+07 4.443783e+07 5.413331e+07 1.569577e+05 4.178740e+07 4.901218e+07 6.658208e+07 20895.984 5.583502e+07 4.227746e+07 3.880942e+07 4.299046e+04 5.404369e+07 4.915806e+07 5.756135e+07 105685.22 4.891568e+07 5.135195e+07 4.860737e+07 1.342100e+05 4.813650e+07 4.425216e+07 6.336650e+07 9.438063e+04 4.055399e+07 5.562223e+07 6.208865e+07 1.214038e+05 3.841523e+07 4.603872e+07 5.327466e+07 2.589330e+07 5.297187e+07 3.431045e+07 6.262234e+07 3.656097e+07 4.796820e+07 5.845606e+07 1.019366e+08 1.334433e+08 1.652135e+08 7.667452e+07 4.896124e+07 5.290050e+07 9.082677e+07 6.044216e+07 9.158432e+07 3.068127e+07 3.071888e+07 7.099560e+07 3.003047e+07 5.362553e+07 5.180802e+07 4.254644e+07 5.426219e+07 6.533930e+07 3.873551e+07 6.575659e+07 4.618690e+07 2.570865e+07 4.599183e+07 1.038362e+08 8.790022e+07 4.131562e+07 2.533726e+07 1.385232e+07 3.999106e+07 4.060000e+07 6.614866e+07 6.046079e+07 3.222589e+07 3.263346e+07 6.203592e+07 2.829285e+07 4.092643e+07 5.441655e+07 4.783352e+07 5.590299e+07 5.546973e+07 4.394314e+07 4.333811e+07 4.334315e+07 4.332677e+07 3.766319e+07 6.751956e+07 3.743789e+07 5.726972e+07 3.357190e+07 4.774313e+07 3.253577e+07 4.476087e+07 3.774030e+07 5.527600e+07 3.479123e+07 3.755677e+07 4.853103e+07 4.300519e+07 4.825934e+07 3.006295e+07 5.423794e+07 6.116390e+07 5.002285e+07 8.170887e+07 4.150633e+07 2.711245e+07 2.282355e+07 6.404446e+07 4.406048e+07 5.769011e+07 3.732625e+07 3.308312e+07 4.563613e+07 2.251601e+07 6.640842e+07 6.979618e+07 4.868087e+07 5.747205e+07 8.349357e+07 4.098571e+07 4.983099e+07 6.195381e+07 6.028426e+07 5.407992e+07 4.549104e+07 3.844101e+07 5.532553e+07 3.253345e+07 7.027461e+07 4.819503e+07 3.813732e+07 6.126393e+07 6.013269e+07 2.754106e+07 4.243682e+07 2.523109e+07 5.367957e+07 3.279242e+07 5.218529e+07 6.699357e+07 7.335694e+07 3.693762e+07 2.514311e+07 7.831176e+07 3.641894e+07 3.198062e+07 6.739627e+07 4.128712e+07 4.666383e+07 6.291588e+07 9.032374e+07 4.429434e+07 5.156957e+07 4.244612e+07 4.993881e+07 5.212799e+07 7.029831e+07 1.981176e+07 4.150697e+07 2.355257e+07 6.031337e+07 5.599892e+07 5.101971e+07 3.792769e+07 2.191281e+07 6.732618e+07 7.406423e+07 3.703124e+07 2.654854e+07 3.899905e+07 6.735206e+07 2.777745e+07 2.205747e+07 3.705691e+07 3.525730e+07 4.561737e+07 3.087235e+07 4.120156e+07 2.034037e+07 3.077837e+07 8.388880e+07 4.480809e+07 3.186146e+07 3.447249e+07 5.058252e+07 2.782343e+07 4.143417e+07 3.343739e+07 4.494029e+07 5.939041e+07 4.563197e+07 5.491284e+07 3.156542e+07 4.978195e+07 3.006274e+07 3.588825e+07 3.052511e+07 3.083171e+07 2.229369e+07 4.949911e+07 4.525051e+07 2.329135e+07 2.819457e+07 4.601220e+07 4.481283e+07 5.249878e+07 3.951584e+07 3.621124e+07 3.775448e+07 3.758499e+07 8.044708e+07 5.866611e+07 5.084814e+07 7.260516e+07 3.528476e+07 3.754159e+07 3.498818e+07 3.846911e+07 2.805506e+07 5.785941e+07 7.438382e+07 5.065705e+07 3.733220e+07 3.241197e+07 6.491736e+07 4.280041e+07 2.213233e+07 5.573326e+07 2.929283e+07 2.733336e+07 5.796040e+07 3.213601e+07 4.300365e+07 2.951810e+07 3.423687e+07 2.460773e+07 4.484490e+07 4.926828e+07 7.319803e+07 4.359679e+07 4.008441e+07 5.299612e+07 8.532924e+07 2.693755e+07 8.203789e+07 9.266140e+07 C31 H44 N O8 P S_5.285 2.074881e+07 6.913963e+06 8.216961e+06 8.165327e+06 1.920833e+05 6.892462e+06 1.147031e+07 9.471515e+06 123162.67 7.769912e+06 8.631233e+06 9.296598e+06 109163.96 7.303187e+06 7.556999e+06 9.576801e+06 1.133659e+05 7.389375e+06 8.049481e+06 9.882067e+06 1.159446e+05 7.270926e+06 8.758444e+06 1.060100e+07 16847.980 6.336034e+06 8.916518e+06 9.348795e+06 3.533182e+04 6.916437e+06 7.506687e+06 9.247547e+06 70919.04 7.697531e+06 9.211788e+06 9.864167e+06 9.110053e+04 7.266147e+06 8.683685e+06 9.550723e+06 7.175794e+04 6.898814e+06 8.193479e+06 1.006409e+07 9.729474e+04 6.823871e+06 8.125373e+06 9.010450e+06 4.022576e+06 8.369639e+06 9.213464e+06 6.317251e+06 8.238084e+06 6.550078e+06 7.034974e+06 8.372173e+06 9.818189e+06 9.673406e+06 1.309726e+07 5.517230e+06 5.870079e+06 6.450187e+06 6.529424e+06 1.385957e+07 1.212518e+07 5.241941e+06 1.026351e+07 6.761230e+06 8.389161e+06 7.529862e+06 9.571073e+06 8.410988e+06 8.923328e+06 1.066809e+07 8.742065e+06 9.273390e+06 1.545731e+07 6.599690e+06 1.731118e+07 8.968224e+06 9.315774e+06 6.366815e+06 5.762984e+06 7.935364e+06 9.396815e+06 1.118426e+07 6.091415e+06 7.120925e+06 8.166989e+06 6.551671e+06 8.797332e+06 6.343245e+06 7.381598e+06 6.392091e+06 1.156577e+07 1.108783e+07 4.454877e+06 9.183894e+06 5.314165e+06 9.424108e+06 6.577931e+06 5.086615e+06 6.404334e+06 9.949370e+06 8.052003e+06 9.815695e+06 5.258917e+06 5.485469e+06 5.796766e+06 7.687971e+06 5.860939e+06 6.855373e+06 6.804822e+06 6.519947e+06 5.351953e+06 9.830545e+06 1.024465e+07 8.217120e+06 9.908454e+06 9.967836e+06 5.994073e+06 7.551161e+06 2.916816e+06 7.327425e+06 6.523272e+06 1.288880e+07 1.357383e+07 6.662969e+06 1.141440e+07 1.266436e+07 7.919752e+06 1.272966e+07 1.019737e+07 7.201490e+06 1.053137e+07 4.535552e+06 8.832388e+06 7.177892e+06 1.123875e+07 6.692628e+06 7.174518e+06 7.482814e+06 9.990797e+06 7.400135e+06 8.289263e+06 4.512452e+06 7.999486e+06 8.495182e+06 8.096988e+06 4.269835e+06 9.524420e+06 5.137267e+06 7.371479e+06 4.748024e+06 5.565743e+06 7.681986e+06 7.202872e+06 9.752967e+06 6.994738e+06 8.275671e+06 1.213464e+07 7.008631e+06 5.394889e+06 7.992122e+06 7.131234e+06 1.046040e+07 6.714934e+06 1.082145e+07 7.322935e+06 7.020851e+06 8.083653e+06 1.064396e+07 6.820581e+06 5.318370e+06 6.510148e+06 8.315393e+06 1.304560e+07 7.905551e+06 7.580708e+06 1.037764e+07 2.592030e+06 1.010281e+07 7.036029e+06 1.001489e+07 7.309576e+06 7.300073e+06 1.231318e+07 1.013243e+07 5.104294e+06 5.104108e+06 8.856773e+06 6.905432e+06 7.260940e+06 9.524222e+06 1.997113e+06 4.847417e+06 7.210691e+06 1.033050e+07 8.235450e+06 5.226027e+06 5.309489e+06 5.836772e+06 4.933568e+06 4.760447e+06 6.809170e+06 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8.806696e+06 1.420175e+07 8.844086e+06 6.968424e+06 7.547231e+06 6.974235e+06 6.563048e+06 5.682814e+06 7.790629e+06 1.576155e+07 4.581391e+06 6.592924e+06 4.072489e+06 9.651629e+06 9.644217e+06 9.843586e+06 6.608129e+06 8.591833e+06 6.722178e+06 9.751251e+06 6.042636e+06 4.016246e+06 1.037587e+07 8.693129e+06 1.125362e+07 7.397811e+06 6.577864e+06 6.893543e+06 9.420558e+06 7.480706e+06 1.336719e+07 1.140886e+07 1.312552e+07 1.249313e+07 1.246224e+07 1.182180e+07 5.158963e+06 1.173996e+07 1.239110e+07 1.424314e+07 1.306034e+07 9.318003e+06 7.752898e+06 9.041195e+06 1.085778e+07 5.896787e+06 5.120496e+06 8.773619e+06 5.426575e+06 7.485072e+06 1.244328e+07 9.896346e+06 1.171725e+07 9.776900e+06 6.997725e+06 1.693219e+07 7.281107e+06 2.279359e+07 1.294752e+07 7.411535e+06 1.282104e+07 1.494690e+07 1.067570e+07 3.261759e+06 7.854905e+06 1.918080e+07 C71 H91 N2 O5 P3_5.293 2.956174e+06 4.434401e+05 6.967998e+05 9.571096e+05 1.819386e+05 9.531745e+05 1.226741e+06 1.079252e+06 95272.22 8.082047e+05 9.864042e+05 1.252333e+06 93279.88 4.989546e+05 8.766263e+05 8.551245e+05 1.032320e+05 6.261557e+05 9.816451e+05 1.234358e+06 1.011019e+05 7.096202e+05 9.566495e+05 1.046672e+06 15013.791 7.540274e+05 8.238475e+05 1.121739e+06 2.838519e+04 5.675499e+05 1.141566e+06 9.203741e+05 64579.72 6.179952e+05 1.056358e+06 9.624505e+05 7.953473e+04 8.387596e+05 8.053638e+05 1.381523e+06 5.731088e+04 6.753408e+05 7.310143e+05 1.086743e+06 7.216357e+04 7.185681e+05 7.182574e+05 1.092749e+06 3.724967e+05 9.782400e+05 7.803745e+05 7.631809e+05 9.372230e+05 7.781108e+05 8.462178e+05 1.132531e+06 1.645682e+06 2.038714e+06 2.523710e+06 7.514972e+05 7.107018e+05 6.760241e+05 8.039609e+05 2.089355e+06 1.276890e+06 3.910277e+05 1.462686e+06 7.637007e+05 7.257230e+05 1.025622e+06 1.089133e+06 1.296739e+06 1.138832e+06 1.011988e+06 1.914286e+06 7.231129e+05 1.927313e+06 8.927096e+05 2.548444e+06 1.231712e+06 9.304221e+05 4.753138e+05 2.716957e+05 1.267902e+06 7.706081e+05 9.771621e+05 3.784556e+05 4.533454e+05 7.033143e+05 4.654910e+05 7.460300e+05 6.328066e+05 4.697372e+05 5.540171e+05 1.121235e+06 1.465120e+06 2.850092e+05 1.291622e+06 5.096399e+05 8.483095e+05 4.217793e+05 4.491339e+05 6.856807e+05 6.969547e+05 3.129645e+05 7.740428e+05 4.529952e+05 3.257165e+05 4.677400e+05 8.281181e+05 3.771702e+05 8.894092e+05 8.050846e+05 5.213142e+05 5.946751e+05 4.112845e+05 1.306905e+06 4.902466e+05 9.699544e+05 1.118440e+06 2.826199e+05 2.541829e+05 3.033019e+05 6.067102e+05 4.936715e+05 1.292602e+06 1.048667e+06 4.320011e+05 1.091947e+06 1.038355e+06 1.001099e+06 1.927704e+06 9.201573e+05 1.079963e+06 1.447848e+06 4.028326e+05 8.574191e+05 8.825925e+05 1.432446e+06 8.251520e+05 7.335124e+05 1.281932e+06 1.054528e+06 7.826459e+05 7.166304e+05 2.925456e+05 5.713218e+05 1.072593e+06 7.072747e+05 1.125883e+05 9.250689e+05 2.938422e+05 5.310999e+05 3.596366e+05 4.391559e+05 8.852389e+05 6.205528e+05 7.036469e+05 2.636290e+05 1.013569e+06 1.179844e+06 5.191584e+05 5.579509e+05 7.122584e+05 7.872129e+05 1.321218e+06 8.797649e+05 1.233102e+06 7.341926e+05 5.208421e+05 9.988214e+05 1.277200e+06 7.056614e+05 1.873828e+05 4.616751e+05 8.827023e+05 2.094490e+06 7.192774e+05 1.084407e+06 5.668949e+05 1.790882e+05 6.401471e+05 1.017326e+06 8.294286e+05 3.936137e+05 4.707547e+05 1.343362e+06 7.521188e+05 4.201507e+05 3.988920e+05 7.070242e+05 8.202820e+05 5.471958e+05 1.196823e+06 1.475917e+05 4.717139e+05 1.336213e+06 6.792368e+05 4.067892e+05 7.406188e+05 7.655643e+05 4.638848e+05 5.954008e+05 5.317022e+05 6.781713e+05 1.542190e+06 2.347344e+05 3.147296e+05 2.166450e+05 7.935326e+05 9.650597e+05 8.076203e+05 6.956698e+05 1.108584e+06 3.793780e+05 9.292386e+05 5.896537e+05 2.869524e+05 8.702460e+05 9.553035e+05 8.294964e+05 7.667837e+05 6.606421e+05 4.263669e+05 7.361410e+05 4.686243e+05 1.470512e+06 5.899104e+05 1.193300e+06 1.522132e+06 1.548375e+06 8.812330e+05 4.689039e+05 1.045341e+06 1.126138e+06 1.285262e+06 1.151151e+06 5.722353e+05 5.168250e+05 8.516457e+05 1.384351e+06 2.883956e+05 4.037408e+05 6.377439e+05 1.911503e+05 4.909412e+05 1.570619e+06 1.011907e+06 1.163699e+06 7.326113e+05 6.232143e+05 1.570823e+06 7.284062e+05 2.396165e+06 9.159063e+05 1.579610e+06 1.160244e+06 1.416176e+06 8.286903e+05 1.082168e+05 7.129661e+05 2.056960e+06 C15 H42 N10 O13_5.296 2.660105e+06 8.767823e+05 8.820175e+05 5.479310e+05 2.045132e+05 3.463906e+05 1.006364e+06 1.363958e+06 89276.57 6.324524e+05 6.294765e+05 1.324196e+06 86991.76 5.263092e+05 6.559958e+05 8.965021e+05 1.024135e+05 5.632182e+05 7.420554e+05 9.432755e+05 9.749118e+04 6.031926e+05 1.049693e+06 1.181175e+06 13031.454 4.598303e+05 7.558698e+05 1.133914e+06 2.610547e+04 5.393846e+05 8.624831e+05 9.635406e+05 66869.12 3.966618e+05 8.398612e+05 1.158106e+06 8.115893e+04 5.157333e+05 9.769227e+05 1.078653e+06 5.995924e+04 4.739219e+05 9.335007e+05 1.113540e+06 8.394250e+04 3.619286e+05 6.497766e+05 1.022355e+06 1.787972e+05 1.222192e+06 2.789556e+05 1.422022e+06 6.724219e+05 7.604619e+05 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1.551360e+06 1.635528e+06 1.220373e+06 1.914608e+05 1.205274e+06 2.147919e+06 1.594592e+06 111977.63 1.592130e+06 1.718320e+06 1.683376e+06 98956.98 1.258077e+06 1.712489e+06 1.855027e+06 1.095395e+05 1.238154e+06 1.234083e+06 1.768330e+06 1.114445e+05 1.391379e+06 1.911020e+06 1.947728e+06 15446.275 1.168244e+06 1.449157e+06 1.772267e+06 3.173228e+04 1.526597e+06 1.637518e+06 1.486382e+06 64453.31 1.212901e+06 1.735993e+06 1.738051e+06 7.552111e+04 1.287008e+06 2.080473e+06 1.805580e+06 5.773381e+04 1.270753e+06 1.279119e+06 1.640390e+06 8.360622e+04 1.630784e+06 1.399859e+06 1.735945e+06 1.476279e+06 1.408667e+06 1.173023e+06 1.616157e+06 1.357944e+06 1.248054e+06 1.957462e+06 1.973165e+06 1.443519e+06 2.293958e+06 1.657276e+06 3.497986e+06 1.599154e+06 2.111107e+06 1.997193e+06 2.202727e+06 1.069134e+06 9.013306e+05 1.580703e+06 1.227084e+06 1.738462e+06 2.127461e+06 1.984980e+06 1.540054e+06 1.560242e+06 2.330206e+06 1.886548e+06 1.552320e+06 1.421770e+06 3.513334e+06 2.594566e+06 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1.411176e+06 1.028712e+06 7.881327e+05 1.591977e+06 1.012525e+06 1.166598e+06 1.309654e+06 1.078548e+06 8.419161e+05 1.938575e+06 1.548367e+06 8.628466e+05 1.108141e+06 1.644710e+06 1.015627e+06 1.575953e+06 1.450000e+06 1.460669e+06 1.459314e+06 9.392575e+05 2.415337e+06 1.241398e+06 1.245239e+06 1.347923e+06 8.172623e+05 8.406531e+05 1.685572e+06 1.513884e+06 1.829594e+06 2.191779e+06 2.119250e+06 1.136936e+06 1.299408e+06 1.460721e+06 1.917058e+06 1.690015e+06 1.470479e+06 1.193785e+06 9.052942e+05 1.135808e+06 1.754233e+06 1.425405e+06 1.011215e+06 1.381343e+06 1.082499e+06 1.296505e+06 8.736154e+05 1.291688e+06 1.504765e+06 1.477486e+06 1.245321e+06 1.121856e+06 1.071922e+06 1.977568e+06 1.195368e+06 1.407473e+06 1.577865e+06 1.378363e+06 1.026928e+06 1.569207e+06 1.624009e+06 1.574559e+06 2.958309e+06 1.374407e+06 1.456491e+06 1.602422e+06 1.686365e+06 1.305237e+06 1.231253e+06 1.266238e+06 1.569661e+06 1.508687e+06 1.536910e+06 2.436855e+06 1.714325e+06 1.026933e+06 1.586594e+06 1.472180e+06 1.179675e+06 1.100096e+06 2.630888e+06 9.233600e+05 1.583309e+06 1.590332e+06 1.706043e+06 2.035076e+06 1.399229e+06 1.500121e+06 1.253680e+06 1.027444e+06 1.477899e+06 1.168779e+06 1.684359e+06 1.966006e+06 1.144245e+06 2.168877e+06 1.349683e+06 3.292605e+06 2.427234e+06 1.759813e+06 1.871921e+06 1.576104e+06 1.777044e+06 6.292172e+05 1.697721e+06 2.085527e+06 C7 H15 N_5.303 2.409277e+06 1.279413e+06 1.408451e+06 1.387843e+06 2.069054e+05 9.575374e+05 1.511349e+06 1.430162e+06 133411.07 1.292761e+06 1.473729e+06 1.464893e+06 119609.84 1.344959e+06 1.160307e+06 1.354538e+06 1.284777e+05 1.128794e+06 1.342695e+06 1.575217e+06 1.293460e+05 1.148240e+06 1.285731e+06 1.748506e+06 18110.492 1.172902e+06 1.313092e+06 1.277660e+06 5.909329e+04 1.241356e+06 1.300148e+06 1.488587e+06 79154.11 1.186853e+06 1.339219e+06 1.422685e+06 1.026002e+05 1.510965e+06 1.276370e+06 1.289644e+06 7.769475e+04 1.149499e+06 1.367228e+06 1.561835e+06 9.394566e+04 1.214089e+06 1.262465e+06 1.399579e+06 2.001748e+06 4.577176e+06 2.433478e+06 2.260103e+06 1.096604e+06 9.960832e+05 1.826598e+06 2.403222e+05 3.303182e+06 2.336947e+06 1.470124e+06 1.993915e+06 1.189478e+06 2.570296e+06 2.002245e+06 3.172393e+06 1.130985e+06 3.049733e+05 8.998412e+05 4.085504e+05 9.412248e+05 7.950024e+05 1.507377e+06 2.146628e+06 1.008417e+06 3.822548e+05 4.888831e+05 8.064809e+05 1.571948e+06 2.736855e+05 1.637525e+06 1.092897e+06 5.425346e+05 1.291658e+06 1.638139e+05 5.728591e+05 1.397310e+06 1.718693e+06 7.006159e+05 1.489848e+06 1.334363e+06 1.881629e+06 3.121692e+05 9.485326e+05 1.605401e+06 6.804388e+05 9.266402e+05 4.957016e+05 9.899263e+05 5.981323e+05 2.672345e+06 6.720425e+05 3.137145e+05 1.406168e+06 9.974400e+05 9.216244e+05 1.687625e+05 5.822428e+05 9.508728e+05 9.605263e+05 1.039853e+06 1.621111e+06 1.527998e+06 5.864349e+05 4.448111e+05 1.229296e+06 2.518120e+06 1.803136e+06 1.275828e+06 1.830673e+06 8.231482e+05 6.461990e+05 3.814872e+05 1.959140e+06 1.473559e+06 1.434022e+06 1.312452e+06 2.517556e+06 3.227179e+06 1.269896e+06 2.418255e+06 1.495806e+06 2.566628e+06 1.675460e+06 1.652771e+06 6.140138e+05 8.487389e+05 1.702740e+06 1.886144e+06 1.316703e+06 6.466756e+05 8.409487e+05 4.617425e+05 1.330480e+06 9.219254e+05 1.781502e+06 2.691042e+06 1.438231e+06 5.323414e+05 2.803175e+06 3.672634e+06 1.011385e+06 4.396985e+05 1.388357e+06 2.338284e+06 1.596133e+06 2.741863e+05 7.319071e+05 4.582410e+06 8.539119e+05 5.386662e+05 1.279329e+06 1.771559e+06 9.375808e+05 2.172553e+06 9.807556e+05 7.886185e+05 2.417402e+06 1.598586e+06 1.192477e+06 2.504241e+06 1.820547e+06 1.320482e+06 1.405671e+06 1.244740e+06 9.600071e+05 1.213368e+06 4.547951e+05 2.094134e+06 4.056423e+06 1.434573e+06 1.073530e+06 9.580542e+05 1.301668e+06 8.065593e+05 3.784301e+05 8.908548e+05 6.476087e+05 1.200160e+06 6.060481e+05 1.439501e+06 1.191010e+06 1.196308e+06 9.306563e+05 8.112796e+05 9.430584e+05 5.301950e+05 5.882059e+05 1.624010e+06 3.313881e+05 5.963604e+06 1.335910e+06 8.878647e+05 7.967056e+05 1.558491e+06 2.885618e+06 9.818237e+05 9.906720e+05 2.673174e+06 1.043758e+06 3.475486e+06 5.522298e+05 3.603661e+06 2.378580e+06 1.416522e+06 9.856169e+05 8.907140e+05 5.733410e+05 1.766907e+06 1.782906e+06 1.266587e+06 1.208054e+06 4.222208e+06 1.074164e+06 2.179235e+06 1.923470e+06 1.269420e+06 1.701666e+06 6.279884e+05 1.347391e+06 1.234987e+06 3.741375e+05 1.074242e+06 7.886513e+05 9.880209e+05 1.273629e+06 8.896444e+05 2.766760e+06 2.743954e+06 2.203313e+06 1.382855e+06 1.894594e+06 1.309839e+06 1.473415e+06 4.229303e+06 8.894163e+05 6.122559e+05 3.767733e+06 3.190920e+06 1.174823e+06 1.980538e+06 1.537825e+05 1.040223e+06 2.493695e+06 2.981397e+05 4.247339e+05 2.230209e+06 1.766587e+06 5.148469e+05 1.164359e+06 1.084251e+06 7.588568e+05 2.473702e+06 1.895305e+06 DL-_-Aminocaprylic acid_5.305 1.213947e+07 6.715635e+06 7.043265e+06 8.130226e+06 2.020400e+05 4.683650e+06 9.028590e+06 8.348996e+06 129530.37 7.175503e+06 7.142047e+06 7.961258e+06 119497.75 6.984963e+06 6.167223e+06 7.629999e+06 1.286221e+05 7.330243e+06 6.633287e+06 7.766018e+06 1.344517e+05 6.271802e+06 7.695576e+06 9.745098e+06 24088.129 6.633668e+06 6.370761e+06 7.745963e+06 4.310800e+04 5.772268e+06 6.805397e+06 7.757540e+06 87979.00 8.063794e+06 7.521354e+06 6.866601e+06 1.151631e+05 7.026625e+06 7.374825e+06 8.147992e+06 8.340481e+04 6.765008e+06 6.636646e+06 8.787155e+06 1.046483e+05 6.749849e+06 5.600679e+06 8.419703e+06 1.105795e+07 2.633415e+07 1.419499e+07 1.234389e+07 6.883469e+06 6.056324e+06 9.084589e+06 1.524312e+06 1.811628e+07 1.019693e+07 8.756189e+06 9.933956e+06 7.283144e+06 1.448350e+07 1.184078e+07 2.003735e+07 6.429923e+06 2.028892e+06 4.835979e+06 2.821089e+06 4.742495e+06 4.818609e+06 8.187273e+06 1.199852e+07 5.578213e+06 2.751328e+06 3.972806e+06 4.365604e+06 6.778098e+06 1.574119e+06 9.885445e+06 5.374220e+06 2.089088e+06 7.441033e+06 1.248760e+06 3.416704e+06 7.050878e+06 1.038877e+07 3.721025e+06 7.981366e+06 7.481113e+06 1.118339e+07 2.942455e+06 5.417824e+06 1.010786e+07 3.031376e+06 4.230780e+06 3.922146e+06 5.388629e+06 3.839301e+06 1.394208e+07 2.894232e+06 2.184881e+06 5.390255e+06 5.605177e+06 4.774633e+06 1.822721e+06 3.632666e+06 4.651395e+06 5.378645e+06 6.125241e+06 1.148410e+07 9.157755e+06 3.197045e+06 3.155026e+06 5.350475e+06 1.265049e+07 7.900068e+06 6.779181e+06 1.120283e+07 5.174775e+06 4.930115e+06 2.216427e+06 1.053490e+07 5.341518e+06 8.584415e+06 7.798573e+06 1.374719e+07 1.728231e+07 7.601794e+06 1.214213e+07 7.878286e+06 1.443165e+07 9.516711e+06 9.699306e+06 3.678792e+06 6.160035e+06 1.036997e+07 8.404882e+06 8.134307e+06 4.080105e+06 5.216920e+06 3.085447e+06 7.277565e+06 3.944736e+06 1.029282e+07 1.498320e+07 6.808213e+06 2.740425e+06 1.457870e+07 1.971068e+07 6.025856e+06 2.916037e+06 8.689840e+06 1.381783e+07 9.235100e+06 1.930741e+06 3.735634e+06 2.109366e+07 4.129863e+06 3.365386e+06 6.588549e+06 7.978302e+06 5.142155e+06 9.809524e+06 6.394155e+06 4.012094e+06 1.241105e+07 9.889195e+06 5.881034e+06 1.273593e+07 1.013035e+07 7.003008e+06 7.957554e+06 6.524414e+06 5.976840e+06 7.592436e+06 1.966563e+06 1.173503e+07 1.970691e+07 6.338324e+06 5.679268e+06 9.200851e+06 5.710649e+06 4.773693e+06 2.436766e+06 4.128804e+06 3.622778e+06 6.552800e+06 2.791491e+06 5.130273e+06 5.704789e+06 7.775812e+06 5.218137e+06 6.257833e+06 5.095113e+06 4.453540e+06 4.129005e+06 7.394035e+06 2.333687e+06 2.373625e+07 7.026803e+06 5.964681e+06 5.316623e+06 9.197292e+06 1.485642e+07 5.117428e+06 5.090995e+06 1.480528e+07 5.918755e+06 1.850794e+07 3.404704e+06 2.033524e+07 1.330148e+07 7.723677e+06 6.424707e+06 5.091230e+06 3.277134e+06 9.717053e+06 9.907050e+06 5.772728e+06 6.465222e+06 2.193866e+07 4.337949e+06 1.161752e+07 1.010421e+07 5.380035e+06 9.208200e+06 3.190683e+06 6.691066e+06 6.474871e+06 2.425549e+06 5.895750e+06 3.953794e+06 5.685302e+06 7.740346e+06 4.538297e+06 1.572729e+07 1.462383e+07 9.200755e+06 7.113767e+06 7.608857e+06 6.754279e+06 8.502443e+06 2.517467e+07 4.368857e+06 3.460306e+06 2.182575e+07 1.543523e+07 5.895997e+06 8.911711e+06 1.420721e+06 4.848586e+06 1.490802e+07 1.658819e+06 2.883283e+06 1.148989e+07 9.948511e+06 2.811633e+06 6.370765e+06 5.602971e+06 3.801420e+06 1.412526e+07 1.195369e+07 375.51109_5.306 4.061713e+06 1.679981e+06 1.304435e+06 2.029221e+06 1.074403e+05 1.084122e+06 2.673276e+06 2.405813e+06 75998.25 1.198694e+06 1.638911e+06 1.463747e+06 71956.84 1.595203e+06 1.725683e+06 1.833803e+06 7.616600e+04 1.859320e+06 1.460807e+06 1.767697e+06 8.260298e+04 2.378507e+06 1.593791e+06 1.734916e+06 13224.175 1.095294e+06 1.716451e+06 1.842177e+06 2.360146e+04 2.092490e+06 1.525119e+06 1.728414e+06 43857.19 1.704351e+06 1.733966e+06 1.929752e+06 5.463544e+04 1.616595e+06 2.016523e+06 1.765052e+06 4.307736e+04 1.629773e+06 1.415672e+06 1.537020e+06 5.620032e+04 1.936528e+06 1.881768e+06 1.713485e+06 1.383066e+06 2.525169e+06 1.714326e+06 1.696744e+06 2.332283e+06 3.213123e+06 1.337071e+06 9.342951e+05 1.590844e+06 1.486624e+06 1.740032e+06 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2.349180e+05 2.100362e+06 4.650627e+05 4.943929e+05 1.370773e+06 6.844998e+05 3.386155e+05 6.660034e+05 1.232955e+06 6.490829e+05 9.919868e+05 8.266200e+05 6.471864e+05 8.080352e+05 1.544115e+06 4.892933e+05 3.449046e+06 5.539519e+05 1.292309e+06 1.158789e+06 2.584944e+05 3.198739e+05 1.706905e+06 297.62804_5.313 8.861580e+06 4.161659e+07 4.426581e+07 4.629453e+07 2.012141e+05 3.391026e+07 5.581660e+07 4.714314e+07 140045.19 4.113651e+07 4.403632e+07 4.804828e+07 124497.25 4.024660e+07 4.143689e+07 5.187234e+07 1.228875e+05 3.765680e+07 4.228680e+07 5.015100e+07 1.273300e+05 4.133600e+07 4.390747e+07 5.063717e+07 18664.208 3.866935e+07 4.306023e+07 4.443922e+07 4.490053e+04 4.103673e+07 4.495874e+07 5.080958e+07 82052.30 4.246587e+07 5.419397e+07 5.545548e+07 1.240248e+05 1.007881e+06 5.815585e+07 5.214644e+07 8.099322e+04 4.227955e+07 4.388340e+07 4.884281e+07 1.022005e+05 3.969326e+07 4.051056e+07 4.690805e+07 3.026504e+07 4.819530e+07 1.661026e+07 1.816339e+07 4.075072e+07 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3.700907e+07 3.676653e+07 4.689080e+07 5.384066e+07 1.746510e+07 3.235727e+07 3.221419e+07 3.581503e+07 3.163877e+07 5.167386e+07 3.124359e+07 2.460571e+07 3.702215e+07 4.334215e+07 3.048673e+07 4.615912e+07 5.272543e+07 4.370653e+07 3.854842e+07 5.428809e+07 5.128145e+07 3.244517e+07 5.027908e+07 7.323651e+07 4.617565e+07 2.478428e+07 4.057086e+07 3.585560e+07 5.528133e+07 4.848643e+07 5.529713e+07 3.258233e+07 3.743896e+07 4.360918e+07 3.642118e+07 4.023951e+07 4.393883e+07 3.582244e+07 3.612736e+07 1.464579e+07 5.855229e+07 1.238045e+07 4.171192e+07 2.606573e+07 6.055666e+07 3.805041e+07 5.907312e+07 6.586130e+07 3.156894e+07 4.834246e+07 6.130041e+07 5.560135e+07 3.312758e+07 4.077333e+07 5.494248e+07 LPC 20:2_5.313 2.007264e+07 5.343345e+06 4.946910e+06 7.044128e+06 4.091546e+05 4.889286e+06 6.570773e+06 8.836691e+06 193202.28 5.663107e+06 6.757172e+06 8.149637e+06 172551.93 3.928573e+06 6.474662e+06 7.013629e+06 1.971575e+05 5.384859e+06 4.764063e+06 7.703075e+06 2.237165e+05 5.474157e+06 7.823422e+06 7.751948e+06 35876.320 5.078840e+06 5.701678e+06 4.980460e+06 8.433010e+04 4.962952e+06 7.039210e+06 8.448025e+06 139251.49 6.543083e+06 6.435935e+06 5.472498e+06 1.875216e+05 5.152625e+06 7.223465e+06 5.963376e+06 1.262489e+05 5.774183e+06 6.843838e+06 8.474046e+06 1.493756e+05 5.070808e+06 4.834611e+06 7.160002e+06 4.205590e+06 5.162106e+06 3.212125e+06 7.560531e+06 5.683901e+06 6.939279e+06 8.560938e+06 1.288128e+07 1.117657e+07 2.444234e+07 1.158618e+07 5.014892e+06 7.662640e+06 8.492936e+06 7.347681e+06 1.242347e+07 1.046487e+07 4.263852e+06 8.970681e+06 3.537303e+06 7.935527e+06 9.192699e+06 8.206601e+06 7.545082e+06 5.325157e+06 5.400273e+06 1.501528e+07 7.686375e+06 5.693269e+06 9.137662e+06 1.201561e+07 7.624801e+06 5.190115e+06 3.930575e+06 2.373975e+06 9.619690e+06 5.002824e+06 6.017929e+06 3.366071e+06 2.197268e+06 5.187084e+06 3.935821e+06 7.536040e+06 3.898709e+06 5.397548e+06 5.102190e+06 5.203766e+06 7.503446e+06 3.723863e+06 1.071755e+07 3.851239e+06 7.719481e+06 3.521198e+06 5.897915e+06 7.451791e+06 6.204288e+06 3.530648e+06 6.643450e+06 4.536909e+06 2.391952e+06 7.207169e+06 4.967268e+06 3.488309e+06 1.082512e+07 6.713359e+06 6.229396e+06 5.799380e+06 3.494015e+06 8.923910e+06 3.664980e+06 6.452670e+06 8.759156e+06 2.748232e+06 1.517950e+06 1.251065e+06 8.110601e+06 3.182092e+06 5.010207e+06 5.040701e+06 3.129834e+06 4.049388e+06 5.226697e+06 1.373201e+07 1.157879e+07 2.847112e+06 9.453331e+06 6.911506e+06 5.249403e+06 4.559905e+06 8.062245e+06 6.013039e+06 6.516524e+06 6.509518e+06 9.795308e+06 7.712617e+06 6.334732e+06 4.908594e+06 4.751702e+06 3.870508e+06 7.004902e+06 6.440452e+06 2.277798e+06 3.476910e+06 5.057624e+06 5.588285e+06 4.163813e+06 4.842254e+06 5.078109e+06 3.935573e+06 6.910196e+06 3.458304e+06 5.576470e+06 4.129953e+06 4.910454e+06 4.048588e+06 6.102754e+06 5.889096e+06 5.941899e+06 5.531786e+06 3.549838e+06 6.389590e+06 4.570317e+06 6.040691e+06 8.681083e+06 7.312101e+06 4.087850e+06 5.203862e+06 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3.375761e+06 5.162631e+06 4.008330e+06 1.640942e+06 3.241033e+06 5.938967e+06 C27 H52 N6 O2 P2 S2_5.322 2.980772e+08 6.887461e+07 1.583650e+08 1.520034e+08 2.356436e+05 9.719803e+07 1.909330e+08 1.332417e+08 152189.48 1.356717e+08 1.321438e+08 1.476430e+08 142768.77 1.299078e+08 9.823301e+07 1.472018e+08 1.436534e+05 1.174610e+08 1.381415e+08 1.477363e+08 1.412099e+05 1.357165e+08 1.282518e+08 1.457915e+08 20096.210 1.223758e+08 1.249412e+08 1.464688e+08 4.753620e+04 1.271581e+08 1.369742e+08 1.370669e+08 86599.04 1.374761e+08 1.077988e+08 1.452114e+08 1.169388e+05 1.256622e+08 1.409131e+08 1.404520e+08 8.140069e+04 1.388952e+08 1.281249e+08 1.630228e+08 1.115957e+05 9.569446e+07 1.286402e+08 1.432589e+08 1.158835e+08 1.643309e+08 1.188749e+08 1.265007e+08 1.916983e+08 1.501524e+08 1.419465e+08 1.535118e+08 1.503182e+08 4.347122e+07 1.791512e+08 1.604413e+08 1.155254e+08 1.564153e+08 1.576825e+08 1.761494e+08 1.435676e+08 1.228424e+08 1.431383e+08 1.142621e+08 1.019674e+08 1.580503e+08 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1.611829e+06 6.849101e+04 1.248533e+06 1.341579e+06 1.433437e+06 10047.311 9.142347e+05 1.197866e+06 1.875705e+06 2.703327e+04 7.147872e+05 1.140956e+06 8.469505e+05 57253.88 1.647929e+06 1.415997e+06 1.415330e+06 8.582471e+04 4.801715e+05 1.543268e+06 1.566256e+06 5.352848e+04 7.609813e+05 1.385306e+06 1.476639e+06 6.169348e+04 1.111211e+06 1.148546e+06 1.235764e+06 1.130007e+06 8.647864e+05 1.182052e+06 1.355054e+06 1.463906e+06 2.534440e+06 2.477241e+06 1.654205e+06 1.278259e+06 2.093288e+06 2.435805e+06 1.565434e+06 1.297573e+06 1.352810e+06 1.817509e+06 2.301350e+06 1.262907e+06 8.609223e+05 9.924864e+05 1.332101e+06 1.003467e+06 3.688325e+05 2.081708e+06 1.279965e+06 7.457616e+05 9.835630e+05 1.325614e+06 1.000071e+06 1.160847e+06 1.251015e+06 1.729253e+06 1.714977e+06 1.063761e+06 5.320546e+05 1.055468e+06 2.533013e+06 9.784106e+05 8.406372e+05 1.028390e+06 5.203821e+05 8.313083e+05 7.287836e+05 1.109726e+06 9.312723e+05 1.991617e+05 1.350558e+06 1.530973e+06 1.497230e+06 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1.021326e+06 5.760014e+05 1.465657e+06 1.823974e+06 6.841395e+05 3.232758e+06 6.539691e+05 1.971994e+06 1.454033e+06 4.754669e+05 4.142684e+05 1.853789e+06 328.67017_5.324 2.335851e+07 3.893971e+07 4.588387e+07 4.175966e+07 1.732956e+05 2.924238e+07 4.944965e+07 4.056141e+07 127570.32 4.449799e+07 3.973104e+07 4.370328e+07 118079.27 3.934637e+07 3.869884e+07 4.512117e+07 1.212350e+05 3.740981e+07 4.065993e+07 4.379226e+07 1.278172e+05 3.894666e+07 4.065097e+07 4.520172e+07 18154.765 4.085583e+07 3.871585e+07 4.188865e+07 4.226912e+04 3.925797e+07 4.208112e+07 3.713361e+07 72046.65 4.228804e+07 4.830836e+07 3.718999e+07 9.837815e+04 3.862238e+07 4.652378e+07 4.060541e+07 7.385165e+04 4.010263e+07 4.000494e+07 4.246080e+07 9.334929e+04 4.079829e+07 3.770830e+07 4.402995e+07 3.416779e+07 4.473690e+07 3.662471e+07 3.752619e+07 5.058613e+07 4.185994e+07 5.093813e+07 5.285735e+07 3.695824e+07 4.240912e+07 5.083548e+07 5.101164e+07 3.394200e+07 4.524379e+07 4.498371e+07 5.594247e+07 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3.680729e+07 5.112882e+07 3.988210e+07 5.062609e+07 3.560370e+07 2.869502e+07 5.030495e+07 3.575872e+07 2.925225e+07 4.174915e+07 3.491383e+07 3.875126e+07 3.307844e+07 3.831594e+07 4.547803e+07 3.271762e+07 4.305265e+07 2.964603e+07 4.397288e+07 1.470320e+07 3.333129e+07 3.477044e+07 4.593444e+07 4.140686e+07 4.425695e+07 4.546594e+07 4.306197e+07 3.227998e+07 3.141336e+07 4.694785e+07 4.765060e+07 3.207642e+07 3.397440e+07 3.360757e+07 4.171087e+07 1.627329e+07 3.287638e+07 4.601524e+07 2.987734e+07 2.123127e+07 3.476767e+07 4.708118e+07 3.852143e+07 3.093593e+07 2.893984e+07 4.127810e+07 3.526548e+07 4.173563e+07 4.067099e+07 4.012359e+07 4.149299e+07 3.955642e+07 4.610092e+07 1.798707e+07 1.289226e+07 4.124862e+07 4.446678e+07 2.565628e+07 4.616555e+07 4.512177e+07 3.520172e+07 4.798613e+07 5.034714e+07 7.358360e+07 3.997119e+07 3.115760e+07 3.738720e+07 3.176678e+07 3.883396e+07 3.942821e+07 3.896460e+07 5.608267e+07 5.041391e+07 4.523381e+07 1.373390e+07 3.744061e+07 4.466303e+07 3.769534e+07 3.948982e+07 3.828054e+07 4.608163e+07 3.469826e+07 3.691596e+07 3.868040e+07 4.064350e+07 3.688381e+07 3.007491e+07 5.318431e+07 5.068575e+07 4.485928e+07 3.440603e+07 5.090721e+07 4.422861e+07 5.190333e+07 4.370239e+07 5.414949e+07 3.185516e+07 6.113836e+07 5.613580e+07 5.233152e+07 4.489481e+07 3.336728e+07 4.924426e+07 4.366175e+07 2.754783e+07 4.492328e+07 4.129014e+07 4.276497e+07 4.399222e+07 4.275672e+07 4.377866e+07 3.946902e+07 5.954902e+07 4.227692e+07 5.317433e+07 5.507592e+07 4.661614e+07 3.364859e+07 2.808260e+07 3.223266e+07 5.265646e+07 C13 H17 N O2_5.324 4.415418e+05 1.265439e+06 1.881496e+06 1.736113e+06 2.691623e+05 1.414370e+06 2.013383e+06 1.971756e+06 152807.31 2.084988e+06 1.785442e+06 1.772120e+06 145484.97 1.583516e+06 1.481675e+06 1.966097e+06 1.511662e+05 1.681301e+06 1.715689e+06 1.606812e+06 1.543427e+05 1.599600e+06 2.077573e+06 2.117795e+06 21483.697 1.513282e+06 1.827731e+06 1.870163e+06 5.543304e+04 1.411918e+06 1.676705e+06 1.900436e+06 100926.48 1.630292e+06 1.949833e+06 1.708089e+06 1.344484e+05 1.741721e+06 1.627612e+06 1.738329e+06 9.097156e+04 1.896073e+06 1.737697e+06 1.910156e+06 1.158572e+05 1.788260e+06 1.474946e+06 1.890443e+06 1.689961e+05 2.047925e+05 1.643264e+05 1.931574e+05 1.969889e+05 2.116494e+05 2.078653e+05 1.960508e+05 2.007215e+05 2.258518e+05 2.237902e+05 1.956073e+05 1.997997e+05 1.773978e+05 2.089225e+05 2.328873e+05 1.844101e+05 1.544874e+05 1.947935e+05 2.009428e+05 1.915194e+05 1.942947e+05 2.408298e+05 1.911477e+05 1.865506e+05 1.813895e+05 1.955082e+05 1.752411e+05 2.015056e+05 1.838805e+05 2.246794e+05 1.968011e+05 1.798799e+05 1.976469e+05 1.715274e+05 1.995233e+05 1.996267e+05 1.743544e+05 1.711462e+05 1.766710e+05 1.757117e+05 1.762105e+05 2.050165e+05 1.758369e+05 2.015499e+05 1.776673e+05 1.897748e+05 2.015468e+05 1.843202e+05 1.914266e+05 1.815698e+05 1.741253e+05 1.835457e+05 2.029065e+05 1.704441e+05 1.993714e+05 9.479658e+07 1.995135e+08 1.922134e+05 1.955928e+05 2.074483e+05 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2.115387e+05 1.651911e+05 1.857199e+05 1.703879e+05 2.346292e+05 1.695666e+05 1.869399e+05 1.985226e+05 1.706979e+05 1.805363e+05 1.668009e+05 2.012639e+05 1.954079e+05 1.769385e+05 1.716879e+05 1.681916e+05 2.011780e+05 1.807458e+05 2.638758e+05 1.919505e+05 1.818930e+05 2.269833e+05 1.599785e+05 2.209464e+05 2.072997e+05 1.841448e+05 1.750904e+05 2.149127e+05 1.657379e+05 1.994408e+05 1.743312e+05 1.561166e+05 1.791370e+05 1.835814e+05 1.799605e+05 1.789078e+05 1.968534e+05 2.202507e+07 1.702232e+05 1.728423e+05 1.927675e+05 1.758994e+05 2.116385e+05 2.436459e+05 1.738116e+05 1.726374e+05 2.047891e+05 1.897994e+05 1.898883e+05 2.020171e+05 2.706651e+05 2.025590e+08 2.194111e+05 2.580942e+05 1.916989e+05 1.860283e+05 1.808264e+05 2.605950e+05 1.911274e+05 1.522553e+05 2.061368e+05 1.990309e+05 1.872556e+05 1.770598e+05 1.767200e+05 1.985601e+05 1.870705e+05 2.071781e+05 2.390799e+05 2.017174e+05 1.928534e+05 2.259897e+05 1.847172e+05 1.808894e+05 1.957344e+05 2.141102e+05 C80 H156 N9 O10 P3 S4_5.324 3.864593e+06 1.422454e+06 1.453043e+06 1.115602e+06 9.984536e+04 1.149560e+06 1.406662e+06 1.570862e+06 65181.07 1.204610e+06 1.504218e+06 1.723804e+06 59424.00 1.110777e+06 1.224746e+06 1.223009e+06 6.466615e+04 1.294522e+06 1.187437e+06 1.602883e+06 6.113594e+04 1.233213e+06 1.378723e+06 1.576258e+06 9232.497 1.333689e+06 1.374685e+06 1.321761e+06 2.382949e+04 1.032753e+06 1.203536e+06 1.718239e+06 41137.66 1.415509e+06 1.308105e+06 1.299686e+06 5.715485e+04 1.162703e+06 1.313169e+06 1.503670e+06 3.650957e+04 1.402184e+06 1.362195e+06 1.435568e+06 4.452407e+04 1.316868e+06 1.001167e+06 1.578394e+06 1.456107e+06 1.730862e+06 1.535254e+06 1.563438e+06 2.054215e+06 1.837456e+06 1.798995e+06 2.578668e+06 1.466405e+06 1.991814e+06 3.487988e+06 1.860089e+06 8.522783e+05 1.504995e+06 2.089096e+06 2.169310e+06 1.148008e+06 8.695577e+05 1.867628e+06 7.739032e+05 1.046854e+06 2.537160e+06 1.662953e+06 2.082793e+06 1.877154e+06 9.292400e+05 2.043743e+06 4.697263e+05 1.385129e+06 2.121677e+06 2.678413e+06 1.688696e+06 1.046413e+06 1.520473e+06 5.034260e+05 2.280366e+06 1.112695e+06 1.149985e+06 9.789951e+05 5.214999e+05 1.302884e+06 8.012345e+05 1.793772e+06 7.594781e+05 5.561037e+05 1.064907e+06 1.370029e+06 2.100538e+06 1.572806e+06 1.929440e+06 9.168584e+05 8.638193e+05 9.376681e+05 6.836237e+05 1.438459e+06 4.338198e+05 8.028017e+05 1.092610e+06 6.183928e+05 1.034587e+06 1.507050e+06 1.213935e+06 8.050872e+05 1.529102e+06 1.529958e+06 1.283884e+06 1.037992e+06 8.746791e+05 1.287253e+06 5.161058e+05 1.311859e+06 2.000379e+06 4.654627e+05 2.694039e+05 1.469128e+05 7.377209e+05 9.957398e+05 1.458412e+06 9.228495e+05 8.526116e+05 1.136944e+06 4.528421e+05 1.186849e+06 2.275281e+06 1.669230e+06 2.375731e+06 1.867806e+06 1.696048e+06 1.239628e+06 7.540052e+05 1.487044e+06 1.094421e+06 1.369767e+06 1.150809e+06 1.663366e+06 1.235901e+06 1.791815e+06 1.275442e+06 6.425274e+05 2.242640e+06 7.197263e+05 5.905310e+05 1.386843e+06 9.477420e+05 1.534232e+06 1.117784e+06 1.144218e+06 1.064307e+06 1.002800e+06 5.714973e+05 7.307083e+05 1.777322e+06 1.875621e+06 9.628647e+05 5.766465e+05 2.342905e+06 2.191643e+06 2.613232e+06 2.102338e+06 1.616818e+06 1.047849e+06 7.006388e+05 1.959653e+06 2.546660e+06 4.969172e+05 1.001837e+06 7.561405e+05 1.860462e+06 2.919862e+06 1.029272e+06 1.855351e+06 3.884452e+05 2.519140e+05 8.005121e+05 1.772344e+06 8.586066e+05 6.551158e+05 6.809948e+05 1.354454e+06 9.807372e+05 1.400637e+06 1.793217e+06 1.372824e+06 1.679089e+06 1.356522e+06 2.295281e+06 1.411979e+05 1.191935e+06 8.688716e+05 1.722708e+06 8.169439e+05 2.690541e+06 2.105637e+06 9.513500e+05 2.538557e+06 1.811224e+06 2.793312e+06 1.287160e+06 5.218019e+05 6.624540e+05 7.361746e+05 1.141347e+06 2.176812e+06 1.196769e+06 2.272595e+06 3.336649e+06 1.314487e+06 2.465601e+06 7.779701e+05 1.817863e+06 1.048433e+06 1.278156e+06 9.526127e+05 1.913557e+06 1.072715e+06 1.186217e+06 1.100438e+06 1.108981e+06 1.298234e+06 5.758262e+05 3.426008e+06 1.817025e+06 1.820942e+06 6.739854e+05 2.048216e+06 1.791490e+06 1.962308e+06 1.338930e+06 1.777138e+06 5.169000e+05 2.750957e+06 2.396624e+06 1.722208e+06 1.188320e+06 7.818556e+05 1.881557e+06 1.081060e+06 4.444666e+05 2.279374e+06 1.452782e+06 1.516140e+06 1.626866e+06 1.602601e+06 1.807175e+06 1.242972e+06 3.091520e+06 9.895734e+05 3.532500e+06 2.225827e+06 1.364685e+06 6.877646e+05 2.849015e+05 7.466531e+05 2.278819e+06 C11 H21 N O4_5.324 2.511500e+07 1.102061e+07 1.218688e+07 7.587322e+06 2.864058e+05 9.663765e+06 1.357786e+07 1.258844e+07 186744.44 1.171542e+07 1.149983e+07 9.638455e+06 198295.96 1.043420e+07 1.043925e+07 1.123787e+07 1.794771e+05 1.104720e+07 1.178800e+07 1.200142e+07 1.958987e+05 1.098523e+07 9.888604e+06 1.442745e+07 31672.729 8.061020e+06 1.055280e+07 1.065801e+07 7.089496e+04 1.216963e+07 8.900221e+06 1.197364e+07 112099.78 1.213315e+07 1.134769e+07 1.056994e+07 1.440291e+05 1.138393e+07 1.045806e+07 1.225328e+07 1.000394e+05 1.085215e+07 9.989501e+06 1.232067e+07 1.272545e+05 1.051371e+07 1.054092e+07 1.149376e+07 1.123192e+07 7.708416e+06 6.915197e+06 1.098006e+07 1.478781e+07 9.227413e+06 1.574661e+07 2.165973e+07 9.882741e+06 8.916115e+06 1.561840e+07 1.226876e+07 1.463120e+07 1.402759e+07 1.044833e+07 5.942625e+06 5.589507e+06 1.356500e+07 1.157395e+07 1.198025e+07 1.957302e+07 1.505585e+07 7.162005e+06 2.538742e+07 1.417792e+07 8.781567e+06 1.175895e+07 1.506259e+07 9.019242e+06 9.031145e+06 1.139972e+07 6.292773e+06 9.435847e+06 6.762408e+06 2.564215e+06 7.164859e+06 3.520267e+06 5.531120e+06 9.983134e+06 1.464938e+07 8.119392e+06 5.611804e+06 2.097270e+07 1.495094e+07 1.920430e+07 2.124437e+07 4.932146e+06 1.020344e+07 1.328394e+07 9.331072e+06 1.284867e+07 6.614171e+06 1.257107e+07 1.790383e+07 6.518423e+06 1.287258e+07 1.092445e+07 8.383075e+06 1.447483e+07 1.280170e+07 1.569003e+07 9.748855e+06 6.340811e+06 2.289408e+07 2.684977e+07 1.349016e+07 1.131984e+07 1.261603e+07 1.420676e+07 1.425189e+07 1.646598e+07 4.948112e+06 6.275218e+06 7.452644e+06 6.107902e+06 1.421686e+07 7.443815e+06 3.954194e+06 7.093180e+06 6.356538e+06 8.177204e+06 1.406571e+07 8.478276e+06 9.363472e+06 7.315742e+06 1.270320e+07 6.642595e+06 1.728004e+07 7.316601e+06 8.755883e+06 7.548254e+06 8.818744e+06 1.144015e+07 2.094172e+07 1.462952e+07 2.485999e+07 6.534590e+06 1.696029e+07 1.466757e+07 1.578685e+07 1.934055e+07 5.374207e+06 3.760882e+06 9.779324e+06 1.102371e+07 1.214288e+07 2.004895e+07 2.742711e+07 1.568000e+07 1.087030e+07 8.869387e+06 1.069222e+07 8.857611e+06 1.927104e+07 4.558371e+06 1.260039e+07 1.194769e+07 5.395682e+06 1.048176e+07 7.570041e+06 5.064129e+06 7.876217e+06 1.146898e+07 6.845700e+06 1.330923e+07 1.422826e+07 8.168047e+06 1.651234e+07 7.116009e+06 1.133254e+07 8.878578e+06 1.062943e+07 3.599118e+06 5.671313e+06 6.099318e+06 6.032678e+06 2.069334e+07 3.527779e+06 4.615924e+06 1.079339e+07 2.143178e+07 1.478996e+07 2.228186e+07 1.995657e+07 2.991935e+06 6.581526e+06 8.579735e+05 8.424294e+06 1.581544e+07 1.274922e+07 1.382414e+07 1.494728e+07 1.374711e+07 1.320212e+07 6.010976e+06 1.727459e+07 9.976583e+06 1.435709e+07 1.629331e+07 9.106774e+06 1.805386e+07 1.036691e+07 7.937955e+06 4.526573e+06 1.048190e+07 1.075728e+07 7.620922e+06 1.381043e+07 5.894474e+06 6.994176e+06 1.554582e+07 1.301483e+07 1.484604e+07 9.361442e+06 1.666436e+07 1.370909e+07 7.903620e+06 8.220207e+06 8.737275e+06 2.052166e+07 7.713329e+06 9.860603e+06 1.631101e+07 1.568767e+07 1.876478e+07 1.830828e+07 1.593898e+07 6.856964e+06 2.137740e+07 1.717531e+07 1.165943e+07 2.540249e+07 1.707495e+07 8.562650e+06 1.483599e+07 1.429588e+07 5.065611e+06 1.071205e+07 1.269407e+07 1.201703e+07 1.150749e+07 9.808049e+06 1.092051e+07 2.430775e+07 8.672825e+06 2.299156e+07 3.593594e+07 8.145885e+06 6.461190e+06 9.795966e+06 1.821730e+07 1.264232e+07 1.688277e+07 1.004350e+07 Platelet-activating factor (peak 1)_5.325 7.372382e+08 3.044684e+08 3.357433e+08 3.148935e+08 4.032144e+05 2.142486e+08 3.667342e+08 3.391579e+08 254198.22 3.252111e+08 3.334269e+08 3.566771e+08 234018.31 2.828698e+08 3.031329e+08 3.078569e+08 2.567064e+05 2.858198e+08 3.129791e+08 3.520528e+08 2.737693e+05 2.759451e+08 3.229856e+08 3.724872e+08 38660.609 2.863840e+08 3.160537e+08 3.242454e+08 9.305524e+04 2.923995e+08 2.914369e+08 3.495073e+08 162587.36 2.988852e+08 3.359754e+08 3.307657e+08 2.195710e+05 2.694474e+08 3.486937e+08 3.287904e+08 1.550492e+05 2.763764e+08 3.301499e+08 3.445130e+08 1.817322e+05 3.009509e+08 2.793975e+08 3.392401e+08 2.692263e+08 3.169675e+08 2.719966e+08 3.348033e+08 3.453112e+08 3.238841e+08 3.937184e+08 5.047993e+08 4.011920e+08 5.723598e+08 5.995635e+08 3.284994e+08 3.189392e+08 4.559195e+08 4.089581e+08 5.491080e+08 3.122254e+08 2.322101e+08 4.082192e+08 2.264302e+08 2.952209e+08 4.189363e+08 3.722885e+08 4.039378e+08 3.668159e+08 2.820898e+08 4.048074e+08 2.418406e+08 3.415922e+08 4.072069e+08 6.409911e+08 4.121216e+08 2.751140e+08 2.660141e+08 1.758069e+08 4.467219e+08 2.773492e+08 2.937684e+08 2.322615e+08 1.575276e+08 2.774205e+08 2.811636e+08 3.000752e+08 2.117846e+08 2.186286e+08 2.791261e+08 3.281349e+08 3.948538e+08 2.813481e+08 3.956432e+08 1.047047e+08 2.613404e+08 2.352426e+08 2.456637e+08 3.349008e+08 1.872424e+08 2.181395e+08 2.826656e+08 2.006997e+08 2.432803e+08 2.980386e+08 2.979855e+08 2.197045e+08 3.257283e+08 3.181303e+08 2.625459e+08 2.579444e+08 2.388299e+08 4.113129e+08 2.097985e+08 2.861601e+08 3.491592e+08 1.868622e+08 1.446689e+08 1.307467e+08 2.475997e+08 2.323889e+08 3.225081e+08 2.904516e+08 2.235267e+08 2.709764e+08 1.932030e+08 3.511635e+08 5.076493e+08 3.449093e+08 4.116574e+08 4.402911e+08 3.115611e+08 2.971968e+08 3.888725e+08 3.135743e+08 2.921569e+08 3.525761e+08 3.060025e+08 3.754284e+08 1.396287e+08 4.017508e+08 2.867988e+08 2.259106e+08 4.268460e+08 2.131310e+08 1.748756e+08 2.861001e+08 2.375732e+08 3.148321e+08 2.380450e+08 2.696936e+08 2.839757e+08 2.494806e+08 2.025702e+08 1.863371e+08 3.695613e+08 3.095536e+08 2.535095e+08 2.565957e+08 1.732576e+08 3.132840e+08 3.687774e+08 3.779205e+08 3.278698e+08 2.667457e+08 2.313664e+08 3.848913e+08 4.109816e+08 2.343762e+08 2.164978e+08 2.299788e+08 3.158558e+08 4.682833e+08 2.484200e+08 3.397332e+08 2.081182e+08 1.544235e+08 2.506786e+08 4.267202e+08 2.782503e+08 2.101445e+08 2.301659e+08 3.234901e+08 2.636888e+08 2.882565e+08 3.157524e+08 2.884938e+08 3.201407e+08 2.779345e+08 1.353545e+08 1.185040e+08 3.105014e+08 4.297393e+08 3.583689e+08 1.921486e+08 3.905296e+08 3.649648e+08 2.497877e+08 3.802158e+08 3.276249e+08 5.177492e+08 3.018015e+08 2.021156e+08 2.316277e+08 1.966438e+08 3.136041e+08 3.460806e+08 2.960595e+08 4.286177e+08 4.474981e+08 2.767501e+08 4.124946e+08 2.575089e+08 3.152083e+08 2.350908e+08 2.779594e+08 2.707412e+08 3.643700e+08 2.200184e+08 2.666216e+08 3.012962e+08 2.578106e+08 3.680423e+08 2.302971e+08 5.498617e+08 1.767734e+08 4.065501e+08 2.382900e+08 3.389063e+08 3.684829e+08 3.289441e+08 2.784368e+08 4.665633e+08 2.491684e+08 4.785800e+08 4.494173e+08 6.297465e+08 3.371938e+08 2.486777e+08 3.545170e+08 2.404101e+08 1.981222e+08 4.565579e+08 3.474014e+08 1.430028e+08 3.060668e+08 3.183487e+08 3.191180e+08 2.891421e+08 5.696036e+08 2.749587e+08 5.577081e+08 3.789741e+08 3.317397e+08 2.964240e+08 1.357016e+08 2.753239e+08 6.372367e+08 C25 H52 N3 O3 P3 S2_5.325 2.669956e+07 9.245943e+06 1.174046e+07 8.195078e+06 2.088124e+05 6.167309e+06 1.387736e+07 8.617796e+06 141773.24 1.094957e+07 9.156666e+06 1.005210e+07 125000.90 7.688386e+06 9.845297e+06 1.033657e+07 1.194399e+05 1.030314e+07 1.069136e+07 8.797808e+06 1.342850e+05 1.044871e+07 6.496851e+06 1.168413e+07 20160.339 1.048911e+07 9.730679e+06 1.162895e+07 4.808156e+04 6.684387e+06 8.174810e+06 1.102006e+07 77215.80 9.540530e+06 1.026585e+07 1.048565e+07 1.001895e+05 9.142277e+06 1.024817e+07 1.194834e+07 7.682137e+04 6.329801e+06 1.014405e+07 1.031010e+07 9.784148e+04 9.842466e+06 7.333193e+06 1.137849e+07 7.867666e+06 7.619477e+06 7.131233e+06 9.876847e+06 8.784952e+06 1.091917e+07 1.297735e+07 1.269661e+07 1.232108e+07 8.591390e+06 1.563181e+07 1.193497e+07 1.099692e+07 1.127543e+07 1.145180e+07 9.282188e+06 7.424626e+06 1.021197e+07 4.918635e+06 1.122150e+07 1.114597e+07 7.953811e+06 8.935831e+06 1.054020e+07 1.197801e+07 6.868692e+06 1.324087e+07 1.104348e+07 8.594617e+06 9.308963e+06 1.210432e+07 1.201994e+07 7.730436e+06 4.729497e+06 4.786436e+06 1.004273e+07 8.809557e+06 9.993729e+06 9.567247e+06 6.701418e+06 9.720117e+06 6.395042e+06 1.062341e+07 1.267114e+07 8.510533e+06 8.469111e+06 5.467806e+06 1.006076e+07 7.609091e+06 1.224105e+07 7.424478e+06 1.111625e+07 9.562569e+06 8.114766e+06 1.458593e+07 6.999549e+06 4.821702e+06 6.288145e+06 5.703994e+06 5.920569e+06 1.280440e+07 8.921628e+06 8.600900e+06 1.552282e+07 1.459903e+07 6.015893e+06 6.511783e+06 9.691876e+06 1.215157e+07 5.769308e+06 1.505002e+07 8.407270e+06 6.777617e+06 4.040461e+06 3.175395e+06 1.013056e+07 7.015387e+06 9.090737e+06 7.335750e+06 5.093912e+06 7.541966e+06 9.241374e+06 1.015204e+07 8.368292e+06 6.377727e+06 1.074765e+07 8.775216e+06 5.393703e+06 7.733374e+06 9.303186e+06 1.074215e+07 8.056075e+06 1.015052e+07 1.907197e+07 1.290101e+07 7.596909e+06 1.133884e+07 7.828587e+06 7.810715e+06 1.119278e+07 1.217548e+07 5.992535e+06 5.146859e+06 8.565468e+06 9.415432e+06 8.164504e+06 1.149317e+07 1.332131e+07 8.414474e+06 3.581365e+06 7.434894e+06 9.899765e+06 6.840529e+06 6.434663e+06 1.021505e+07 1.089267e+07 7.052455e+06 9.052191e+06 1.087616e+07 7.227398e+06 6.744685e+06 6.661660e+06 1.080052e+07 1.050820e+07 6.146917e+06 5.608901e+06 1.016652e+07 8.997707e+06 8.422591e+06 6.308812e+06 1.284779e+07 1.141172e+07 3.566916e+06 8.847769e+06 1.145985e+07 9.499162e+06 7.993825e+06 9.653194e+06 1.044301e+07 8.469892e+06 1.187564e+07 6.978526e+06 7.466021e+06 8.281846e+06 5.936040e+06 8.741004e+06 4.840190e+06 1.248194e+07 1.802789e+07 1.440768e+07 5.460153e+06 1.067982e+07 8.891643e+06 6.504083e+06 8.838285e+06 5.967941e+06 1.138443e+07 1.130543e+07 6.928948e+06 4.419343e+06 6.357664e+06 1.258945e+07 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2.366616e+06 3.725649e+05 5.759030e+05 6.573983e+05 1.328117e+06 1.885454e+06 6.583865e+05 3.927286e+05 8.733070e+05 3.244756e+05 7.282162e+05 5.819580e+05 3.215988e+05 1.026068e+06 7.238882e+05 7.556190e+05 9.221079e+05 6.132825e+05 4.849267e+05 8.676428e+05 2.308339e+06 1.325717e+06 1.716212e+05 1.448707e+05 2.038196e+05 3.210781e+05 4.679913e+05 8.270216e+05 1.331359e+05 1.059387e+05 1.479745e+05 2.859564e+05 1.930306e+05 1.939726e+05 3.455515e+05 1.777988e+05 4.541874e+05 6.861627e+05 4.033080e+05 5.015242e+05 1.336037e+05 3.944942e+05 2.745508e+05 6.353616e+05 2.965168e+05 5.378430e+05 1.419035e+05 6.152923e+05 1.314096e+05 1.583796e+05 5.215445e+05 4.448783e+05 2.480839e+05 7.211270e+05 7.372057e+05 4.036870e+05 3.014462e+05 1.233192e+05 8.409469e+05 4.627811e+05 3.911003e+05 1.071562e+06 1.196569e+05 3.894528e+05 2.129900e+05 3.880439e+05 3.938378e+05 7.129199e+05 2.603700e+05 2.302341e+05 5.203635e+05 3.368565e+05 1.198047e+06 1.097174e+06 4.010988e+05 4.724198e+05 1.008060e+06 5.760733e+05 2.116256e+05 6.354198e+05 4.414172e+05 6.976422e+05 3.998778e+05 4.344266e+05 6.474534e+05 1.226591e+05 5.255801e+05 3.410916e+05 1.398552e+05 5.976513e+05 6.837175e+05 1.380008e+05 9.494362e+04 1.049358e+05 4.210050e+05 2.234724e+05 4.562231e+05 3.665294e+05 1.296280e+05 3.301589e+05 1.872018e+05 5.437133e+05 1.883346e+05 3.997333e+05 6.341451e+05 1.623157e+05 5.164495e+05 9.918225e+05 1.023836e+06 2.401583e+05 6.705415e+05 1.350199e+05 3.247420e+05 5.101795e+05 4.613356e+05 1.119549e+05 3.209457e+05 2.859027e+05 1.048544e+06 8.631340e+05 7.144500e+05 4.941868e+05 1.456654e+05 5.082616e+05 1.636676e+06 2.719454e+05 2.763452e+05 4.069972e+05 5.783282e+05 2.528845e+05 1.270557e+05 4.455257e+05 4.340137e+05 8.024854e+04 3.296166e+05 3.089500e+05 1.188404e+05 8.425852e+04 9.137959e+05 2.978633e+05 3.192061e+05 4.296782e+05 9.368618e+04 1.958016e+05 1.494666e+05 1.362316e+05 5.175353e+05 5.429596e+05 1.584482e+05 5.165518e+05 1.165382e+05 5.199498e+05 6.733107e+05 6.260668e+05 6.156825e+05 1.215816e+05 9.145259e+04 4.792908e+05 5.848905e+05 2.787146e+05 1.830191e+05 3.454726e+05 4.177913e+05 2.030080e+05 2.631513e+05 5.073900e+05 6.105219e+05 1.983645e+05 6.415102e+05 7.730692e+05 2.211790e+05 6.963959e+05 6.734115e+05 5.452237e+05 1.279208e+05 6.471360e+05 1.169545e+05 9.149193e+05 5.688133e+05 2.467637e+05 9.593924e+04 8.350961e+04 7.176952e+05 8.244685e+04 1.224561e+05 1.410674e+05 1.150733e+05 9.414544e+04 5.994901e+05 2.897535e+05 7.803562e+05 1.154569e+05 1.694903e+05 2.345945e+05 1.008424e+05 6.082168e+05 4.799291e+05 3.511332e+05 4.424977e+05 6.857139e+05 8.233730e+05 2.011492e+05 4.669085e+05 9.522229e+05 1097.61948_5.329 3.168208e+07 1.134137e+07 1.124562e+07 1.054586e+07 1.305458e+05 8.314563e+06 1.332491e+07 1.229012e+07 88536.60 1.057301e+07 1.086043e+07 1.320158e+07 81063.49 1.041491e+07 9.372552e+06 1.214529e+07 8.492560e+04 9.820772e+06 1.019527e+07 1.332958e+07 8.121920e+04 9.412064e+06 1.156996e+07 1.271994e+07 12275.342 1.010123e+07 1.106815e+07 1.159866e+07 3.037160e+04 1.003050e+07 1.036565e+07 1.178881e+07 53660.22 1.081367e+07 1.206479e+07 1.047499e+07 7.383870e+04 1.056002e+07 1.177155e+07 1.144592e+07 4.980966e+04 1.055158e+07 1.138296e+07 1.155620e+07 6.073161e+04 1.033648e+07 1.058513e+07 1.165336e+07 8.787202e+06 1.382838e+07 1.052320e+07 1.295837e+07 9.840693e+06 1.176190e+07 1.034384e+07 1.368138e+07 1.752867e+07 1.991493e+07 1.698609e+07 1.306021e+07 1.297556e+07 1.816375e+07 1.438521e+07 2.084452e+07 1.043991e+07 6.690899e+06 1.467381e+07 7.248030e+06 9.930636e+06 1.273752e+07 1.600680e+07 1.159451e+07 1.325811e+07 1.466737e+07 1.538435e+07 8.025028e+06 9.550605e+06 1.633319e+07 1.699343e+07 1.513974e+07 9.036646e+06 7.523420e+06 4.566903e+06 1.277630e+07 1.146267e+07 1.127691e+07 9.040889e+06 6.029094e+06 9.411800e+06 1.086732e+07 8.819513e+06 8.197982e+06 8.814267e+06 9.689332e+06 1.054477e+07 1.469158e+07 1.052504e+07 1.047579e+07 7.659776e+06 9.811175e+06 9.931927e+06 1.154538e+07 1.037577e+07 4.127214e+06 7.311663e+06 9.667149e+06 6.155683e+06 7.233689e+06 1.036112e+07 1.018526e+07 7.381380e+06 1.331120e+07 1.197058e+07 8.902224e+06 1.064836e+07 8.354247e+06 9.776544e+06 8.669534e+06 1.144161e+07 1.501483e+07 7.867694e+06 4.715194e+06 4.204923e+06 9.858480e+06 8.285878e+06 1.350341e+07 1.077428e+07 6.806228e+06 9.413783e+06 5.803967e+06 1.399600e+07 1.766587e+07 1.053964e+07 1.395610e+07 1.487550e+07 1.006387e+07 8.289867e+06 1.300987e+07 1.205760e+07 1.271334e+07 1.070710e+07 8.808251e+06 1.233190e+07 8.627704e+06 1.648138e+07 1.234297e+07 7.349582e+06 1.265568e+07 1.126955e+07 5.394462e+06 8.560589e+06 7.057736e+06 1.307963e+07 8.154355e+06 1.035736e+07 1.274920e+07 1.014448e+07 8.322635e+06 5.632313e+06 1.327425e+07 1.216379e+07 7.175597e+06 1.054783e+07 1.166442e+07 1.058438e+07 1.267182e+07 1.539730e+07 9.302796e+06 8.889361e+06 8.607611e+06 1.379934e+07 1.382900e+07 1.009644e+07 6.644022e+06 6.455564e+06 8.512321e+06 1.392898e+07 1.116277e+07 1.120724e+07 7.678887e+06 4.210551e+06 8.918465e+06 1.674817e+07 9.126756e+06 7.719092e+06 9.967823e+06 1.383438e+07 1.023334e+07 9.432208e+06 1.006084e+07 1.057136e+07 1.016159e+07 9.225522e+06 1.266933e+07 3.315036e+06 9.128379e+06 1.378861e+07 1.134359e+07 7.143856e+06 1.101133e+07 8.696393e+06 7.631560e+06 1.502190e+07 1.134279e+07 1.380686e+07 1.176957e+07 7.442010e+06 9.345847e+06 7.177984e+06 1.303449e+07 1.175559e+07 1.101276e+07 1.176991e+07 1.310189e+07 6.745987e+06 1.374720e+07 1.269502e+07 8.376778e+06 8.363142e+06 1.166742e+07 8.707518e+06 1.372195e+07 1.209196e+07 8.911838e+06 1.254959e+07 9.650725e+06 1.593037e+07 1.022366e+07 1.647234e+07 1.548190e+07 9.652506e+06 8.301744e+06 1.127319e+07 1.008249e+07 1.009704e+07 1.177008e+07 2.200802e+07 9.234761e+06 1.148227e+07 1.034498e+07 1.819148e+07 9.904198e+06 8.159969e+06 1.340974e+07 8.423399e+06 6.194744e+06 1.525610e+07 9.417886e+06 1.252448e+07 9.952075e+06 1.057657e+07 9.016629e+06 1.060230e+07 2.233487e+07 1.240104e+07 1.512646e+07 1.022099e+07 1.511940e+07 1.046742e+07 4.806216e+06 1.166624e+07 1.805785e+07 INOSINE 3.617048e+05 5.845776e+05 5.930433e+05 8.184672e+05 1.774460e+05 5.514012e+05 7.255060e+05 7.636551e+05 123695.86 5.536722e+05 6.546939e+05 8.718614e+05 114498.42 6.176577e+05 5.542922e+05 6.988098e+05 1.272234e+05 5.784455e+05 7.207247e+05 7.054638e+05 1.458786e+05 5.248164e+05 7.831470e+05 6.922741e+05 22062.941 5.191581e+05 7.349515e+05 6.033059e+05 4.756588e+04 6.805749e+05 6.548686e+05 7.315564e+05 81446.90 6.240478e+05 7.975791e+05 6.630810e+05 1.186229e+05 5.253251e+05 5.578179e+05 6.785082e+05 7.861404e+04 7.098870e+05 6.517379e+05 8.615815e+05 9.639095e+04 6.184604e+05 5.376755e+05 6.867949e+05 1.029045e+06 1.618946e+05 2.247484e+05 8.958390e+05 3.374936e+05 3.311729e+05 8.141381e+05 1.952845e+05 4.794340e+05 2.151529e+05 1.944584e+05 1.905966e+06 5.052260e+05 1.647140e+05 3.486615e+05 2.097048e+05 1.084832e+06 9.143643e+05 1.772034e+05 7.410155e+05 1.719054e+05 5.238332e+05 2.243229e+06 2.158039e+05 3.975488e+05 2.126187e+06 2.170886e+05 1.705795e+06 1.817309e+05 1.627086e+06 4.795942e+06 7.519560e+05 1.458913e+05 1.982962e+06 1.078181e+06 8.217249e+05 7.668435e+05 1.230441e+06 9.952147e+05 7.426316e+05 5.461790e+05 6.851755e+05 5.871307e+05 3.477971e+06 5.064272e+05 5.096747e+05 2.514527e+05 2.397104e+06 2.505904e+06 3.182458e+05 5.719637e+06 1.026226e+06 2.763225e+05 2.123690e+06 2.198707e+05 2.810878e+06 7.374866e+05 2.760825e+05 1.631111e+06 2.272036e+05 3.479506e+05 7.014317e+05 5.718758e+05 2.914659e+05 9.034123e+05 2.775623e+06 8.309293e+06 3.325044e+05 2.690062e+05 8.199114e+05 2.099480e+05 1.988259e+05 1.894413e+05 3.384194e+05 2.190282e+05 1.709123e+05 7.167946e+05 2.493557e+05 1.667996e+05 3.508397e+05 1.965802e+05 2.384281e+05 2.939908e+05 6.211319e+06 1.583729e+05 2.692131e+05 1.611196e+05 1.672107e+05 1.645876e+05 1.844865e+05 3.544724e+05 1.724785e+05 2.523282e+05 5.319655e+05 1.576766e+05 5.347579e+05 4.540835e+05 4.202622e+05 2.523941e+05 1.742572e+05 3.087147e+06 1.661163e+05 2.256162e+05 1.531771e+05 1.693596e+05 2.513247e+06 1.093671e+06 7.330747e+05 1.611692e+05 1.935081e+05 1.219706e+06 6.956211e+05 8.304080e+05 1.853428e+06 8.522780e+05 3.639779e+05 1.612359e+05 9.957177e+05 1.271587e+06 1.188225e+06 1.146162e+06 1.384955e+06 2.445103e+05 1.170311e+06 4.253340e+05 1.228111e+06 1.037936e+06 2.720769e+06 3.086695e+05 1.695765e+06 2.475519e+05 2.984594e+06 2.117956e+06 3.072205e+06 1.744796e+05 2.646849e+05 2.558815e+06 3.712763e+05 1.813386e+05 1.621688e+05 1.497894e+05 1.534146e+05 1.937584e+05 1.480155e+06 1.571817e+05 1.776995e+05 7.471049e+05 2.654951e+05 3.219013e+05 8.258456e+05 1.626815e+05 1.626335e+05 1.360083e+05 1.632533e+05 1.796394e+05 3.977685e+05 2.076259e+05 8.871563e+05 1.668235e+05 1.233492e+06 1.591602e+05 2.430198e+05 5.700935e+05 1.842600e+05 1.720448e+05 1.756832e+05 2.030130e+06 1.807360e+05 1.613083e+05 1.403968e+05 4.378160e+06 1.839135e+05 1.457162e+05 2.418090e+05 1.772144e+05 1.459592e+05 2.376266e+05 1.377266e+05 1.743736e+05 4.121776e+06 1.865218e+05 1.808898e+05 3.910026e+05 1.685939e+05 3.020947e+05 1.736832e+05 1.698771e+05 3.440905e+05 2.065184e+05 1.228691e+06 1.730057e+05 2.782395e+05 1.920500e+05 2.157695e+05 1.727672e+05 1.987684e+05 2.385933e+05 5.854393e+05 2.731979e+05 1.098592e+06 1.670753e+05 1.454288e+05 1.392299e+05 1.720275e+05 1.512987e+05 4.007293e+05 1.792162e+05 1.718720e+05 3.961023e+05 4.094810e+05 3.875936e+06 3.921990e+06 2.512095e+05 1.795976e+05 319.16011_5.33 3.909129e+06 1.919824e+06 1.742201e+06 1.978184e+06 1.677781e+05 1.408826e+06 2.112469e+06 2.163735e+06 107538.46 1.869581e+06 1.947832e+06 2.004763e+06 97370.74 1.714179e+06 1.707546e+06 1.965519e+06 1.018271e+05 1.768599e+06 2.018388e+06 1.943495e+06 1.063777e+05 1.823147e+06 2.021002e+06 1.875955e+06 17857.347 1.723705e+06 1.640734e+06 1.913971e+06 4.212686e+04 2.113987e+06 1.848848e+06 1.912804e+06 73945.68 1.959046e+06 1.761278e+06 1.798814e+06 1.006817e+05 1.836451e+06 2.077776e+06 1.945424e+06 6.816992e+04 1.806083e+06 1.950708e+06 1.985586e+06 8.747796e+04 1.821163e+06 1.446654e+06 2.195154e+06 1.598669e+06 2.230229e+06 1.686222e+06 1.984350e+06 2.328036e+06 1.939280e+06 1.850724e+06 2.376093e+06 1.617066e+06 2.371518e+06 3.258974e+06 2.046771e+06 1.494261e+06 2.256181e+06 2.166251e+06 3.263137e+06 1.568439e+06 1.314309e+06 2.348953e+06 1.510846e+06 1.795514e+06 2.370493e+06 2.411135e+06 2.645542e+06 2.131698e+06 1.518535e+06 1.941531e+06 1.534859e+06 1.910527e+06 2.025977e+06 2.413228e+06 2.241980e+06 1.762524e+06 1.870239e+06 1.193728e+06 2.635333e+06 1.623672e+06 1.888134e+06 1.086515e+06 9.922690e+05 1.653344e+06 1.323762e+06 1.892049e+06 1.383281e+06 1.274482e+06 1.903562e+06 2.217317e+06 1.881849e+06 1.890693e+06 2.242800e+06 1.427942e+06 1.646626e+06 1.413320e+06 1.325508e+06 2.187092e+06 1.270732e+06 1.303294e+06 1.564219e+06 1.563865e+06 1.749843e+06 1.929199e+06 1.820752e+06 1.514779e+06 2.100573e+06 3.405243e+06 1.504559e+06 1.645738e+06 1.775548e+06 1.810768e+06 1.677762e+06 1.443497e+06 1.867626e+06 1.578604e+06 9.354666e+05 9.345067e+05 1.174350e+06 1.521197e+06 1.860337e+06 1.997813e+06 1.400059e+06 1.546332e+06 1.265619e+06 1.641231e+06 2.566176e+06 1.908251e+06 2.414830e+06 2.299108e+06 2.040113e+06 1.687574e+06 2.302203e+06 2.337728e+06 1.624715e+06 2.084142e+06 1.853458e+06 2.039014e+06 1.983268e+06 2.193722e+06 1.774310e+06 1.304451e+06 2.444113e+06 1.748175e+06 1.392800e+06 1.767755e+06 1.561458e+06 1.581848e+06 1.773713e+06 1.509935e+06 1.874936e+06 1.640050e+06 1.438349e+06 1.132930e+06 1.865996e+06 2.041108e+06 1.455448e+06 1.607237e+06 2.022311e+06 1.664292e+06 1.827882e+06 2.176185e+06 1.793749e+06 1.262791e+06 1.487923e+06 2.195853e+06 2.264398e+06 1.481875e+06 1.517622e+06 1.272892e+06 2.711463e+06 2.537562e+06 1.391706e+06 1.959645e+06 1.252619e+06 8.247636e+05 1.496756e+06 2.111922e+06 1.651708e+06 1.103943e+06 1.646728e+06 2.059120e+06 1.465323e+06 2.226845e+06 1.963960e+06 2.080959e+06 1.978573e+06 1.697498e+06 2.211883e+06 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6.259949e+05 2.197373e+06 8.190197e+05 8.814263e+05 5.304873e+05 8.548278e+05 3.248208e+05 1.363918e+06 1.463317e+06 3.437608e+05 3.676648e+05 1.613961e+06 1.216065e+06 1.818275e+06 1.323439e+06 7.941805e+05 1.006904e+06 7.019699e+05 3.283152e+06 2.372381e+06 1.190742e+06 2.069211e+06 6.029903e+05 1.089077e+06 6.412749e+05 9.278350e+05 5.936266e+05 9.874721e+05 2.876846e+06 1.106573e+06 6.367062e+05 5.156214e+05 1.074949e+06 9.680805e+05 6.517218e+05 1.063231e+06 5.804886e+05 8.555390e+05 1.070351e+06 9.874277e+05 1.518223e+06 1.091838e+06 7.910805e+05 8.428545e+05 1.103487e+06 1.402290e+06 1.761449e+06 1.048224e+06 1.483120e+06 1.704845e+06 2.317234e+06 2.079169e+05 2.143931e+06 2.008645e+06 C11 H7 N4 O2 P_5.349 9.903094e+06 2.636049e+06 2.568259e+06 2.600339e+06 2.704241e+05 2.438237e+06 3.981893e+06 3.127599e+06 126575.79 2.440161e+06 3.730797e+06 1.913527e+06 236695.54 2.873229e+06 2.524009e+06 3.105279e+06 2.090652e+05 2.952489e+06 2.906057e+06 2.486743e+06 5.890650e+05 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5.512159e+08 1.888796e+08 8.087569e+07 2.139913e+08 1.048917e+08 1.315244e+08 3.637599e+08 3.185494e+08 C20 H48 N8 O17_5.375 4.747138e+06 6.947835e+05 5.124247e+05 9.335203e+05 2.253423e+05 5.340504e+05 7.264297e+05 7.181465e+05 134890.73 6.568531e+05 7.696027e+05 7.966611e+05 130521.27 6.527352e+05 6.725315e+05 5.586478e+05 1.217714e+05 5.991985e+05 6.894623e+05 7.033709e+05 1.039371e+05 8.914110e+05 6.528743e+05 8.998526e+05 17427.348 5.246474e+05 5.657620e+05 6.835255e+05 3.924393e+04 6.539441e+05 8.480616e+05 4.887784e+05 123883.25 7.272791e+05 6.402640e+05 8.637240e+05 1.110239e+05 8.063892e+05 7.035633e+05 5.573873e+05 9.916588e+04 6.062812e+05 6.446597e+05 6.237972e+05 1.147443e+05 8.047322e+05 7.165536e+05 6.952701e+05 4.140283e+05 4.171882e+05 3.507564e+05 2.413825e+05 5.669733e+05 1.738415e+06 4.202785e+05 1.566201e+06 1.745052e+06 2.031677e+06 3.080439e+06 8.865775e+05 9.643486e+05 5.290402e+05 3.598518e+05 2.384729e+05 7.905030e+05 2.418200e+05 5.034325e+05 7.829491e+05 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7.333661e+05 8.895811e+05 2.386459e+06 4.673828e+05 3.006341e+05 7.420439e+05 4.336718e+05 5.460373e+05 1.678144e+07 8.609586e+05 6.039222e+05 7.825572e+05 5.221877e+05 9.376192e+05 9.092435e+05 1.207253e+05 4.263932e+05 1.087608e+06 3.268848e+05 2.259666e+05 9.097496e+05 1.052890e+06 9.973491e+05 1.125225e+06 1.051255e+06 9.008579e+05 8.041887e+05 5.255854e+05 6.674287e+05 2.374909e+05 6.571549e+05 4.609052e+05 6.330160e+05 2.824651e+05 7.427401e+05 4.117844e+05 3.523023e+05 5.459867e+05 7.801988e+05 6.423838e+05 7.420058e+05 7.333670e+05 1.171325e+06 5.491824e+05 3.318829e+05 1.552031e+05 5.644585e+05 3.473966e+05 1.190383e+06 1.152535e+06 5.762652e+05 6.895230e+05 5.036637e+05 9.929232e+05 3.695016e+05 5.271795e+05 5.376545e+05 3.185824e+05 9.043909e+05 3.451329e+05 1.155854e+06 3.322326e+05 9.544867e+05 1.536103e+06 4.898727e+05 5.498168e+05 2.300221e+05 3.449741e+05 2.482075e+05 2.097479e+05 4.304005e+05 5.726863e+05 C37 H39 N O S2_5.379 4.721036e+06 2.218605e+06 3.066185e+06 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3.555950e+06 4.687837e+06 4.954218e+06 57551.70 3.352204e+06 3.802637e+06 5.026218e+06 5.599585e+04 3.774781e+06 3.852489e+06 5.022217e+06 5.526908e+04 3.603201e+06 4.071245e+06 5.789098e+06 8387.881 3.403843e+06 4.645137e+06 4.122986e+06 1.564494e+04 2.714542e+06 4.709560e+06 5.017409e+06 38430.41 4.121285e+06 4.362978e+06 4.385952e+06 4.798241e+04 3.090457e+06 4.762532e+06 5.042450e+06 3.365707e+04 3.907604e+06 3.775596e+06 4.635713e+06 3.715073e+04 4.189560e+06 3.871168e+06 4.510148e+06 2.065584e+06 6.328781e+06 2.805561e+06 4.851116e+06 3.482399e+06 3.876338e+06 4.279254e+06 6.491356e+06 9.686973e+06 9.212468e+06 6.727943e+06 4.141878e+06 5.960021e+06 7.054876e+06 4.831100e+06 8.611710e+06 3.482173e+06 1.661138e+06 5.206366e+06 1.584275e+06 4.411360e+06 4.963872e+06 4.927472e+06 5.121113e+06 4.497234e+06 4.960048e+06 6.998688e+06 5.999421e+06 2.396533e+06 4.550142e+06 6.912522e+06 8.701751e+06 2.615884e+06 1.385784e+06 1.051600e+06 3.241373e+06 5.768467e+06 6.654031e+06 4.421020e+06 2.012289e+06 2.742534e+06 6.132588e+06 2.331446e+06 3.643440e+06 5.845019e+06 4.734581e+06 4.756563e+06 5.216625e+06 3.080037e+06 3.276490e+06 3.541499e+06 3.808055e+06 3.291042e+06 7.874297e+06 3.386662e+06 6.615237e+06 1.553234e+06 4.047462e+06 2.716468e+06 3.051765e+06 4.095857e+06 4.459516e+06 2.427451e+06 4.105762e+06 4.270745e+06 3.604671e+06 3.142098e+06 2.958060e+06 5.399739e+06 5.388162e+06 4.895442e+06 7.069645e+06 2.719240e+06 2.582337e+06 1.432592e+06 7.215313e+06 3.486685e+06 6.465874e+06 5.141100e+06 2.578068e+06 4.579280e+06 1.962063e+06 7.219108e+06 7.574503e+06 3.810746e+06 4.551167e+06 5.731990e+06 2.827817e+06 2.425997e+06 6.293094e+06 6.367258e+06 5.981466e+06 4.146338e+06 3.435514e+06 5.202953e+06 3.378054e+06 7.973906e+06 5.565062e+06 3.519897e+06 5.450246e+06 4.811197e+06 1.965940e+06 4.424300e+06 3.068498e+06 4.940527e+06 2.703585e+06 5.837929e+06 5.794201e+06 4.025231e+06 3.507227e+06 2.111596e+06 6.723511e+06 4.450781e+06 2.469174e+06 5.373734e+06 2.912723e+06 3.737638e+06 6.215927e+06 7.915067e+06 3.017378e+06 4.992608e+06 3.259342e+06 3.897288e+06 4.580047e+06 4.149250e+06 1.617784e+06 3.840776e+06 1.524514e+06 5.650647e+06 5.748171e+06 2.818484e+06 2.691171e+06 1.281713e+06 4.531428e+06 5.939259e+06 3.213167e+06 2.757798e+06 3.950250e+06 6.343930e+06 1.441713e+06 2.119189e+06 3.008176e+06 3.808584e+06 3.174085e+06 2.749344e+06 3.803037e+06 5.928416e+05 2.543186e+06 6.432453e+06 4.612838e+06 3.917686e+06 3.102547e+06 2.558654e+06 2.456302e+06 4.117601e+06 3.423816e+06 4.713308e+06 5.739391e+06 3.146815e+06 4.545150e+06 2.706529e+06 5.336505e+06 1.885723e+06 4.103522e+06 2.092116e+06 3.914031e+06 1.557131e+06 3.903527e+06 4.344054e+06 1.584655e+06 2.335356e+06 4.834728e+06 6.105442e+06 5.427803e+06 4.625088e+06 3.985093e+06 3.778201e+06 3.323191e+06 1.013733e+07 5.782051e+06 3.772459e+06 7.462413e+06 2.886601e+06 3.113675e+06 3.658379e+06 3.321587e+06 2.123556e+06 5.331251e+06 8.919011e+06 4.347406e+06 2.753618e+06 2.299012e+06 5.297923e+06 3.010405e+06 1.986981e+06 4.617828e+06 1.759539e+06 2.065626e+06 5.346046e+06 2.555639e+06 3.704570e+06 2.435954e+06 2.980945e+06 2.256435e+06 2.732810e+06 4.900912e+06 7.042131e+06 3.770037e+06 3.043636e+06 4.675999e+06 7.672539e+06 1.740448e+06 8.706691e+06 8.220280e+06 C25 H50 N O7 P_5.384 4.475453e+06 1.210886e+06 1.428900e+06 1.399933e+06 2.006768e+05 1.045836e+06 1.756442e+06 1.460311e+06 123615.63 1.352553e+06 1.476436e+06 1.493835e+06 133561.66 1.290112e+06 1.433578e+06 1.410801e+06 1.448146e+05 1.179441e+06 1.355294e+06 1.389363e+06 1.363939e+05 1.150410e+06 1.412515e+06 1.934017e+06 17868.613 1.050588e+06 1.632705e+06 1.205928e+06 3.229184e+04 1.365031e+06 1.375927e+06 1.313873e+06 86288.20 1.397128e+06 1.487992e+06 1.391771e+06 1.130514e+05 1.227059e+06 1.585321e+06 1.140639e+06 8.179152e+04 1.405735e+06 1.360869e+06 1.719991e+06 9.901454e+04 1.333967e+06 1.270913e+06 1.381487e+06 1.496312e+06 1.158121e+06 6.066100e+05 1.730876e+06 1.086228e+06 2.018917e+06 1.996414e+06 2.475921e+06 1.386469e+06 2.424200e+06 3.533421e+06 1.338306e+06 3.919369e+06 3.047654e+06 1.138154e+06 1.939068e+06 2.035133e+06 8.558242e+05 1.811710e+06 9.239835e+05 1.339859e+06 1.038584e+06 1.608136e+06 2.091616e+06 2.214713e+06 1.714052e+06 1.620751e+06 1.006038e+06 2.555887e+06 1.691419e+06 2.754428e+06 1.702558e+06 9.713291e+05 6.135205e+05 4.910973e+05 1.039257e+06 1.507133e+06 1.203114e+06 2.067693e+06 4.441635e+05 1.889864e+06 9.071584e+05 1.099614e+06 1.136734e+06 6.056226e+05 8.535981e+05 9.125851e+05 2.210688e+06 8.258503e+05 1.754076e+06 1.226852e+06 1.331280e+06 2.676338e+06 1.414867e+06 8.183675e+05 1.038016e+06 6.769612e+05 8.009729e+05 6.514957e+05 9.614526e+05 2.044316e+06 1.084621e+06 3.527022e+05 1.906318e+06 2.650204e+06 1.068169e+06 1.238392e+06 7.050380e+05 1.153944e+06 9.640968e+05 1.542784e+06 1.624394e+06 4.642615e+05 3.687716e+05 2.046718e+05 1.307947e+06 1.062397e+06 1.159851e+06 1.195579e+06 6.723875e+05 1.356553e+06 1.261241e+06 1.468003e+06 2.869514e+06 6.581086e+05 1.179621e+06 1.479392e+06 1.059942e+06 1.641441e+06 1.675655e+06 8.303999e+05 1.659152e+06 1.394818e+06 1.185119e+06 1.253340e+06 8.345179e+05 2.446406e+06 2.196511e+06 1.170899e+06 1.428575e+06 1.055306e+06 7.119700e+05 1.364723e+06 4.166103e+05 1.890024e+06 1.929689e+06 1.527284e+06 1.095187e+06 1.510641e+06 9.588048e+05 6.417100e+05 1.437965e+06 1.169666e+06 9.616062e+05 1.114857e+06 1.630502e+06 8.795033e+05 1.815603e+06 1.500127e+06 1.922415e+06 1.065762e+06 9.549962e+05 2.747428e+06 1.707754e+06 1.393936e+06 6.477768e+05 1.158636e+06 1.744821e+06 1.452085e+06 1.678587e+06 1.216293e+06 1.516266e+06 6.663479e+05 1.648322e+06 2.772524e+06 1.223841e+06 1.278722e+06 1.534755e+06 1.195407e+06 2.164835e+06 9.571587e+05 9.956298e+05 8.667506e+05 2.372885e+06 8.348434e+05 1.655144e+06 3.180126e+05 2.953955e+06 2.412904e+06 3.122021e+06 1.395640e+06 1.971594e+06 9.072201e+05 1.116859e+06 2.274244e+06 1.960752e+06 2.640337e+06 1.507930e+06 8.662548e+05 8.278030e+05 1.295897e+06 1.715328e+06 2.174709e+06 1.654217e+06 1.186258e+06 1.973858e+06 6.728712e+05 1.569823e+06 1.710832e+06 8.279705e+05 1.186706e+06 1.812994e+06 1.893542e+06 1.070342e+06 1.115581e+06 1.449183e+06 1.461688e+06 1.252490e+06 2.175092e+06 2.005270e+06 2.799322e+06 1.623042e+06 1.146629e+06 8.817941e+05 5.692884e+05 1.529986e+06 8.502798e+05 9.857681e+05 3.427822e+06 1.255462e+06 1.750533e+06 1.841108e+06 3.630915e+06 1.460575e+06 1.079966e+06 2.762260e+06 8.090226e+05 1.024405e+06 2.066429e+06 1.366501e+06 1.876895e+06 2.020251e+06 1.206915e+06 6.175503e+05 1.550447e+06 2.634991e+06 1.513860e+06 2.225304e+06 9.992305e+05 1.869937e+06 1.774213e+06 5.482767e+05 1.184483e+06 2.161574e+06 C5 H13 N O_5.385 3.737832e+07 1.446620e+07 8.407760e+06 1.614418e+07 4.044481e+05 4.110489e+06 1.817714e+07 1.292058e+07 237512.58 1.274631e+07 1.319036e+07 1.035692e+07 448559.22 1.150096e+07 1.377361e+07 1.451765e+07 2.230528e+05 7.862651e+06 1.199874e+07 1.708886e+07 5.260296e+05 1.144468e+07 1.233911e+07 1.302043e+07 305637.585 5.621089e+06 1.592675e+07 1.692487e+07 5.020943e+05 1.236889e+07 5.596749e+06 1.440929e+07 140045.91 1.464578e+07 6.561543e+06 1.556823e+07 2.736389e+05 1.359415e+07 1.744879e+07 6.048242e+06 4.114549e+05 1.310400e+07 1.613965e+07 1.108639e+07 3.227708e+06 4.618766e+06 1.624753e+07 1.321392e+07 1.538551e+07 1.147951e+07 1.357676e+07 1.668321e+07 1.260817e+07 1.403531e+07 1.301936e+07 6.975861e+06 1.213467e+07 9.144861e+06 1.168649e+07 1.613138e+07 1.598581e+07 7.386820e+06 1.801604e+07 2.046963e+07 4.154907e+06 1.144272e+07 1.324056e+07 1.497011e+07 1.563574e+07 1.433808e+07 1.399388e+07 1.363503e+07 1.533854e+07 1.038256e+07 1.430643e+07 1.435711e+07 7.242917e+06 1.264638e+07 1.010343e+07 1.610442e+07 1.399461e+07 4.573680e+06 1.735942e+07 1.210099e+07 1.159651e+07 1.532199e+07 1.503285e+07 1.022154e+07 1.172549e+07 1.246203e+07 1.589875e+07 1.255633e+07 7.674071e+06 1.265318e+07 1.172162e+07 9.141199e+06 1.846447e+07 1.676716e+07 8.439924e+06 1.002314e+07 1.283300e+07 1.420837e+07 1.353978e+07 1.322073e+07 1.448391e+07 1.349500e+07 1.372895e+07 1.581734e+07 1.340941e+07 9.509756e+06 1.286354e+07 5.977689e+06 1.614164e+07 1.630109e+07 1.273161e+07 1.782487e+07 1.031338e+07 1.552392e+07 1.437463e+07 1.340156e+07 6.987042e+06 2.133938e+07 1.581173e+07 1.241793e+07 1.082208e+07 1.790888e+07 2.076834e+07 1.350750e+07 1.298303e+07 1.195745e+07 1.095213e+07 1.872181e+07 2.120753e+07 1.407515e+07 1.481588e+07 1.601901e+07 7.847206e+06 1.108430e+07 1.607307e+07 1.298642e+07 1.508512e+07 1.251273e+07 1.055995e+07 1.413334e+07 1.926602e+07 1.345596e+07 1.769890e+07 5.788739e+06 1.266294e+07 1.201204e+07 1.179153e+07 1.344695e+07 7.357938e+06 1.489081e+07 1.331940e+07 1.557047e+07 1.455907e+07 1.377085e+07 1.153133e+07 1.231702e+07 1.486314e+07 7.812416e+06 1.581750e+07 1.622461e+07 1.435660e+07 1.410253e+07 1.059469e+07 2.095514e+07 8.203835e+06 1.473720e+07 1.218429e+07 1.408615e+07 1.166600e+07 1.214694e+07 1.026864e+07 1.327830e+07 1.560466e+07 1.508247e+07 1.157164e+07 1.219859e+07 4.512213e+06 1.335767e+07 1.224200e+07 9.889376e+06 1.554379e+07 1.482044e+07 1.920559e+07 1.531579e+07 1.396359e+07 1.517472e+07 1.255511e+07 1.213953e+07 1.149634e+07 1.585284e+07 4.389178e+06 1.274223e+07 1.024558e+07 1.417014e+07 1.342871e+07 1.274469e+07 1.228928e+07 1.156191e+07 1.551990e+07 1.042514e+07 1.522680e+07 7.921509e+06 6.743172e+06 1.434788e+07 1.628306e+07 5.941609e+06 1.325484e+07 1.082209e+07 1.319041e+07 1.448127e+07 1.311188e+07 8.421849e+06 1.618643e+07 2.498946e+07 1.306790e+07 1.209464e+07 1.193047e+07 1.132779e+07 1.449257e+07 1.901022e+07 1.202421e+07 1.098406e+07 1.684203e+07 2.054383e+07 1.439235e+07 1.747828e+07 1.480146e+07 1.704842e+07 1.407103e+07 1.288480e+07 1.415431e+07 1.607926e+07 1.835323e+07 1.114452e+07 1.023665e+07 1.607203e+07 1.165469e+07 1.429339e+07 1.075936e+07 1.047687e+07 1.362104e+07 1.334458e+07 9.113799e+06 1.579602e+07 1.095200e+07 1.303671e+07 9.820964e+06 1.549233e+07 1.878672e+07 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4.981137e+06 7.337539e+06 1.993596e+06 7.442832e+06 6.905884e+06 C51 H91 N8 O9 P_5.397 2.159597e+07 5.067139e+06 5.945227e+06 6.105117e+06 1.571129e+05 5.478183e+06 5.116793e+06 8.197237e+06 86333.35 5.233300e+06 6.212025e+06 7.331826e+06 87747.34 5.301186e+06 5.853296e+06 4.773467e+06 9.768125e+04 5.623533e+06 5.377923e+06 6.762707e+06 9.596536e+04 5.720610e+06 5.496956e+06 9.114450e+06 13190.232 3.150912e+06 6.522530e+06 5.040634e+06 2.144534e+04 6.278405e+06 6.497099e+06 7.381660e+06 58283.05 4.895390e+06 5.268580e+06 6.233534e+06 7.953204e+04 5.761866e+06 4.891677e+06 6.556958e+06 5.201577e+04 5.288248e+06 6.905367e+06 6.540927e+06 5.990986e+04 5.745591e+06 5.300865e+06 6.093284e+06 4.112932e+06 6.587248e+06 4.380660e+06 7.274374e+06 6.116906e+06 4.310388e+06 8.454562e+06 1.276526e+07 7.622298e+06 1.648759e+07 3.047987e+07 3.930621e+06 8.213073e+06 1.014539e+07 9.957624e+06 1.165645e+07 7.616948e+06 2.953678e+06 8.409532e+06 4.633076e+06 6.226631e+06 8.874017e+06 8.797109e+06 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4.321887e+06 9.348985e+06 2.795895e+06 1.278561e+07 1.196822e+07 1.652140e+07 4.274667e+06 5.832428e+06 6.496796e+06 4.097235e+06 6.444729e+06 9.185188e+06 6.486613e+06 8.928331e+06 6.811049e+06 2.204416e+07 5.188387e+06 4.365186e+06 7.061759e+06 3.011655e+06 2.729648e+06 1.300195e+07 5.875594e+06 8.210417e+06 5.584007e+06 7.388449e+06 5.744618e+06 6.253523e+06 1.462132e+07 6.145445e+06 1.865244e+07 6.087276e+06 6.529629e+06 6.353942e+06 9.353676e+05 4.911594e+06 1.403608e+07 374.16749_5.397 6.712322e+06 3.012833e+06 3.562737e+06 4.245497e+06 2.133702e+05 2.984291e+06 5.285692e+06 4.124346e+06 148784.83 3.938231e+06 3.444235e+06 3.537703e+06 149372.04 3.000751e+06 3.456450e+06 4.210662e+06 1.239072e+05 3.924483e+06 4.077150e+06 3.661365e+06 1.194751e+05 4.460103e+06 3.316147e+06 3.714991e+06 19205.738 3.352633e+06 3.973054e+06 4.325580e+06 3.315038e+04 2.847434e+06 3.818210e+06 4.075732e+06 70981.90 3.910166e+06 3.707715e+06 3.820590e+06 8.854964e+04 3.513967e+06 4.235028e+06 3.582810e+06 6.896527e+04 3.804392e+06 3.177078e+06 4.664249e+06 9.717781e+04 3.570477e+06 3.994446e+06 3.396923e+06 4.332737e+06 5.072842e+06 2.954857e+06 3.476839e+06 3.308389e+06 3.666275e+06 3.052510e+06 5.047372e+06 4.957719e+06 3.259377e+06 2.087504e+06 3.559517e+06 2.903392e+06 3.980397e+06 3.884703e+06 3.525635e+06 2.375675e+06 2.612904e+06 3.549990e+06 3.335565e+06 4.126372e+06 3.868799e+06 3.451559e+06 3.262702e+06 3.633237e+06 4.758509e+06 4.935846e+06 4.706251e+06 2.305754e+06 3.105732e+06 2.766239e+06 4.130320e+06 3.322254e+06 2.654707e+06 2.118317e+06 3.227217e+06 3.221932e+06 4.029035e+06 3.967533e+06 4.390838e+06 2.738304e+06 4.124648e+06 2.736777e+06 3.513718e+06 4.719464e+06 4.318143e+06 4.169854e+06 3.456722e+06 3.147824e+06 2.975009e+06 4.173326e+06 3.618695e+06 4.392185e+06 5.148702e+06 4.298123e+06 4.502177e+06 4.214559e+06 3.832550e+06 4.215938e+06 4.207600e+06 4.489551e+06 3.942208e+06 3.253272e+06 3.650310e+06 3.292335e+06 3.681846e+06 5.123959e+06 4.675910e+06 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9.490252e+08 9.672573e+08 357254.69 8.270776e+08 8.109152e+08 8.654114e+08 356055.85 8.676886e+08 7.821587e+08 8.490394e+08 3.638738e+05 8.558085e+08 7.697845e+08 8.612516e+08 3.661084e+05 8.074187e+08 8.594414e+08 1.042201e+09 53400.445 6.930843e+08 8.086011e+08 8.563702e+08 9.224857e+04 7.724744e+08 8.514526e+08 1.007801e+09 220303.27 7.864283e+08 8.015126e+08 9.200058e+08 2.962852e+05 7.379307e+08 8.111053e+08 8.548852e+08 2.157305e+05 8.109066e+08 8.613447e+08 8.961468e+08 2.605154e+05 8.545663e+08 7.915491e+08 8.529196e+08 6.793875e+08 8.604805e+08 7.143526e+08 9.810507e+08 9.063729e+08 6.559613e+08 9.773782e+08 1.286277e+09 1.071931e+09 1.369750e+09 1.921497e+09 7.477993e+08 9.558653e+08 1.080401e+09 1.325206e+09 1.210592e+09 9.556685e+08 5.491413e+08 1.029972e+09 6.691899e+08 8.268419e+08 1.015479e+09 9.974592e+08 1.040106e+09 9.906990e+08 8.630929e+08 9.395673e+08 6.844436e+08 8.574418e+08 1.248691e+09 1.687536e+09 9.557451e+08 9.852195e+08 6.316680e+08 4.936516e+08 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1.699418e+08 9.183886e+07 8.346774e+07 5.896776e+07 5.374716e+07 1.966645e+07 2.266945e+07 9.800145e+07 2.240184e+07 1.605777e+08 9.294851e+07 3.756820e+07 1.067787e+08 7.936231e+07 1.068404e+08 3.426915e+07 1.232331e+08 3.413818e+07 4.261555e+07 9.901167e+07 7.857883e+07 1.274014e+08 1.111365e+08 2.006636e+07 1.044751e+08 1.718080e+07 1.303502e+08 8.442426e+07 3.793265e+07 7.667612e+07 7.843672e+07 8.388498e+07 7.361915e+07 6.373562e+07 5.099914e+07 1.001976e+08 1.129256e+08 1.469357e+08 3.404587e+07 7.195633e+07 7.343517e+07 7.266273e+07 2.311914e+07 2.437550e+07 9.219854e+07 8.896584e+07 1.227183e+08 2.412649e+07 8.856247e+07 7.921931e+07 2.883726e+07 6.452924e+07 3.117040e+07 2.501406e+07 1.051039e+08 7.665994e+07 5.478250e+07 2.337811e+07 9.876023e+07 1.137169e+08 2.730885e+07 4.535119e+07 3.729923e+07 9.593401e+07 1.146646e+08 2.606848e+07 3.084854e+07 1.090809e+08 8.874121e+07 2.148350e+07 4.455942e+07 1.542637e+08 6.989563e+07 8.605414e+07 3.034041e+07 5.577477e+07 9.855865e+07 3.869605e+07 8.761882e+07 9.084710e+07 9.199248e+07 1.175967e+08 2.321508e+07 5.671760e+07 2.801502e+07 2.845246e+07 "(2S,3R,4E)-3-Hydroxy-2-(tricosanoylamino)-4-octadecen-1-yl 5-acetamido-6-[(1S,2R)-2-({5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl}oxy)-1,3-dihydroxypro pyl]-3,5-dideoxy-beta-L-threo-hex-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside_5.408" 9.266059e+06 2.675972e+06 3.527626e+06 3.023622e+06 1.412362e+05 3.214426e+06 3.880129e+06 3.993379e+06 97344.85 3.011024e+06 3.000519e+06 4.117750e+06 101143.72 2.816743e+06 3.004254e+06 3.423005e+06 9.864047e+04 3.006774e+06 3.385384e+06 3.490001e+06 1.004509e+05 3.207765e+06 3.290070e+06 4.148033e+06 14186.449 2.334249e+06 2.845766e+06 4.510136e+06 2.512390e+04 2.778062e+06 3.520248e+06 3.196988e+06 57884.11 3.398798e+06 3.150142e+06 3.409373e+06 8.765462e+04 2.743487e+06 3.367648e+06 3.813757e+06 5.906728e+04 2.903361e+06 3.252290e+06 3.555485e+06 7.418663e+04 3.590982e+06 2.982156e+06 3.317905e+06 2.716554e+06 3.146219e+06 2.638647e+06 4.020946e+06 4.274209e+06 3.116138e+06 4.158148e+06 4.847425e+06 2.725138e+06 4.287668e+06 1.022877e+07 3.049603e+06 3.870207e+06 3.642847e+06 4.018098e+06 3.726468e+06 3.843214e+06 2.259173e+06 4.211417e+06 2.710929e+06 2.895046e+06 4.118368e+06 3.938232e+06 4.075416e+06 4.100465e+06 2.851980e+06 3.329561e+06 2.251354e+06 3.969088e+06 6.274838e+06 6.450753e+06 2.964591e+06 4.648180e+06 2.697092e+06 1.912427e+06 4.387205e+06 2.808690e+06 2.799859e+06 2.285681e+06 1.449089e+06 4.442100e+06 3.180790e+06 3.830774e+06 1.849941e+06 2.120848e+06 2.737655e+06 3.925734e+06 3.324521e+06 3.316100e+06 4.242030e+06 1.755302e+06 3.648422e+06 2.260872e+06 1.374903e+06 3.151954e+06 3.053506e+06 1.903774e+06 2.839805e+06 1.327256e+06 2.087156e+06 3.619808e+06 3.417192e+06 2.368427e+06 3.332952e+06 3.811676e+06 2.605665e+06 2.247775e+06 1.519359e+06 3.339140e+06 1.573367e+06 2.022941e+06 2.935902e+06 1.584826e+06 1.829028e+06 1.318159e+06 1.641045e+06 2.402245e+06 2.696045e+06 2.553478e+06 3.017360e+06 3.235301e+06 4.630746e+06 4.998477e+06 5.961556e+06 2.587473e+06 4.798466e+06 4.422608e+06 3.006668e+06 4.160305e+06 2.715704e+06 3.193039e+06 3.155907e+06 4.301674e+06 2.689878e+06 3.953896e+06 3.207320e+06 3.140220e+06 2.819498e+06 2.214687e+06 3.298431e+06 1.899898e+06 1.836844e+06 2.957405e+06 1.910663e+06 3.004167e+06 3.267164e+06 2.167354e+06 3.324199e+06 2.657481e+06 3.147223e+06 1.931727e+06 3.351854e+06 3.427337e+06 3.199235e+06 2.997835e+06 3.936779e+06 3.623708e+06 3.155707e+06 3.130216e+06 4.120195e+06 2.247236e+06 4.228038e+06 4.596537e+06 3.527021e+06 2.174793e+06 2.788117e+06 2.562498e+06 4.278805e+06 3.725968e+06 3.254187e+06 4.507149e+06 1.931810e+06 6.371814e+05 1.982834e+06 5.287483e+06 3.218586e+06 1.983505e+06 3.676976e+06 3.508158e+06 3.658912e+06 4.432624e+06 3.529533e+06 2.815539e+06 2.840582e+06 2.062602e+06 5.200612e+06 1.299286e+05 4.202236e+06 4.284614e+06 3.764428e+06 3.176035e+06 3.607527e+06 5.411712e+06 2.359859e+06 5.389926e+06 3.497566e+06 6.977662e+06 3.047437e+06 1.312018e+06 2.872350e+06 2.783173e+06 2.437989e+06 4.327217e+06 4.616145e+06 5.477069e+06 4.804313e+06 2.639031e+06 3.889543e+06 2.040714e+06 2.735569e+06 2.916471e+06 2.837000e+06 3.211832e+06 4.574735e+06 4.227922e+06 2.196442e+06 4.456041e+06 2.513571e+06 3.278315e+06 1.050271e+06 5.493348e+06 4.038526e+06 6.056114e+06 2.635197e+06 3.724281e+06 4.010090e+06 2.985625e+06 3.717431e+06 3.507831e+06 3.014184e+06 4.680652e+06 4.143096e+06 7.347240e+06 3.212727e+06 2.808326e+06 3.751352e+06 2.333505e+06 2.324434e+06 5.787399e+06 3.744547e+06 3.937681e+06 4.479485e+06 4.317846e+06 3.822617e+06 3.758945e+06 6.404509e+06 2.411415e+06 6.024176e+06 3.306717e+06 3.700070e+06 2.567391e+06 6.186523e+05 1.727252e+06 4.740391e+06 294.1414_5.408 1.007611e+09 1.025658e+08 5.577230e+08 1.109193e+08 3.098567e+05 2.438992e+08 4.003149e+08 3.201757e+08 159679.65 3.513202e+08 2.949627e+08 2.883743e+08 160601.13 2.679320e+08 2.732457e+08 2.924633e+08 1.449895e+05 3.039587e+08 3.059296e+08 3.158725e+08 1.492179e+05 3.522586e+08 3.510521e+08 1.170543e+08 25292.742 3.062788e+08 3.245204e+08 3.318514e+08 4.091544e+04 2.625426e+08 3.100129e+08 3.427618e+08 90409.30 3.276956e+08 3.021534e+08 3.548193e+08 2.516456e+05 9.073463e+07 3.773257e+08 3.417846e+08 1.011849e+05 3.286758e+08 3.409894e+08 9.819503e+07 1.303485e+05 3.629786e+08 3.150863e+08 3.240374e+08 3.122680e+08 3.203942e+08 3.105543e+08 3.641190e+08 3.315349e+08 3.654812e+08 3.096026e+08 3.433547e+08 3.049848e+08 2.706540e+08 5.063696e+08 2.815165e+08 3.415302e+08 3.379512e+08 3.258501e+08 3.667092e+08 3.659741e+08 2.674148e+08 3.292777e+08 3.090054e+08 3.075708e+08 4.202149e+08 3.287777e+08 3.496678e+08 3.699404e+08 3.199236e+08 9.423238e+07 3.196612e+08 3.188331e+08 3.945068e+08 3.506123e+08 3.595920e+08 3.496995e+08 3.064559e+08 7.556836e+07 3.211330e+08 4.670540e+08 3.607931e+08 3.678515e+08 2.364446e+08 1.006527e+08 3.664485e+08 3.262155e+08 2.473704e+08 2.903304e+08 2.626360e+08 4.124622e+08 3.334500e+08 3.439293e+08 3.717533e+08 2.723978e+08 3.002792e+08 2.711628e+08 2.499841e+08 3.676875e+08 8.335269e+07 3.146766e+08 3.475269e+08 2.460778e+08 3.051179e+08 1.027166e+08 3.255944e+08 2.630275e+08 1.045334e+08 1.018222e+08 3.058960e+08 2.442203e+08 3.296604e+08 3.344462e+08 2.802734e+08 2.844443e+08 3.372749e+08 2.590571e+08 2.849931e+08 2.567857e+08 2.471268e+08 3.388814e+08 3.333417e+08 3.275190e+08 3.413801e+08 3.263785e+08 3.029367e+08 3.839762e+08 3.703548e+08 3.376352e+08 3.911209e+08 3.415727e+08 2.734915e+08 2.922508e+08 9.729196e+07 3.933470e+08 3.518084e+08 4.161447e+08 3.339259e+08 3.254423e+08 3.657525e+08 4.002948e+08 3.133912e+08 2.826788e+08 3.242749e+08 2.215249e+08 2.576564e+08 2.769247e+08 2.796616e+08 3.341660e+08 3.334408e+08 3.072405e+08 3.749949e+08 7.302384e+07 2.845887e+08 2.700836e+08 3.020878e+08 3.439501e+08 8.611413e+07 3.026093e+08 3.670737e+08 3.129251e+08 2.876212e+08 1.012543e+08 4.059110e+08 2.753008e+08 3.568247e+08 3.409501e+08 3.556158e+08 3.813052e+08 3.557226e+08 3.143481e+08 3.111719e+08 9.019278e+07 3.238977e+08 3.563502e+08 2.449525e+08 2.184191e+08 2.801910e+08 3.371889e+08 2.885791e+08 2.725884e+08 3.427000e+08 3.402024e+08 8.779409e+07 3.318746e+08 3.272381e+08 2.863982e+08 2.624957e+08 2.742269e+08 3.934250e+08 1.727949e+08 2.908559e+08 3.548765e+08 4.053450e+08 2.947293e+08 3.224993e+08 3.474713e+08 2.777018e+08 4.846103e+08 2.923103e+08 4.917326e+08 2.908048e+08 2.953078e+08 3.584698e+08 3.416726e+08 2.899230e+08 3.723934e+08 4.281547e+08 4.043335e+08 3.661441e+08 3.073610e+08 3.089594e+08 3.002157e+08 4.284655e+08 2.901752e+08 2.979571e+08 2.905198e+08 2.676107e+08 4.224358e+08 3.053032e+08 1.077234e+08 2.598037e+08 3.409537e+08 2.413335e+08 3.578712e+08 4.034789e+08 4.379904e+08 3.137728e+08 3.253878e+08 3.013438e+08 3.540130e+08 1.028827e+08 4.371630e+08 2.883494e+08 4.107186e+08 4.085056e+08 1.330380e+08 3.334381e+08 9.232649e+07 4.054227e+08 3.405314e+08 2.614613e+08 4.101485e+08 3.250624e+08 3.130251e+08 3.400599e+08 2.940187e+08 3.621801e+08 2.961834e+08 4.014801e+08 1.001243e+08 3.580193e+08 3.253038e+08 4.384777e+08 2.814086e+08 1.832691e+08 2.540002e+08 3.213067e+08 588.28292_5.408 7.692918e+08 2.671340e+08 3.224290e+08 3.592130e+08 2.566010e+05 2.280824e+08 4.196918e+08 3.460458e+08 163502.53 3.893765e+08 3.060858e+08 3.117831e+08 161018.80 2.941962e+08 3.086957e+08 3.250663e+08 1.527564e+05 3.600274e+08 3.173231e+08 3.164391e+08 1.495977e+05 3.382930e+08 3.427815e+08 3.711199e+08 22356.749 2.830783e+08 3.100000e+08 3.451640e+08 3.948805e+04 2.692803e+08 3.475138e+08 3.453766e+08 91150.03 3.484542e+08 3.331912e+08 4.069600e+08 1.406900e+05 3.733973e+08 1.354764e+08 4.304719e+08 1.256961e+05 1.189022e+08 3.834425e+08 3.776287e+08 1.241460e+05 3.706738e+08 3.097686e+08 3.165183e+08 2.995004e+08 3.789136e+08 2.967023e+08 5.149356e+08 3.727656e+08 3.311075e+08 3.389357e+08 3.639175e+08 3.111618e+08 3.296059e+08 5.705658e+08 3.193002e+08 3.563424e+08 3.468731e+08 3.614200e+08 4.456257e+08 4.770363e+08 2.585787e+08 3.573000e+08 3.101100e+08 3.772962e+08 3.720512e+08 3.733482e+08 3.777743e+08 3.676288e+08 3.085098e+08 4.716003e+08 2.897275e+08 3.525517e+08 4.033369e+08 4.059198e+08 4.661621e+08 3.687846e+08 3.634661e+08 3.648607e+08 3.535354e+08 5.321131e+08 4.180312e+08 3.566659e+08 2.466219e+08 3.689387e+08 3.356610e+08 3.321299e+08 2.709632e+08 2.793168e+08 2.943034e+08 4.159320e+08 3.511897e+08 4.338932e+08 4.543580e+08 3.035839e+08 3.291077e+08 3.317696e+08 2.557662e+08 3.305194e+08 3.696434e+08 3.219679e+08 3.487941e+08 2.628598e+08 3.035011e+08 3.735114e+08 3.315186e+08 2.592298e+08 3.571292e+08 3.529686e+08 3.804342e+08 2.648546e+08 3.178017e+08 3.400447e+08 3.892325e+08 2.972706e+08 3.810825e+08 3.343298e+08 3.276311e+08 2.650567e+08 2.685261e+08 3.642727e+08 4.337320e+08 3.426978e+08 3.143557e+08 3.330858e+08 3.389363e+08 3.734472e+08 4.101328e+08 3.285907e+08 3.945953e+08 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3.824455e+08 3.696547e+08 3.782542e+08 2.988403e+08 3.151706e+08 2.933458e+08 4.856265e+08 3.286877e+08 3.149930e+08 3.180509e+08 3.115556e+08 4.024613e+08 3.181857e+08 3.745197e+08 3.340968e+08 4.493789e+08 2.636418e+08 3.921052e+08 3.691058e+08 4.245394e+08 3.458183e+08 3.448635e+08 3.205413e+08 3.709742e+08 4.069050e+08 4.185459e+08 3.188790e+08 3.830428e+08 3.920227e+08 4.357691e+08 3.285499e+08 2.958196e+08 3.973103e+08 4.241882e+08 2.782572e+08 4.066132e+08 3.276867e+08 3.395278e+08 3.379343e+08 3.284317e+08 3.577569e+08 3.250837e+08 4.044402e+08 3.701538e+08 4.185690e+08 3.258259e+08 5.649241e+08 3.036050e+08 2.601484e+08 2.886517e+08 3.504437e+08 "LysoPC(18:3(6Z,9Z,12Z))_5.409" 2.233710e+07 5.591476e+06 6.881193e+06 5.916636e+06 2.544287e+05 3.041278e+06 6.009972e+06 6.721229e+06 141172.27 8.451076e+06 6.381369e+06 4.761237e+06 143267.47 5.385144e+06 5.808589e+06 6.477052e+06 1.429414e+05 5.130555e+06 6.067237e+06 6.675752e+06 1.358713e+05 5.425137e+06 6.343278e+06 7.532506e+06 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7.311589e+08 8.498270e+08 8.219225e+08 6.779138e+08 1.049922e+09 7.033330e+08 1.080666e+09 5.689383e+08 1.578587e+09 1.201699e+09 1.254767e+09 7.755814e+08 6.204326e+06 1.027834e+07 5.828591e+08 9.286106e+08 1.155154e+09 7.961913e+08 1.099448e+09 9.326134e+08 1.574867e+09 8.421485e+08 5.938820e+08 1.064970e+09 5.949744e+08 3.904775e+06 1.063151e+09 7.203453e+08 1.235688e+09 9.625545e+08 8.715337e+08 7.161693e+08 8.714785e+08 1.603928e+09 9.787668e+08 1.698335e+09 9.254439e+08 9.209602e+08 9.682948e+08 3.661563e+08 6.086549e+08 1.241733e+07 Lyso-PAF C-18_5.425 3.879887e+06 1.505603e+06 1.997669e+06 1.927203e+06 1.781826e+05 1.258841e+06 2.555764e+06 2.000399e+06 116832.20 1.770555e+06 2.107707e+06 1.993335e+06 113526.94 1.561964e+06 1.765786e+06 1.889777e+06 1.145801e+05 1.958746e+06 1.685518e+06 2.186500e+06 1.126181e+05 1.595731e+06 2.075592e+06 2.361793e+06 17939.565 1.479682e+06 1.544014e+06 2.089276e+06 3.374666e+04 1.539916e+06 2.216771e+06 2.247110e+06 83509.01 1.341613e+06 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4.762980e+06 3.121539e+06 3.749853e+06 2.004813e+06 6.195896e+05 1.464963e+06 4.215190e+06 C9 H13 N_5.436 2.648964e+05 6.309511e+05 5.356428e+05 7.384205e+05 1.490473e+05 6.361148e+05 7.845439e+05 6.333151e+05 102930.62 6.884474e+05 6.695967e+05 1.001806e+06 96976.76 4.602096e+05 5.484875e+05 6.769007e+05 1.022038e+05 7.177773e+05 6.332476e+05 8.500134e+05 1.077113e+05 5.490728e+05 6.175292e+05 7.780132e+05 58837.494 5.328435e+05 5.616031e+05 9.224968e+05 3.162376e+04 5.774338e+05 7.277810e+05 7.002523e+05 99089.52 6.446146e+05 5.851678e+05 6.779983e+05 1.162226e+05 6.758516e+05 6.858057e+05 5.812963e+05 8.442787e+04 6.914529e+05 7.268686e+05 8.199318e+05 9.686886e+04 5.858865e+05 5.737747e+05 7.223794e+05 1.415035e+05 1.340949e+05 1.636406e+05 2.048891e+05 1.772246e+05 1.834274e+05 1.240283e+05 1.869319e+05 1.589675e+05 1.555174e+05 2.223192e+05 1.187078e+05 1.639520e+05 1.749403e+05 1.310577e+05 1.903068e+05 1.923843e+05 1.530364e+05 1.659833e+05 1.756941e+05 1.382041e+05 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9.312902e+05 1.704684e+06 1.225701e+06 1.208417e+06 8.102797e+05 8.382812e+05 1.030359e+06 9.547677e+05 1.075392e+06 1.178286e+06 1.060790e+06 9.865375e+05 8.912473e+05 7.893319e+05 2.872888e+06 1.260077e+06 9.479855e+05 1.041278e+06 1.600618e+06 7.163299e+05 1.018041e+06 9.323778e+05 9.470522e+05 7.265821e+05 1.216159e+06 9.611126e+05 4.730403e+05 9.358753e+05 1.029842e+06 1.002213e+06 9.842336e+05 7.557890e+05 1.391441e+06 8.286947e+05 1.173207e+06 1.565710e+06 1.140590e+06 1.873876e+06 1.297843e+06 1.664899e+06 9.857463e+05 1.490630e+06 7.524185e+05 9.183668e+05 1.010766e+06 5.218317e+05 1.156057e+06 6.284496e+05 1.146942e+06 1.916409e+06 1.534389e+06 1.366218e+06 1.445095e+06 1.666391e+06 1.151156e+06 9.666509e+05 1.572484e+06 1.407354e+06 1-pentadecanoyl-sn-glycero-3-phosphocholine_5.44 1.769737e+07 5.223104e+06 5.566137e+06 6.380702e+06 2.042814e+05 3.944267e+06 6.361493e+06 7.588258e+06 125288.80 5.970927e+06 5.904241e+06 6.154469e+06 122936.43 4.474977e+06 5.978527e+06 6.249326e+06 1.228002e+05 5.433061e+06 5.352862e+06 6.775239e+06 1.194708e+05 5.079514e+06 6.805333e+06 5.482122e+06 19857.765 5.200386e+06 6.195123e+06 6.000845e+06 3.488301e+04 4.734603e+06 6.694818e+06 6.681329e+06 99440.65 5.160063e+06 5.543421e+06 5.743110e+06 1.073253e+05 5.930376e+06 5.897018e+06 5.959648e+06 7.735521e+04 5.337263e+06 6.328893e+06 5.758656e+06 8.763862e+04 5.857540e+06 5.651256e+06 5.934730e+06 4.639918e+06 5.521439e+06 2.794141e+06 6.489284e+06 6.311264e+06 5.881476e+06 7.927504e+06 8.238233e+06 5.980328e+06 1.266664e+07 1.807828e+07 4.699788e+06 1.226981e+07 8.934787e+06 7.060268e+06 7.391134e+06 6.854385e+06 4.322525e+06 7.094040e+06 5.806658e+06 5.302856e+06 7.815148e+06 6.474896e+06 9.936346e+06 8.827939e+06 5.032738e+06 6.696618e+06 5.716899e+06 8.915065e+06 8.220122e+06 1.201416e+07 4.776050e+06 4.937819e+06 3.723800e+06 2.512872e+06 5.542627e+06 5.622450e+06 4.829730e+06 8.504344e+06 2.901151e+06 1.001088e+07 4.679943e+06 5.513971e+06 5.031522e+06 3.009791e+06 4.159641e+06 5.534761e+06 4.583665e+06 3.893520e+06 8.885160e+06 5.424130e+06 5.622088e+06 7.096426e+06 6.109034e+06 3.999488e+06 4.346694e+06 2.653731e+06 3.671951e+06 2.235557e+06 4.948380e+06 6.129538e+06 6.037506e+06 3.295984e+06 6.873143e+06 1.102116e+07 3.680538e+06 3.452649e+06 3.292849e+06 6.741800e+06 4.030471e+06 6.052055e+06 6.853428e+06 2.008690e+06 2.388656e+06 1.739320e+06 5.566714e+06 5.514615e+06 3.721068e+06 3.539029e+06 2.479114e+06 5.674330e+06 6.534157e+06 9.023252e+06 1.050202e+07 3.217854e+06 7.226568e+06 8.097134e+06 6.342006e+06 6.700486e+06 8.053892e+06 5.826429e+06 5.852753e+06 8.601788e+06 4.926354e+06 6.442221e+06 4.022269e+06 6.080077e+06 9.047974e+06 5.393065e+06 8.206028e+06 5.048487e+06 5.131663e+06 7.224819e+06 3.467684e+06 8.044294e+06 5.591484e+06 6.180559e+06 6.773073e+06 5.360854e+06 4.823124e+06 3.439766e+06 5.345955e+06 4.760308e+06 4.363573e+06 2.605881e+06 6.410255e+06 3.523953e+06 6.454981e+06 6.245488e+06 8.130944e+06 3.285539e+06 4.913985e+06 6.641790e+06 6.115108e+06 6.710316e+06 3.901334e+06 4.603946e+06 7.082422e+06 5.123722e+06 6.200211e+06 4.545274e+06 6.776515e+06 2.439680e+06 7.558123e+06 6.992458e+06 4.767148e+06 4.974329e+06 6.436853e+06 4.322409e+06 7.844946e+06 5.937987e+06 5.474528e+06 3.750360e+06 9.156631e+06 4.191526e+06 7.234673e+06 1.407323e+06 5.108567e+06 1.072589e+07 1.091103e+07 5.145064e+06 6.326189e+06 5.588841e+06 4.473928e+06 1.231834e+07 6.094349e+06 1.017636e+07 8.806258e+06 3.341900e+06 3.340942e+06 4.294042e+06 5.283861e+06 9.980719e+06 5.705381e+06 9.817755e+06 6.671901e+06 2.480656e+06 6.113105e+06 5.002440e+06 3.129979e+06 5.688562e+06 7.146754e+06 6.943611e+06 4.187606e+06 5.182289e+06 4.271592e+06 6.784129e+06 4.073829e+06 9.712882e+06 5.027385e+06 1.006022e+07 9.711396e+06 5.116779e+06 3.439249e+06 3.646524e+06 8.459540e+06 4.644016e+06 6.934355e+06 9.249671e+06 7.331037e+06 8.323623e+06 5.150513e+06 1.698633e+07 5.248925e+06 5.633663e+06 1.200026e+07 5.189304e+06 4.482133e+06 1.185982e+07 5.733435e+06 8.253659e+06 8.195313e+06 5.683006e+06 5.796491e+06 6.526718e+06 8.959916e+06 8.720477e+06 8.378319e+06 5.952219e+06 8.647254e+06 6.488159e+06 2.791237e+06 5.875417e+06 7.611637e+06 C19 H33 N9 O10_5.44 4.640139e+07 3.897397e+06 1.664257e+07 1.501812e+07 1.952471e+05 1.043845e+07 1.636609e+07 1.533581e+07 129928.30 1.303094e+07 1.177360e+07 1.217063e+07 128929.46 1.156877e+07 1.323218e+07 1.372510e+07 1.243581e+05 1.280518e+07 1.128063e+07 1.309730e+07 1.158136e+05 1.196355e+07 1.419940e+07 1.584523e+07 18103.224 1.017175e+07 1.239342e+07 1.353491e+07 3.223319e+04 1.078705e+07 1.388435e+07 1.353281e+07 92183.21 1.298826e+07 1.161121e+07 1.407512e+07 9.771066e+04 1.106697e+07 1.323566e+07 1.398152e+07 6.997645e+04 1.249429e+07 1.278119e+07 1.379456e+07 1.796310e+05 1.136454e+07 1.222340e+07 1.354434e+07 1.205654e+07 1.076839e+07 6.231988e+06 9.689145e+06 1.318539e+07 1.363914e+07 1.618802e+07 1.280982e+07 8.032252e+06 1.364816e+07 2.728442e+07 9.725867e+06 1.831280e+07 1.417569e+07 1.089538e+07 1.358017e+07 1.451291e+07 4.718213e+06 1.551196e+07 1.014376e+07 1.099259e+07 1.119617e+07 1.009210e+07 1.329895e+07 1.289965e+07 1.228657e+07 1.393061e+07 1.124348e+07 1.959228e+07 1.555119e+07 2.117615e+07 1.137756e+07 1.718915e+07 6.767047e+06 1.000676e+07 1.314808e+07 1.210242e+07 1.030051e+07 1.076631e+07 7.510033e+06 1.859620e+07 1.239156e+07 1.887927e+07 1.280456e+07 8.042009e+06 9.105758e+06 1.034359e+07 1.408623e+07 1.347639e+07 1.385034e+07 7.692223e+06 8.315859e+06 1.533964e+07 1.237844e+07 1.415445e+07 1.116431e+07 8.894025e+06 1.087794e+07 7.596772e+06 8.860179e+06 1.486688e+07 1.029576e+07 5.457655e+06 1.804218e+07 2.722738e+07 1.023507e+07 8.834608e+06 1.202592e+07 1.357559e+07 7.818776e+06 1.210182e+07 1.054620e+07 8.612065e+06 6.601989e+06 3.998193e+06 1.137385e+07 1.232634e+07 7.905923e+06 1.132311e+07 1.030212e+07 1.801971e+07 1.521146e+07 1.382555e+07 1.443514e+07 8.043384e+06 1.143155e+07 1.042188e+07 8.365825e+06 9.948745e+06 1.323696e+07 1.171123e+07 1.170528e+07 1.484233e+07 1.325022e+07 1.202317e+07 9.572144e+06 1.295935e+07 1.096723e+07 7.953046e+06 1.563742e+07 1.020506e+07 7.394528e+06 1.091247e+07 6.728868e+06 1.132343e+07 1.117533e+07 1.063062e+07 1.394322e+07 1.350720e+07 9.798844e+06 8.290532e+06 1.018956e+07 1.024129e+07 1.128273e+07 6.357967e+06 1.279903e+07 1.262080e+07 1.181651e+07 9.322300e+06 1.041054e+07 9.528717e+06 1.731859e+07 1.512546e+07 1.526743e+07 1.919142e+07 1.468888e+07 8.412681e+06 1.703964e+07 1.089589e+07 1.194486e+07 1.625903e+07 1.355361e+07 5.263607e+06 9.299178e+06 2.153549e+07 1.258405e+07 1.503073e+07 1.242579e+07 1.442279e+07 1.497834e+07 1.334824e+07 9.724637e+06 1.084305e+07 1.587747e+07 8.795331e+06 1.486515e+07 5.448508e+06 2.171850e+07 1.682029e+07 2.583815e+07 1.123701e+07 1.622156e+07 1.165558e+07 1.095341e+07 2.185405e+07 1.256945e+07 2.954827e+07 1.341976e+07 9.190355e+06 1.056673e+07 7.576592e+06 1.131122e+07 1.704244e+07 1.713469e+07 1.576482e+07 1.286562e+07 9.840852e+06 1.287433e+07 1.090669e+07 9.309847e+06 1.277270e+07 1.176203e+07 1.513812e+07 9.188158e+06 1.820686e+07 8.538423e+06 9.745718e+06 7.672953e+06 2.463648e+07 8.052424e+06 1.548245e+07 1.439031e+07 2.570564e+07 1.015694e+07 8.857466e+06 1.045867e+07 1.396635e+07 8.599038e+06 1.839197e+07 1.635752e+07 1.514762e+07 9.583576e+06 2.963446e+07 1.252812e+07 1.143957e+07 1.327242e+07 2.366643e+07 9.343396e+06 2.163293e+07 1.201521e+07 1.391664e+07 1.886023e+07 1.082547e+07 7.660517e+06 1.777147e+07 2.551971e+07 1.371674e+07 1.391976e+07 1.094176e+07 2.088047e+07 1.267384e+07 5.641394e+06 9.093270e+06 1.350349e+07 LPC O-18:1_5.446 1.321397e+07 4.339863e+06 5.457412e+06 5.354684e+06 2.026785e+05 2.769429e+06 6.069889e+06 6.615929e+06 126401.04 5.199370e+06 4.807394e+06 5.178168e+06 127122.71 4.477648e+06 4.671192e+06 5.501646e+06 1.279604e+05 5.081806e+06 4.277322e+06 5.495016e+06 1.192261e+05 4.574021e+06 5.508462e+06 6.606103e+06 18835.889 3.906764e+06 5.082096e+06 4.907425e+06 3.487177e+04 4.314508e+06 5.258395e+06 6.000703e+06 102738.53 5.082689e+06 4.507902e+06 5.670962e+06 1.153592e+05 4.444183e+06 4.664533e+06 5.605589e+06 8.154032e+04 4.734473e+06 5.194066e+06 6.142899e+06 8.867751e+04 4.044162e+06 4.821560e+06 5.333386e+06 4.862053e+06 6.599478e+06 4.152234e+06 1.301950e+07 4.401434e+06 6.119419e+06 5.498396e+06 7.120686e+06 6.519876e+06 6.881529e+06 9.686540e+06 5.217063e+06 5.911593e+06 1.165606e+07 7.652040e+06 1.169215e+07 7.875569e+06 2.883316e+06 5.977473e+06 4.312344e+06 4.776970e+06 7.698482e+06 7.709010e+06 7.017704e+06 5.973331e+06 5.632807e+06 5.457251e+06 5.284249e+06 4.529944e+06 9.766455e+06 1.135317e+07 6.766387e+06 4.256123e+06 3.288967e+06 2.982143e+06 4.206583e+06 4.443388e+06 5.488447e+06 2.994378e+06 1.867600e+06 3.866309e+06 3.559908e+06 4.712315e+06 4.553790e+06 3.348542e+06 4.115608e+06 3.837432e+06 4.883897e+06 4.943447e+06 5.504887e+06 5.595679e+06 3.690197e+06 3.165000e+06 4.841555e+06 2.909748e+06 3.439116e+06 3.608388e+06 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1.399181e+05 1.601357e+05 1.632676e+05 1.769416e+05 1.424560e+05 2.793100e+05 1.742587e+05 1.841363e+05 1.890421e+05 1.596954e+05 C7 H6_5.454 3.721706e+05 1.887559e+05 5.017424e+05 5.006378e+05 2.259143e+05 2.424680e+05 6.718201e+05 7.109467e+05 424079.45 3.359680e+05 5.377932e+05 3.532912e+05 172274.28 4.661926e+05 5.680711e+05 2.845896e+05 5.018142e+05 6.106524e+05 4.522340e+05 5.846000e+05 1.429904e+05 5.090471e+05 4.381977e+05 5.801483e+05 24174.646 5.048230e+05 3.602749e+05 2.241602e+05 3.087586e+05 8.537795e+05 2.145496e+05 2.092633e+05 121803.61 4.417299e+05 2.108723e+05 5.522375e+05 1.195491e+05 6.231127e+05 5.829102e+05 4.453872e+05 1.397723e+05 4.225116e+05 1.972913e+05 2.243752e+05 1.285854e+05 5.276763e+05 3.559459e+05 5.840614e+05 1.915398e+05 2.249545e+05 6.073722e+05 3.806748e+05 1.871930e+05 1.992115e+05 2.014977e+05 2.538883e+05 2.058670e+05 5.311173e+05 4.780561e+05 5.800205e+05 5.541454e+05 2.354515e+05 7.417708e+05 1.955517e+05 6.304184e+05 2.614045e+05 1.871946e+05 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4.898110e+06 5.994097e+06 1.476496e+05 3.369974e+06 5.838506e+06 5.294109e+06 114897.32 4.432980e+06 4.595476e+06 4.410981e+06 122482.56 3.995092e+06 5.023603e+06 4.904001e+06 1.160878e+05 4.428116e+06 4.023147e+06 5.001344e+06 1.024184e+05 4.553805e+06 4.775471e+06 5.878274e+06 16324.452 3.802432e+06 4.523624e+06 4.623606e+06 2.750202e+04 4.044096e+06 4.779858e+06 5.283624e+06 85936.93 4.377780e+06 4.374292e+06 4.730493e+06 9.035356e+04 4.308465e+06 4.961301e+06 5.032902e+06 6.601705e+04 4.404526e+06 4.622737e+06 5.041545e+06 7.987409e+04 3.856953e+06 4.922959e+06 4.617613e+06 4.587486e+06 6.799122e+06 3.799020e+06 8.805753e+06 3.790200e+06 5.137867e+06 5.115027e+06 5.740718e+06 6.209925e+06 6.616573e+06 5.990892e+06 5.349393e+06 5.431578e+06 9.055449e+06 6.784680e+06 7.886304e+06 5.703829e+06 3.128446e+06 5.473976e+06 4.349813e+06 4.865652e+06 6.864513e+06 6.002761e+06 6.220063e+06 5.749756e+06 6.088192e+06 5.201665e+06 4.595297e+06 4.142526e+06 8.271498e+06 8.288390e+06 5.315353e+06 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6.105707e+06 3.901014e+06 5.308417e+06 3.891106e+06 5.414220e+06 4.633364e+06 5.808807e+06 5.891115e+06 4.074528e+06 4.722430e+06 5.307361e+06 4.773090e+06 4.716851e+06 4.161283e+06 5.169398e+06 4.584114e+06 4.574919e+06 3.795287e+06 4.823485e+06 9.989720e+06 5.784271e+06 6.384911e+06 5.238364e+06 7.522645e+06 4.881225e+06 2.096096e+06 4.802168e+06 7.409967e+06 C6 H20 N7 O3 P3_5.48 2.427027e+06 8.269039e+05 9.964279e+05 8.271596e+05 1.446172e+05 6.997415e+05 1.364549e+06 8.398835e+05 99740.36 9.480120e+05 9.674694e+05 8.061484e+05 112294.15 8.813846e+05 9.447244e+05 1.183653e+06 1.157487e+05 8.312159e+05 7.184711e+05 8.639884e+05 1.013305e+05 9.168854e+05 9.656164e+05 1.224684e+06 13739.055 8.076455e+05 1.032126e+06 8.078739e+05 2.136801e+04 7.883720e+05 7.813161e+05 1.085342e+06 67169.44 9.684639e+05 9.151930e+05 8.097796e+05 5.947453e+04 8.484649e+05 1.087855e+06 1.313647e+06 4.587589e+04 6.512834e+05 7.663045e+05 1.069482e+06 6.863712e+04 8.427325e+05 8.395123e+05 9.924666e+05 6.696621e+05 9.785439e+05 1.476912e+05 6.156768e+05 1.290860e+06 9.776293e+05 1.142892e+06 1.773220e+06 4.020647e+05 1.744379e+06 2.237573e+06 9.229801e+05 1.298052e+06 6.852923e+05 1.486209e+06 6.193618e+05 1.414308e+06 5.245033e+05 1.123015e+06 1.104728e+06 7.103145e+05 7.316926e+05 7.301828e+05 9.408505e+05 1.227335e+06 5.063030e+05 1.185606e+06 7.813267e+05 1.615362e+06 1.394411e+06 1.407371e+06 2.984556e+05 1.528314e+06 7.619580e+05 5.556191e+05 1.460989e+06 1.196311e+06 8.699976e+05 1.075981e+06 2.753282e+05 1.828466e+06 8.480589e+05 1.844805e+06 8.609317e+05 2.104418e+05 6.624814e+05 1.039172e+06 4.956952e+05 4.857073e+05 9.701545e+05 7.214677e+05 5.752641e+05 1.141512e+06 9.918954e+05 1.064623e+06 6.684411e+05 2.763796e+05 3.169879e+05 3.267188e+05 2.138931e+06 5.948367e+05 1.081127e+06 1.085001e+05 8.911030e+05 1.721913e+06 5.562189e+05 7.182307e+05 5.122015e+05 8.649583e+05 1.644851e+05 9.106868e+05 9.118853e+05 1.661157e+05 2.582677e+05 1.383760e+05 1.262269e+06 1.451831e+06 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1.797348e+06 1.363740e+06 2.285302e+06 1.168605e+06 3.061037e+05 1.406243e+05 7.311357e+05 9.436737e+05 1.237349e+06 1.002097e+06 1.644079e+06 1.398214e+06 8.342483e+05 1.700236e+06 1.295358e+06 9.400675e+05 6.082642e+05 7.087313e+05 1.188939e+06 2.721104e+05 3.246309e+05 2.511538e+05 9.206648e+05 5.212858e+05 1.146647e+06 7.940101e+05 1.925979e+06 2.037044e+06 1.751166e+06 1.881117e+05 5.483182e+05 1.479487e+06 4.903074e+05 5.340687e+05 1.466949e+06 9.801300e+05 1.104412e+06 6.469205e+05 2.352879e+06 6.173112e+05 1.031833e+06 1.819650e+06 1.344786e+06 8.734164e+05 3.379296e+06 7.916066e+05 1.176806e+06 2.332583e+06 1.054386e+06 1.007294e+06 1.368333e+06 1.749628e+06 1.020815e+06 1.726069e+06 4.635341e+05 1.893242e+06 1.512625e+06 2.465722e+05 7.549546e+05 8.755379e+05 L-alpha-lysophosphatidylcholine_5.484 3.382359e+07 9.447821e+06 1.139166e+07 1.152585e+07 1.856045e+05 1.128293e+07 1.282837e+07 1.338894e+07 110457.32 1.200437e+07 1.229851e+07 1.263246e+07 124229.78 1.090294e+07 1.175619e+07 1.212027e+07 1.451044e+05 1.110430e+07 8.784323e+06 1.247183e+07 1.335276e+05 1.073463e+07 1.283285e+07 1.644743e+07 18433.522 9.142814e+06 1.230875e+07 1.185382e+07 2.956197e+04 9.617132e+06 9.616983e+06 1.424461e+07 98729.29 1.184854e+07 1.234438e+07 1.160554e+07 9.239610e+04 9.669374e+06 1.393109e+07 1.125124e+07 6.851843e+04 1.071834e+07 1.212206e+07 1.341294e+07 8.449672e+04 1.146496e+07 1.018912e+07 1.240034e+07 8.244126e+06 1.087056e+07 2.887839e+06 9.502718e+06 1.436615e+07 1.455257e+07 1.316089e+07 2.238071e+07 7.196350e+06 2.747004e+07 4.102607e+07 9.586048e+06 1.793430e+07 1.224198e+07 1.448166e+07 1.154388e+07 1.850588e+07 3.753996e+06 1.471572e+07 1.385311e+07 1.049567e+07 1.121033e+07 1.290301e+07 1.560439e+07 1.493185e+07 5.895710e+06 1.436736e+07 8.252161e+06 2.263839e+07 2.048384e+07 2.276626e+07 5.642972e+06 1.679250e+07 8.550195e+06 6.573048e+06 1.744995e+07 1.331007e+07 1.047506e+07 1.235622e+07 3.862609e+06 2.055344e+07 1.084792e+07 2.197748e+07 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1.444072e+07 7.262888e+06 1.648678e+07 1.841867e+07 1.683742e+07 2.664542e+06 7.824079e+06 1.241996e+07 4.459095e+06 6.136876e+06 1.412289e+07 1.174215e+07 1.063689e+07 8.036760e+06 2.592577e+07 7.632364e+06 8.939387e+06 1.879852e+07 1.244809e+07 8.750797e+06 4.089202e+07 8.697089e+06 1.041553e+07 2.224773e+07 9.075088e+06 7.954122e+06 1.201645e+07 1.928650e+07 9.498095e+06 2.071832e+07 6.239998e+06 2.406920e+07 1.434248e+07 3.986067e+06 7.151184e+06 8.911334e+06 C20 H46 N9 O6 P S2_5.486 4.857377e+06 1.674700e+06 3.354763e+06 2.592990e+06 1.273568e+05 2.017298e+06 2.779890e+06 1.466302e+06 107102.07 3.874198e+06 2.607921e+06 2.129251e+06 131913.70 2.100036e+06 2.862494e+06 2.479491e+06 1.359810e+05 2.225721e+06 2.467733e+06 3.187561e+06 1.109067e+05 1.699573e+06 2.372466e+06 2.950186e+06 13828.122 2.387873e+06 2.405294e+06 2.518097e+06 1.988478e+04 2.655396e+06 2.355439e+06 2.881969e+06 75499.17 2.247825e+06 1.902495e+06 3.491063e+06 8.081170e+04 1.501871e+06 2.768236e+06 2.592906e+06 6.559569e+04 2.565137e+06 2.279631e+06 2.773166e+06 8.954855e+04 2.587958e+06 1.667319e+06 2.984128e+06 2.890262e+06 2.733368e+06 1.107115e+06 2.377772e+06 3.446047e+06 2.338813e+06 3.702814e+06 7.285338e+06 2.079073e+06 5.612968e+06 6.286698e+06 2.170306e+06 2.765395e+06 2.856355e+06 3.004106e+06 2.252280e+06 3.661836e+06 1.374766e+06 2.692698e+06 2.854315e+06 1.775461e+06 1.609727e+06 4.165694e+06 2.882825e+06 3.608792e+06 1.729524e+06 2.006193e+06 8.973583e+05 4.019335e+06 4.058631e+06 5.983840e+06 1.630992e+06 3.450431e+06 2.447639e+06 1.713646e+06 3.856875e+06 2.937205e+06 1.816340e+06 2.244625e+06 1.295533e+06 3.904227e+06 1.831369e+06 3.499015e+06 2.543366e+06 1.929934e+06 4.269310e+06 2.811908e+06 3.782028e+06 1.936437e+06 4.613444e+06 2.337126e+06 2.547174e+06 3.317065e+06 3.161324e+06 1.092737e+06 1.664692e+06 3.105959e+05 2.836858e+05 9.073746e+05 3.759983e+06 1.708733e+06 2.116638e+06 1.222615e+06 2.068033e+06 3.379848e+06 2.325193e+06 2.612516e+06 2.178944e+06 1.925524e+06 6.791727e+05 2.137630e+06 1.872765e+06 8.844282e+05 7.347905e+05 6.013950e+05 3.780718e+06 3.392546e+06 3.090627e+06 2.220809e+06 4.246940e+06 3.499259e+06 4.177592e+06 2.033119e+06 3.526128e+06 1.171877e+06 1.785073e+06 2.996049e+06 2.097866e+06 2.934897e+06 3.687989e+06 2.315358e+06 1.968343e+06 2.600175e+06 2.063521e+06 3.745407e+06 2.130343e+06 2.048019e+06 2.153522e+06 2.623369e+06 2.545649e+06 5.878218e+06 1.770475e+06 3.051945e+06 2.125636e+06 2.228000e+06 2.858446e+06 2.099582e+06 1.927283e+06 1.908534e+06 2.449421e+06 1.031937e+06 1.489655e+06 1.284415e+06 1.865365e+06 9.210322e+05 4.006947e+06 1.361428e+06 2.162565e+06 1.386572e+06 2.960332e+06 2.148368e+06 4.110069e+06 2.426748e+06 2.826994e+06 2.053231e+06 1.827857e+06 2.668628e+06 2.964624e+06 1.629418e+06 1.918283e+06 5.014929e+06 2.958825e+06 6.103379e+05 2.844783e+06 6.402956e+06 3.421016e+06 2.640335e+06 1.691384e+06 2.130429e+06 3.752248e+06 2.479416e+06 2.961476e+06 1.199683e+06 5.513503e+06 2.564448e+06 3.163188e+06 1.363916e+05 2.352606e+06 5.425090e+06 3.568009e+06 2.001274e+06 4.890520e+06 3.062233e+06 1.984673e+06 4.731641e+06 3.905028e+06 4.607784e+06 3.728609e+06 1.511959e+06 1.040828e+06 2.945983e+06 2.107238e+06 3.025638e+06 2.553295e+06 3.640489e+06 2.367510e+06 2.610442e+06 3.556833e+06 3.196346e+06 2.471880e+06 2.289189e+06 2.398600e+06 2.819112e+06 3.915474e+06 1.544201e+06 1.309307e+06 2.051274e+06 1.916255e+06 4.288877e+06 2.028238e+06 4.533382e+06 4.281941e+06 4.582422e+06 1.016385e+06 2.308723e+06 3.409434e+06 1.104081e+06 1.019175e+06 2.984991e+06 2.910107e+06 2.523106e+06 2.002479e+06 6.179252e+06 2.774358e+06 3.185790e+06 4.137745e+06 2.999906e+06 2.228757e+06 8.178579e+06 2.793175e+06 2.770339e+06 6.809404e+06 2.728311e+06 1.544982e+06 3.360128e+06 5.711274e+06 2.550133e+06 6.017341e+06 1.888799e+06 4.858958e+06 4.221272e+06 7.851822e+05 1.926620e+06 3.719222e+06 C37 H48 N O5 P_5.495 2.277954e+06 5.810136e+05 8.793643e+05 8.425773e+05 1.555071e+05 9.792015e+05 1.003239e+06 1.121590e+06 98165.18 7.674190e+05 9.170179e+05 8.522217e+05 103574.19 8.543604e+05 8.536368e+05 1.066320e+06 1.203474e+05 7.854403e+05 8.423806e+05 8.964785e+05 1.148229e+05 6.081842e+05 8.908845e+05 1.209878e+06 15321.848 9.117832e+05 7.795633e+05 9.076661e+05 2.378994e+04 8.612325e+05 7.150527e+05 9.277961e+05 68111.21 8.361684e+05 1.145241e+06 7.374147e+05 8.849616e+04 7.910071e+05 8.401101e+05 8.879169e+05 5.626924e+04 1.053628e+06 8.775254e+05 1.056718e+06 7.521293e+04 7.214018e+05 6.893302e+05 1.017911e+06 7.376217e+05 1.937125e+06 3.540922e+05 1.547258e+06 8.631711e+05 1.084797e+06 1.424127e+06 1.693077e+06 9.123382e+05 2.255573e+06 1.634385e+06 1.310466e+06 1.203997e+06 2.023973e+06 2.006458e+06 1.813478e+06 1.184832e+06 4.663057e+05 1.106311e+06 3.770194e+05 9.822708e+05 1.335064e+06 1.282338e+06 1.289775e+06 1.009026e+06 8.380550e+05 1.649525e+06 6.953883e+05 8.269184e+05 2.136903e+06 1.916254e+06 8.404068e+05 6.699277e+05 6.755088e+05 3.798341e+05 1.008424e+06 5.322595e+05 5.903798e+05 6.427592e+05 1.863375e+05 6.710914e+05 1.198094e+06 9.481908e+05 8.579273e+05 7.261514e+05 7.234166e+05 6.085769e+05 9.511341e+05 8.532926e+05 9.501696e+05 7.483316e+05 4.379765e+05 7.340226e+05 1.080263e+06 5.251984e+05 3.475861e+05 5.133850e+05 8.481699e+05 4.577972e+05 8.831567e+05 2.341655e+06 8.693150e+05 3.643632e+05 8.607824e+05 9.900511e+05 6.789762e+05 1.167621e+06 5.577308e+05 8.734960e+05 9.335597e+05 5.088168e+05 9.960053e+05 1.820844e+05 1.252861e+05 1.776055e+05 3.185270e+05 4.912683e+05 3.801735e+05 7.943864e+05 4.673287e+05 6.087774e+05 5.842736e+05 9.498053e+05 1.160927e+06 5.399982e+05 2.262962e+06 1.285466e+06 5.601644e+05 9.719325e+05 1.007444e+06 1.097766e+06 1.418612e+06 1.174324e+06 3.276881e+05 1.143337e+06 7.979612e+05 4.987601e+05 7.201384e+05 3.954726e+05 6.476488e+05 2.373036e+05 5.088991e+05 7.202367e+05 1.624721e+05 6.783515e+05 7.448299e+05 8.406855e+05 4.677826e+05 6.420749e+05 6.857976e+05 2.453051e+05 1.214935e+06 3.687395e+05 6.751074e+05 1.008845e+06 5.669902e+05 8.494691e+05 7.057049e+05 1.163619e+06 7.975958e+05 6.434983e+05 5.275051e+05 1.028712e+06 8.716384e+05 9.775709e+05 8.694342e+05 6.594503e+05 4.998997e+05 1.077514e+06 8.047470e+05 8.897903e+05 4.245816e+05 2.752064e+05 3.553462e+05 1.138161e+06 5.334085e+05 7.750690e+05 6.271642e+05 6.886125e+05 8.163761e+05 2.274266e+06 1.438240e+06 5.582747e+05 8.346034e+05 4.298794e+05 9.485567e+05 2.831423e+05 3.417890e+05 9.253246e+05 4.613267e+05 2.705183e+05 1.379839e+06 7.291594e+05 5.883261e+05 8.064384e+05 8.787151e+05 1.313676e+06 7.661442e+05 3.869964e+05 4.287198e+05 8.288525e+05 8.058373e+05 8.924525e+05 9.854732e+05 1.135922e+06 1.157613e+06 9.886601e+05 1.036023e+06 5.943074e+05 4.794232e+05 1.011986e+06 1.241966e+06 7.425833e+05 9.114406e+05 1.120283e+06 6.615802e+05 9.441488e+05 5.342611e+05 7.590816e+05 3.870082e+05 9.702460e+05 1.183893e+06 8.748723e+05 6.625673e+05 9.600057e+05 9.941013e+05 5.842825e+05 4.420740e+05 1.175850e+06 8.228667e+05 9.159078e+05 3.280938e+05 2.034098e+06 1.206316e+06 5.171003e+05 1.070080e+06 9.806114e+05 5.410472e+05 1.237999e+06 8.878857e+05 9.119904e+05 6.313442e+05 6.443148e+05 5.215075e+05 8.108952e+05 1.783360e+06 1.124619e+06 8.548267e+05 1.405415e+06 1.176355e+06 7.601214e+05 7.056870e+05 1.126345e+06 1.639745e+06 C14 H18 N6 O_5.498 1.377477e+07 7.588999e+06 9.669023e+06 9.554251e+06 1.717514e+05 8.381459e+06 1.189938e+07 1.041433e+07 114508.85 1.006118e+07 9.660847e+06 9.087147e+06 121919.44 9.040891e+06 9.427363e+06 1.000961e+07 1.344031e+05 9.987928e+06 8.338369e+06 9.547514e+06 1.205916e+05 8.255339e+06 1.041756e+07 1.331258e+07 16644.322 7.657987e+06 9.658549e+06 1.002463e+07 3.156343e+04 7.570562e+06 8.809868e+06 1.054496e+07 75137.60 1.002680e+07 9.776140e+06 9.589697e+06 1.017727e+05 8.401597e+06 1.084125e+07 1.052633e+07 6.906552e+04 7.707636e+06 1.030895e+07 1.057179e+07 8.864389e+04 8.691009e+06 8.416822e+06 1.047121e+07 8.754197e+06 1.185901e+07 5.375543e+06 1.441347e+07 7.361334e+06 8.624229e+06 1.068977e+07 1.222175e+07 9.438718e+06 1.632808e+07 1.355179e+07 8.004989e+06 9.000517e+06 1.579972e+07 1.653148e+07 1.615185e+07 1.030955e+07 5.233031e+06 8.349847e+06 6.048404e+06 8.756687e+06 1.074949e+07 9.869573e+06 1.082894e+07 8.980709e+06 8.080096e+06 1.347208e+07 7.592784e+06 8.219127e+06 1.526090e+07 1.431342e+07 8.283057e+06 6.320964e+06 6.133887e+06 4.257503e+06 7.353822e+06 5.886424e+06 8.639160e+06 5.063450e+06 3.137303e+06 6.536105e+06 7.409113e+06 7.396692e+06 8.006483e+06 6.515239e+06 4.498548e+06 5.938657e+06 9.184538e+06 6.683885e+06 8.330518e+06 8.146888e+06 5.570686e+06 6.694108e+06 7.760289e+06 4.955208e+06 4.532393e+06 4.698737e+06 7.233416e+06 4.227267e+06 6.033287e+06 1.875281e+07 7.933954e+06 5.047223e+06 7.270016e+06 8.442686e+06 6.110103e+06 9.048427e+06 5.244495e+06 6.240344e+06 8.926820e+06 5.906523e+06 9.847711e+06 3.920696e+06 3.176688e+06 2.537919e+06 3.467425e+06 5.348718e+06 8.713843e+06 7.790181e+06 5.248110e+06 6.473106e+06 5.627996e+06 9.244047e+06 1.423105e+07 6.284482e+06 1.773785e+07 1.064951e+07 5.729102e+06 7.808038e+06 8.836420e+06 9.403260e+06 1.138073e+07 1.024430e+07 4.503598e+06 8.721512e+06 8.749933e+06 7.113733e+06 8.617330e+06 4.282342e+06 6.378958e+06 2.928769e+06 4.425288e+06 5.692040e+06 4.524979e+06 6.972403e+06 6.888043e+06 7.515716e+06 5.735782e+06 8.368515e+06 5.494039e+06 3.608685e+06 1.008803e+07 6.207927e+06 5.937368e+06 7.869433e+06 7.577115e+06 7.862348e+06 6.718103e+06 9.924670e+06 8.541689e+06 6.614538e+06 6.754376e+06 8.281091e+06 7.291652e+06 8.927068e+06 7.044942e+06 7.087359e+06 6.169165e+06 9.597653e+06 7.786257e+06 7.566020e+06 5.796332e+06 3.523352e+06 5.086618e+06 9.950478e+06 5.498876e+06 6.270803e+06 6.892649e+06 6.907363e+06 6.648086e+06 1.841909e+07 9.642988e+06 5.575953e+06 7.748770e+06 4.787218e+06 6.421802e+06 3.108594e+06 4.555464e+06 8.949121e+06 6.648027e+06 4.223764e+06 1.152981e+07 6.656226e+06 6.522911e+06 6.744835e+06 6.034350e+06 9.306822e+06 7.507753e+06 5.479288e+06 5.243322e+06 6.412053e+06 4.978091e+06 7.753013e+06 7.204733e+06 9.017642e+06 8.833902e+06 9.312585e+06 7.540813e+06 6.900834e+06 6.351692e+06 9.028705e+06 9.551138e+06 6.116683e+06 6.933841e+06 1.025556e+07 6.371452e+06 7.813719e+06 6.218056e+06 8.768859e+06 4.316003e+06 8.008103e+06 8.877310e+06 8.140930e+06 6.133161e+06 6.726915e+06 9.178661e+06 6.095880e+06 5.718309e+06 1.087993e+07 7.766947e+06 6.956124e+06 6.643888e+06 1.242310e+07 1.102372e+07 5.058391e+06 9.189463e+06 7.564919e+06 5.408176e+06 9.804196e+06 8.475136e+06 7.460806e+06 6.677781e+06 7.051028e+06 4.996663e+06 7.047636e+06 1.387105e+07 9.993025e+06 2.970658e+08 1.013344e+07 1.195444e+07 6.986396e+06 3.079483e+06 9.525415e+06 1.553025e+07 LPC O-16:0_5.499 1.940799e+07 6.108201e+06 8.478456e+06 8.503679e+06 2.086324e+05 6.680639e+06 8.531065e+06 9.003361e+06 123403.35 7.897276e+06 8.413041e+06 8.804159e+06 124596.74 7.738364e+06 7.874159e+06 6.960772e+06 1.440747e+05 7.775075e+06 7.363247e+06 8.653751e+06 1.293973e+05 6.874080e+06 8.161102e+06 1.120795e+07 18480.780 6.351694e+06 8.139448e+06 7.605578e+06 3.415387e+04 6.802947e+06 7.322038e+06 1.041412e+07 84759.01 8.009021e+06 7.212659e+06 7.142421e+06 1.197022e+05 7.550553e+06 8.159772e+06 8.650742e+06 7.385494e+04 7.176909e+06 8.333167e+06 9.506612e+06 8.738427e+04 7.458752e+06 6.563865e+06 8.616206e+06 7.792924e+06 1.093125e+07 4.814825e+06 1.323160e+07 9.012477e+06 9.637893e+06 1.078088e+07 1.395689e+07 9.814732e+06 1.862432e+07 1.597054e+07 8.719360e+06 1.027599e+07 1.692453e+07 1.470736e+07 1.923488e+07 1.054260e+07 5.020246e+06 9.881159e+06 6.521993e+06 8.903394e+06 1.137755e+07 1.122203e+07 1.257629e+07 7.515497e+06 7.366355e+06 9.000117e+06 7.097712e+06 6.206821e+06 1.539717e+07 1.797235e+07 9.988689e+06 6.374666e+06 6.267294e+06 4.144896e+06 7.178380e+06 5.923266e+06 7.608080e+06 5.809191e+06 2.871117e+06 6.665771e+06 7.018833e+06 7.982695e+06 8.120688e+06 6.244301e+06 5.379627e+06 6.077431e+06 9.389272e+06 7.389804e+06 9.002709e+06 7.821640e+06 5.631222e+06 5.411035e+06 7.103690e+06 5.032384e+06 5.230439e+06 6.151481e+06 7.478656e+06 5.144428e+06 5.690148e+06 1.966709e+07 7.928195e+06 5.110689e+06 8.130043e+06 9.935955e+06 6.032553e+06 9.802383e+06 6.231500e+06 6.632416e+06 9.143716e+06 7.681134e+06 1.208356e+07 2.857617e+06 3.110006e+06 2.723574e+06 3.933829e+06 5.525651e+06 6.652273e+06 6.596140e+06 5.020355e+06 7.687070e+06 5.555948e+06 8.872869e+06 1.554969e+07 7.250550e+06 2.119576e+07 1.114551e+07 4.988987e+06 7.751687e+06 9.823000e+06 9.920520e+06 8.830537e+06 1.204569e+07 5.161785e+06 9.276700e+06 7.665102e+06 7.333011e+06 1.012500e+07 4.628466e+06 6.582068e+06 3.501940e+06 4.413168e+06 6.685665e+06 3.928658e+06 6.388707e+06 7.976158e+06 6.802129e+06 6.502920e+06 9.610690e+06 5.785886e+06 4.435666e+06 1.007638e+07 5.949190e+06 9.062781e+06 8.510198e+06 8.542628e+06 8.951784e+06 7.650208e+06 1.271895e+07 8.098023e+06 7.344758e+06 6.644379e+06 9.269711e+06 7.357380e+06 8.689542e+06 7.797093e+06 8.113914e+06 6.926125e+06 8.649190e+06 9.128030e+06 7.868190e+06 5.044970e+06 4.426927e+06 4.698153e+06 9.048381e+06 6.931511e+06 5.450172e+06 6.991306e+06 8.724640e+06 6.950436e+06 2.220463e+07 1.068639e+07 5.810612e+06 8.119825e+06 4.140800e+06 7.436016e+06 3.521109e+06 5.085047e+06 1.135602e+07 7.556745e+06 4.746015e+06 1.178143e+07 6.286774e+06 6.794496e+06 8.171125e+06 7.595211e+06 1.131377e+07 7.507731e+06 4.321242e+06 5.961748e+06 6.996250e+06 4.909081e+06 8.655449e+06 7.845452e+06 9.458990e+06 8.173922e+06 9.805399e+06 7.613986e+06 6.914443e+06 5.720893e+06 1.076992e+07 9.626679e+06 7.687365e+06 7.988096e+06 1.151919e+07 6.355462e+06 7.983652e+06 6.836823e+06 1.089082e+07 5.070839e+06 8.530070e+06 1.152482e+07 8.486831e+06 6.034249e+06 8.687413e+06 9.338884e+06 6.671129e+06 6.485586e+06 1.335068e+07 9.458203e+06 4.352661e+06 6.995585e+06 1.489300e+07 1.222496e+07 5.674421e+06 1.000103e+07 5.943543e+06 5.912111e+06 1.123852e+07 8.759007e+06 8.265470e+06 7.890049e+06 7.631361e+06 5.165627e+06 8.027027e+06 1.657691e+07 1.081948e+07 9.467731e+06 1.219416e+07 1.082102e+07 7.969923e+06 3.484564e+06 9.224242e+06 1.528766e+07 "4-(2-Aminoethyl)benzenesulfonylfluoride (MS2 match, not predicted comp because of fluorine)_5.5" 1.871775e+06 2.112674e+07 2.101182e+07 2.045236e+07 4.022834e+05 1.681105e+07 1.882482e+07 9.770860e+06 459434.87 2.351767e+07 1.912372e+07 9.003411e+06 479405.66 3.515219e+07 1.473076e+07 9.395458e+06 4.773469e+05 3.369762e+07 1.616007e+07 8.878324e+06 4.345112e+05 3.146732e+07 1.928736e+07 1.108754e+07 64727.643 2.856477e+07 1.812361e+07 9.439775e+06 1.345619e+05 2.918709e+07 1.727430e+07 1.096220e+07 351068.15 3.172634e+07 1.966377e+07 8.107131e+06 4.084676e+05 2.610344e+07 1.919737e+07 8.244439e+06 2.361483e+05 2.828656e+07 1.687954e+07 1.435804e+07 2.617158e+05 3.215402e+07 2.070362e+07 1.311293e+07 3.727641e+05 5.668751e+05 3.597366e+05 4.934627e+05 5.826667e+05 5.599361e+05 4.595220e+05 3.967964e+05 4.645340e+05 4.501512e+05 5.573510e+05 5.033287e+05 5.370703e+05 3.634269e+05 4.939026e+05 5.044095e+05 6.029304e+06 5.320147e+05 4.579775e+05 5.686652e+05 4.730546e+05 4.820474e+05 3.967542e+05 4.290181e+05 8.591008e+06 5.167747e+05 5.708424e+05 5.067120e+05 4.560754e+05 1.086734e+06 4.822575e+05 5.025632e+05 5.434761e+05 4.370579e+05 5.559216e+05 4.980041e+05 3.981317e+05 3.645732e+05 2.749045e+06 5.176277e+05 4.514528e+05 5.699867e+06 6.237890e+05 5.052924e+05 5.015253e+05 5.218366e+05 3.842945e+05 4.725210e+05 4.609474e+05 4.454560e+05 4.742584e+05 4.843071e+05 4.864210e+05 5.179702e+05 4.494027e+05 5.707804e+05 5.844983e+05 5.131467e+05 5.375855e+05 5.679043e+05 4.863262e+05 5.548128e+05 5.129658e+05 6.905149e+06 4.836840e+05 3.952837e+05 4.725013e+05 4.697216e+05 4.519779e+05 5.518452e+06 5.727673e+05 5.446114e+05 3.897751e+05 4.070636e+05 3.708608e+05 5.488182e+06 3.571607e+06 5.664712e+05 5.130925e+05 4.010132e+05 4.793493e+05 9.045249e+06 5.088430e+05 5.553444e+05 3.552215e+05 6.696119e+05 5.438376e+05 4.499989e+05 3.461277e+05 4.683136e+05 5.080906e+05 5.463133e+06 3.827414e+05 4.921680e+05 4.784294e+06 4.852937e+05 4.651544e+05 5.599462e+05 3.812065e+05 5.696009e+05 5.025717e+05 5.979755e+05 4.703291e+05 5.211827e+05 4.525807e+05 5.211837e+05 4.709722e+05 8.082911e+06 5.508545e+05 5.427604e+05 4.732494e+05 4.855297e+05 5.459748e+05 5.486106e+05 4.725584e+05 3.762622e+05 5.410832e+05 4.897363e+05 5.458416e+05 4.095951e+05 4.020190e+05 5.325995e+05 5.146378e+05 4.905080e+05 5.445402e+05 5.083566e+05 3.850035e+05 5.005972e+05 5.258175e+05 5.065961e+05 5.013856e+05 5.383653e+06 3.801258e+07 3.380266e+08 6.409245e+07 1.937470e+07 2.561646e+08 3.411510e+07 2.786119e+07 4.568084e+07 1.147837e+07 4.639034e+07 1.025324e+08 5.033327e+08 4.888306e+08 9.614503e+06 6.611527e+08 6.421817e+07 2.690757e+08 2.876285e+08 9.385828e+07 3.766808e+07 1.354336e+07 6.168338e+07 9.908915e+05 3.522159e+06 4.147335e+07 6.684389e+06 1.120174e+07 4.022271e+07 1.573879e+07 3.938617e+06 2.426049e+07 2.147046e+07 5.310784e+07 2.799952e+07 1.390878e+08 9.494557e+06 4.831960e+06 9.637148e+06 1.351863e+06 1.349027e+07 7.436328e+07 2.493711e+07 1.328298e+07 2.693773e+06 1.120913e+06 2.113036e+06 2.543555e+06 5.882548e+08 4.164070e+06 3.033138e+07 1.741646e+06 1.575447e+08 4.154092e+08 1.997631e+07 2.860244e+06 2.007908e+07 2.990455e+07 6.596542e+08 2.506716e+07 4.034180e+05 4.622878e+05 4.922639e+05 4.871852e+05 4.914787e+05 5.609517e+05 3.494830e+05 5.257001e+05 5.258812e+05 4.515781e+05 4.797261e+05 5.459903e+05 5.009706e+05 5.290355e+05 4.980990e+05 4.766780e+05 5.084979e+05 4.929941e+05 6.613048e+05 4.996769e+05 5.386938e+05 5.154509e+05 4.519766e+05 C18 H43 N9 O12_5.5 4.053173e+06 1.728046e+06 2.204948e+06 1.932161e+06 1.946612e+05 1.468416e+06 2.570862e+06 1.900070e+06 126872.83 2.371698e+06 1.922062e+06 1.961534e+06 130325.07 1.844992e+06 2.174803e+06 1.996104e+06 1.390451e+05 1.885120e+06 2.023035e+06 1.784567e+06 1.219768e+05 1.839706e+06 2.105729e+06 3.083677e+06 17352.232 1.407919e+06 2.019730e+06 1.970413e+06 3.176677e+04 1.592831e+06 1.614267e+06 2.844012e+06 72692.80 1.712758e+06 2.183530e+06 1.996364e+06 1.036355e+05 1.802473e+06 2.224492e+06 2.178875e+06 7.622046e+04 1.558421e+06 1.996083e+06 2.313061e+06 9.539067e+04 1.811900e+06 1.725399e+06 2.258398e+06 1.884984e+06 2.955315e+06 9.834139e+05 3.611012e+06 1.892817e+06 2.066970e+06 2.717048e+06 3.421917e+06 2.097509e+06 3.834623e+06 3.877254e+06 2.071245e+06 2.292873e+06 4.098412e+06 4.909420e+06 3.722831e+06 3.130289e+06 1.456124e+06 2.137182e+06 1.514789e+06 2.176248e+06 2.618985e+06 3.236946e+06 2.993777e+06 2.383398e+06 1.755269e+06 3.928622e+06 1.724109e+06 1.979616e+06 3.993692e+06 3.853946e+06 2.309332e+06 1.673721e+06 1.668741e+06 9.365773e+05 1.745520e+06 1.533139e+06 2.159837e+06 1.491093e+06 8.818606e+05 1.605003e+06 1.740963e+06 1.965553e+06 1.909665e+06 1.711541e+06 1.462860e+06 1.676940e+06 2.319727e+06 1.865435e+06 2.544720e+06 2.375368e+06 1.482973e+06 1.609971e+06 1.940733e+06 1.276665e+06 1.062208e+06 1.474545e+06 1.946987e+06 1.076938e+06 1.461327e+06 4.498206e+06 1.701842e+06 1.181883e+06 1.615081e+06 2.046574e+06 1.712277e+06 2.742916e+06 1.516338e+06 1.646515e+06 2.259596e+06 1.831590e+06 2.333843e+06 1.486782e+06 9.350066e+05 7.354441e+05 9.923113e+05 1.700580e+06 1.809800e+06 2.081891e+06 1.556385e+06 1.852606e+06 1.767041e+06 2.098526e+06 5.316468e+06 1.799395e+06 4.723915e+06 3.322718e+06 1.491696e+06 2.156734e+06 2.279008e+06 2.594751e+06 3.014328e+06 3.059970e+06 1.120476e+06 2.555682e+06 1.966741e+06 2.052079e+06 2.041287e+06 1.183731e+06 1.405031e+06 9.955246e+05 1.101004e+06 1.541996e+06 1.050437e+06 1.630813e+06 2.102856e+06 2.001110e+06 1.776322e+06 2.130729e+06 1.613122e+06 1.090758e+06 2.585466e+06 1.400248e+06 1.309738e+06 1.956059e+06 2.065083e+06 1.962622e+06 2.134309e+06 2.947100e+06 2.242435e+06 1.918430e+06 1.704377e+06 2.364899e+06 1.963486e+06 1.916595e+06 1.778241e+06 1.961807e+06 1.627394e+06 2.346489e+06 2.216929e+06 2.122628e+06 1.447710e+06 8.984777e+05 1.489320e+06 2.436616e+06 1.614928e+06 2.229714e+06 1.837523e+06 1.937874e+06 1.865459e+06 5.463196e+06 3.262043e+06 1.463534e+06 2.112312e+06 1.215127e+06 1.719513e+06 7.479451e+05 1.160504e+06 2.736493e+06 1.539128e+06 1.068433e+06 3.370140e+06 1.707751e+06 1.759336e+06 2.208160e+06 1.694181e+06 3.026715e+06 2.555387e+06 1.522532e+06 1.497968e+06 1.447638e+06 1.523835e+06 1.807088e+06 2.028432e+06 2.269026e+06 2.064751e+06 2.442135e+06 2.391413e+06 1.895928e+06 1.640273e+06 2.373007e+06 2.435193e+06 1.662870e+06 1.882079e+06 2.705538e+06 1.866779e+06 2.040306e+06 1.412891e+06 2.497914e+06 1.043357e+06 2.100974e+06 2.843638e+06 2.075016e+06 1.809828e+06 1.737384e+06 2.274520e+06 1.550094e+06 1.710528e+06 2.831013e+06 1.901698e+06 1.868796e+06 1.765786e+06 3.374801e+06 2.924328e+06 1.179126e+06 2.500373e+06 2.113019e+06 1.462136e+06 2.830511e+06 1.924039e+06 2.138469e+06 1.671418e+06 2.128470e+06 1.362320e+06 1.758975e+06 4.376276e+06 3.312156e+06 2.132372e+06 2.770304e+06 3.064242e+06 2.041579e+06 7.488867e+05 2.193600e+06 3.972857e+06 C5 H20 N8 O6_5.501 1.503125e+07 5.678320e+06 7.419080e+06 7.472538e+06 1.793675e+05 6.015469e+06 8.993468e+06 7.689871e+06 116591.77 7.552208e+06 7.417861e+06 7.020842e+06 120629.68 6.565339e+06 7.150135e+06 7.943891e+06 1.298621e+05 7.400137e+06 6.093396e+06 7.414718e+06 1.159773e+05 6.056842e+06 7.689211e+06 1.033879e+07 16512.594 5.565745e+06 7.718802e+06 7.098971e+06 3.103043e+04 5.698382e+06 6.802367e+06 8.660890e+06 75296.73 6.915908e+06 7.106303e+06 6.930591e+06 9.973826e+04 6.517693e+06 8.198496e+06 8.590291e+06 6.508039e+04 5.771522e+06 7.545629e+06 7.807816e+06 8.277169e+04 6.510500e+06 6.324781e+06 8.008388e+06 6.367350e+06 1.153470e+07 4.618513e+06 1.264483e+07 7.742308e+06 8.588229e+06 1.025068e+07 1.102341e+07 9.162148e+06 1.528343e+07 1.286057e+07 7.548184e+06 8.967384e+06 1.483023e+07 1.559541e+07 1.419552e+07 9.585662e+06 4.877382e+06 7.681935e+06 6.253692e+06 9.158302e+06 1.052031e+07 1.110842e+07 1.022310e+07 8.310974e+06 7.368309e+06 8.845979e+06 7.448928e+06 7.639616e+06 1.456175e+07 1.296804e+07 7.841671e+06 6.587435e+06 5.709361e+06 4.166407e+06 6.994661e+06 5.399693e+06 7.864958e+06 4.855390e+06 4.581711e+06 6.276620e+06 6.541532e+06 7.558421e+06 7.841474e+06 5.595929e+06 4.677183e+06 5.297476e+06 8.452020e+06 6.932529e+06 7.699691e+06 7.819564e+06 5.560066e+06 6.080184e+06 7.876516e+06 4.889595e+06 4.797014e+06 4.662741e+06 6.913740e+06 4.478078e+06 5.847046e+06 1.759826e+07 7.714891e+06 4.796833e+06 6.749882e+06 8.042179e+06 5.749134e+06 8.407932e+06 5.257725e+06 6.068511e+06 8.635194e+06 6.538452e+06 1.006533e+07 3.521648e+06 2.752005e+06 2.437385e+06 3.513250e+06 4.895880e+06 5.618836e+06 7.460482e+06 4.623217e+06 6.262376e+06 5.473198e+06 8.822847e+06 1.118734e+07 5.515396e+06 1.736604e+07 1.046987e+07 5.231417e+06 6.351393e+06 8.411240e+06 9.056768e+06 1.075264e+07 9.105399e+06 4.216559e+06 8.506515e+06 7.800168e+06 7.109420e+06 8.331409e+06 3.863799e+06 6.040462e+06 3.668468e+06 4.302474e+06 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4.068479e+06 7.540095e+06 9.216520e+06 7.705642e+06 5.608602e+06 6.674273e+06 8.553481e+06 5.734767e+06 5.228129e+06 1.136394e+07 7.488174e+06 7.013107e+06 6.558996e+06 1.168315e+07 1.117449e+07 4.807143e+06 8.745804e+06 7.384986e+06 5.048110e+06 9.294632e+06 8.395821e+06 6.867754e+06 6.434002e+06 6.554457e+06 5.229601e+06 6.932806e+06 1.328578e+07 1.012958e+07 8.221582e+06 1.039763e+07 1.152342e+07 6.653359e+06 2.898085e+06 9.252012e+06 1.474439e+07 C27 H49 N2 O7 P S_5.501 2.092903e+07 6.081193e+06 1.003017e+07 9.786532e+06 2.021329e+05 5.583149e+06 1.147170e+07 9.616689e+06 120949.36 9.055885e+06 8.855986e+06 8.626790e+06 123025.80 8.024913e+06 8.847867e+06 9.473400e+06 1.337069e+05 8.923659e+06 7.424431e+06 9.085473e+06 1.221921e+05 8.066356e+06 8.392502e+06 1.266978e+07 17672.755 7.016518e+06 9.266592e+06 8.835674e+06 3.753444e+04 6.421796e+06 8.646024e+06 1.072807e+07 77542.56 7.833255e+06 9.586132e+06 9.357538e+06 1.093893e+05 8.206499e+06 7.351317e+06 1.071132e+07 7.410020e+04 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2.735612e+06 2.283227e+06 4.447562e+06 3.693050e+06 3.777246e+06 3.097033e+06 5.256149e+06 4.856322e+06 3.229225e+06 3.354415e+06 1.982544e+06 3.432106e+06 1.354398e+06 4.123593e+06 2.318217e+06 4.803018e+06 1.884594e+06 1.992620e+06 2.770188e+06 2.298322e+06 1.452588e+06 3.102378e+06 2.150476e+06 3.704702e+06 1.696513e+06 2.815269e+06 2.822189e+06 4.344474e+06 2.604779e+06 1.987848e+05 3.755028e+06 1.984975e+06 2.788994e+06 6.175827e+06 2.220357e+06 4.489909e+06 4.454803e+06 3.117971e+06 1.768296e+06 2.134405e+06 5.118172e+06 2.958595e+06 3.311145e+06 4.369019e+06 2.067777e+06 4.105916e+06 9.895512e+05 5.187692e+06 4.412650e+06 4.920458e+06 1.945498e+06 1.715889e+06 1.459006e+06 2.406735e+06 3.075101e+06 4.553274e+06 3.225401e+06 6.067422e+06 1.377407e+06 5.290188e+06 3.505515e+06 2.570364e+06 2.262624e+06 1.097461e+06 2.261666e+06 3.769428e+06 1.572567e+06 3.401606e+06 1.723790e+06 1.612536e+06 3.491967e+06 3.203586e+06 3.298145e+06 4.476529e+06 3.827193e+06 3.203928e+06 3.056984e+06 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2.275717e+07 2.016642e+07 2.290639e+07 2.647257e+07 2.474765e+07 2.155966e+07 1.148450e+07 1.782068e+07 1.920477e+07 1.903784e+07 2.519209e+07 1.828557e+07 2.758677e+07 1.824440e+07 2.168632e+07 2.289744e+07 1.814319e+07 1.079763e+07 1.923771e+07 1.346288e+07 1.412035e+07 1.379674e+07 1.642072e+07 1.990974e+07 1.734542e+07 2.244422e+07 2.476171e+07 1.503936e+07 1.564707e+07 2.203102e+07 1.181872e+07 1.934773e+07 3.062481e+07 1.878682e+07 2.007785e+07 2.711901e+07 2.093482e+07 1.509933e+07 1.894165e+07 2.159677e+07 2.648930e+07 2.139602e+07 2.799381e+07 2.008595e+07 1.957194e+07 1.455868e+07 1.813188e+07 2.253883e+07 1.988852e+07 1.506706e+07 2.444904e+07 1.488218e+07 2.346936e+07 2.212633e+07 2.191327e+07 1.972791e+07 1.856663e+07 1.394601e+07 2.605534e+07 2.152402e+07 4.427829e+06 1.447902e+07 2.057746e+07 1.915917e+07 2.074401e+07 1.863645e+07 2.338877e+07 1.594169e+07 2.120721e+07 2.134786e+07 3.510820e+07 1.585998e+07 2.299271e+07 2.103833e+07 2.378717e+07 2.269900e+07 3.253982e+07 1.344175e+07 1.949525e+07 2.444460e+07 1.870348e+07 1.660861e+07 1.081419e+07 1.652692e+07 1.656206e+07 1.475492e+07 2.101790e+07 2.422987e+07 1.729090e+07 1.806251e+07 2.241693e+07 2.009307e+07 1.163684e+07 1.682768e+07 2.370568e+07 2.247093e+07 2.459045e+07 2.819489e+07 C5 H15 N6 O3 P3_5.58 3.531405e+07 1.869263e+07 1.561255e+07 1.279849e+07 2.142889e+05 1.273586e+07 2.163061e+07 1.999053e+07 128991.04 1.958753e+07 1.991902e+07 1.263489e+07 137612.62 1.797622e+07 8.619019e+06 2.203028e+07 1.511305e+05 1.821091e+07 1.599776e+07 2.001037e+07 1.472969e+05 1.731310e+07 1.083615e+07 2.502962e+07 22026.359 1.852781e+07 1.654801e+07 1.333192e+07 4.907036e+04 7.926153e+06 2.452396e+07 1.607865e+07 82420.97 1.794196e+07 1.798335e+07 2.064757e+07 9.728878e+04 1.314705e+07 1.925233e+07 1.217998e+07 8.577411e+04 2.108037e+07 1.459209e+07 1.873311e+07 9.905099e+04 2.019989e+07 1.193918e+07 1.969267e+07 1.937444e+07 1.996921e+07 1.127522e+07 2.024058e+07 1.521925e+07 1.711145e+07 2.520344e+07 1.902275e+07 3.034135e+07 2.323119e+07 1.956066e+07 3.064686e+07 3.178431e+07 2.042498e+07 1.442182e+07 1.489095e+07 1.976326e+07 2.064914e+07 2.847288e+07 1.721346e+07 1.769122e+07 4.232797e+07 1.946113e+07 1.515073e+07 2.153275e+07 1.190689e+07 3.183777e+07 2.287586e+07 3.018795e+07 2.304151e+07 1.722800e+07 1.458348e+07 1.517377e+07 2.285071e+07 7.005256e+06 1.693489e+07 1.325757e+07 1.387934e+07 1.413683e+07 8.989137e+06 1.983480e+07 1.811195e+07 2.596569e+07 1.499313e+07 2.125133e+07 9.876956e+06 2.276416e+07 1.588096e+07 1.375102e+07 1.661439e+07 1.713958e+07 2.102227e+07 1.549766e+07 2.330382e+07 1.537409e+07 9.993494e+06 6.141384e+06 1.108088e+07 2.237622e+07 3.406845e+07 2.401826e+07 2.278197e+07 1.636009e+07 1.087152e+07 1.998590e+07 1.813913e+07 1.962894e+07 2.661068e+07 1.900870e+07 1.620541e+07 2.652957e+07 2.091495e+07 1.408662e+07 1.243711e+07 1.961050e+07 1.625812e+07 2.158564e+07 1.174779e+07 1.751541e+07 1.210773e+07 7.174567e+06 7.568388e+06 2.414748e+07 1.502154e+07 1.712670e+07 2.087619e+07 2.254093e+07 1.429794e+07 1.303728e+07 2.297198e+07 1.701516e+07 2.140973e+07 1.387457e+07 3.736207e+07 8.724185e+06 1.418401e+07 2.100856e+07 1.860439e+07 6.881689e+06 1.765393e+07 1.883211e+07 9.022011e+06 8.165706e+06 2.219713e+07 1.666373e+07 3.324752e+07 1.966661e+07 1.488163e+07 1.083132e+07 6.410394e+06 2.230300e+07 2.180365e+07 1.779870e+07 2.065079e+07 1.504887e+07 1.119657e+07 1.303364e+07 2.160906e+07 1.951115e+07 2.501602e+07 1.751289e+07 2.036102e+07 8.519909e+06 1.731258e+07 1.730166e+07 1.116683e+07 2.277941e+07 1.386467e+07 2.523129e+07 2.065851e+07 1.890183e+07 2.180959e+07 1.467575e+07 1.057132e+07 1.539699e+07 1.161136e+07 2.318797e+07 1.498903e+07 1.338408e+07 2.067793e+07 1.207916e+07 1.202285e+07 2.920522e+07 1.800464e+07 1.047930e+07 1.212889e+07 7.307896e+06 1.906441e+07 1.850647e+07 2.342935e+07 1.650044e+07 2.487350e+07 1.626675e+07 6.839427e+06 1.679148e+07 2.177957e+07 2.189850e+07 2.102738e+07 3.077848e+07 1.398090e+07 2.339611e+07 1.087165e+07 1.694297e+07 2.357052e+07 2.357354e+07 1.262228e+07 2.476111e+07 1.497971e+07 2.123910e+07 1.696967e+07 1.484414e+07 1.722281e+07 1.463103e+07 1.324223e+07 3.037452e+07 1.824764e+07 6.235164e+06 1.325441e+07 1.548449e+07 1.850981e+07 2.122777e+07 1.508715e+07 2.803747e+07 1.139563e+07 2.164944e+07 1.562901e+07 3.154388e+07 1.469658e+07 2.204707e+07 2.128745e+07 1.670139e+07 1.796355e+07 3.341563e+07 1.496498e+07 1.516485e+07 1.885873e+07 1.851295e+07 1.212251e+07 2.962257e+07 2.386435e+07 1.219985e+07 5.365880e+06 1.661187e+07 2.011458e+07 2.240643e+07 1.803824e+07 2.138384e+07 1.851448e+07 1.115964e+07 1.188062e+07 3.281985e+07 2.764073e+07 2.804184e+07 2.432176e+07 C9 H11 N9 O4 S_5.582 4.582605e+07 1.013340e+07 2.621249e+07 1.517042e+07 2.276078e+05 1.310746e+07 2.600838e+07 2.145121e+07 128466.02 1.904695e+07 2.080085e+07 1.835993e+07 132027.97 1.897496e+07 1.475758e+07 1.902642e+07 1.545019e+05 1.897612e+07 1.666969e+07 2.120750e+07 1.432847e+05 1.725585e+07 1.897957e+07 2.512280e+07 18892.974 1.550086e+07 2.006324e+07 1.911094e+07 4.025365e+04 1.397555e+07 2.048577e+07 1.939181e+07 80823.30 1.955907e+07 2.052196e+07 1.947508e+07 1.067660e+05 1.686225e+07 1.545001e+07 2.089524e+07 9.041496e+04 1.811802e+07 2.125383e+07 2.180376e+07 1.057699e+05 1.810202e+07 1.440980e+07 2.084614e+07 2.169642e+07 2.219090e+07 1.658037e+07 2.299642e+07 1.636677e+07 2.002353e+07 2.725089e+07 1.586509e+07 2.175719e+07 2.627564e+07 2.052974e+07 3.016879e+07 2.329765e+07 2.090899e+07 1.864831e+07 2.078625e+07 2.065417e+07 2.033271e+07 2.791918e+07 1.027218e+07 1.910611e+07 1.411836e+07 2.157272e+07 2.242667e+07 3.018767e+07 9.431636e+06 2.454146e+07 1.971419e+07 2.497345e+07 1.618915e+07 2.612280e+07 1.902456e+07 1.681630e+07 2.368760e+07 1.282547e+07 1.917205e+07 1.326422e+07 3.031849e+07 1.676063e+07 8.494286e+06 1.557871e+07 2.321672e+07 2.420467e+07 1.977612e+07 1.634076e+07 1.425741e+07 2.308873e+07 2.098244e+07 1.423305e+07 2.102620e+07 1.660075e+07 3.361519e+07 1.903877e+07 1.705624e+07 1.634650e+07 1.061623e+07 1.076112e+07 1.073804e+07 1.492219e+07 2.312511e+07 2.041117e+07 1.941623e+07 2.540123e+07 1.767008e+07 1.829352e+07 1.487956e+07 2.090098e+07 3.101528e+07 1.466183e+07 1.322722e+07 2.060740e+07 2.300741e+07 1.288979e+07 2.207565e+07 1.852431e+07 1.785355e+07 1.817629e+07 2.334937e+07 1.842468e+07 2.031689e+07 2.120319e+07 1.124119e+07 1.088234e+07 1.353880e+07 1.851531e+07 1.809667e+07 2.468643e+07 1.334721e+07 1.467696e+07 1.398562e+07 1.559628e+07 1.737698e+07 1.811840e+07 1.913345e+07 1.640211e+07 1.094574e+07 2.322553e+07 1.670547e+07 8.107475e+06 1.882231e+07 2.164023e+07 8.394525e+06 1.242728e+07 1.753893e+07 2.499258e+07 1.693974e+07 1.565874e+07 1.781021e+07 1.674011e+07 1.145613e+07 1.534966e+07 1.904324e+07 2.252642e+07 1.020529e+07 1.494180e+07 1.263618e+07 1.543070e+07 2.289062e+07 2.068101e+07 2.371086e+07 2.087118e+07 2.103006e+07 1.219115e+07 1.428255e+07 1.418516e+07 1.127961e+07 2.626412e+07 1.957134e+07 3.045675e+07 9.357881e+06 1.936305e+07 2.054152e+07 1.202454e+07 1.503234e+07 1.927846e+07 1.206212e+07 2.052331e+07 9.389582e+06 1.634705e+07 2.272249e+07 1.677035e+07 1.407584e+07 2.052222e+07 1.552782e+07 1.320875e+07 2.046983e+07 8.946389e+06 2.737483e+07 2.899454e+07 1.903548e+07 1.844790e+07 2.713498e+07 2.591681e+07 9.280267e+06 1.464886e+07 2.059744e+07 2.109773e+07 2.142760e+07 1.908974e+07 1.787777e+07 1.936845e+07 1.001617e+07 1.505307e+07 2.081524e+07 2.018571e+07 1.616426e+07 2.493655e+07 2.031326e+07 2.225432e+07 2.073602e+07 1.950532e+07 1.554299e+07 1.579295e+07 1.728553e+07 2.424985e+07 1.792345e+07 4.826601e+06 1.537715e+07 1.920002e+07 1.653721e+07 1.816963e+07 1.690893e+07 2.060331e+07 1.603848e+07 2.201995e+07 2.262529e+07 2.735627e+07 1.631066e+07 1.581771e+07 2.204506e+07 2.256745e+07 2.274124e+07 4.940663e+07 1.969923e+07 1.247088e+07 1.925013e+07 1.179536e+07 1.310047e+07 2.615327e+07 2.016418e+07 1.456305e+07 1.270953e+07 1.924939e+07 2.656532e+07 2.322379e+07 2.126968e+07 2.516283e+07 1.640764e+07 9.324323e+06 1.515529e+07 2.365483e+07 1.836388e+07 2.330838e+07 2.598615e+07 C17 H5 N3 O3_5.582 2.496593e+06 2.257713e+06 2.476797e+06 2.382847e+06 1.978073e+05 2.795399e+06 2.164063e+06 2.628620e+06 185940.81 2.189322e+06 2.349244e+06 2.642382e+06 181872.46 2.342627e+06 2.500579e+06 2.289059e+06 1.840711e+05 2.302327e+06 2.594377e+06 2.231488e+06 1.714064e+05 2.949720e+06 2.111302e+06 2.175703e+06 23126.920 2.997417e+06 1.745727e+06 2.040531e+06 4.075809e+04 3.146889e+06 2.013779e+06 2.787574e+06 72854.15 2.938939e+06 1.714845e+06 1.884776e+06 9.116533e+04 3.471089e+06 2.013394e+06 2.277791e+06 8.410651e+04 3.098201e+06 1.932832e+06 2.335325e+06 1.021159e+05 2.107096e+06 3.161889e+06 2.121348e+06 2.615364e+06 2.188866e+06 2.028385e+06 2.118945e+06 1.464335e+06 1.762760e+06 4.021427e+06 2.165943e+06 2.477404e+06 2.876199e+06 3.030061e+06 3.061726e+06 1.292071e+06 2.388671e+06 2.402619e+06 1.798040e+06 2.219272e+06 1.361639e+06 3.014102e+06 1.899331e+06 2.559125e+06 2.201593e+06 3.868470e+06 2.245743e+06 3.160244e+06 1.665567e+06 2.926653e+06 1.808798e+06 2.429978e+06 1.900036e+06 3.213178e+06 1.682938e+06 2.204727e+06 2.823483e+06 1.904992e+06 2.569865e+06 2.033122e+06 2.663159e+06 1.312677e+06 8.470735e+05 2.021588e+06 2.547749e+06 2.100743e+06 2.248673e+06 1.928604e+06 1.529205e+06 2.103766e+06 1.642932e+06 1.323818e+06 2.759600e+06 1.819344e+06 2.970720e+06 2.310212e+06 1.947439e+06 1.961028e+06 1.734020e+06 1.174385e+06 1.042066e+06 2.401041e+06 2.371178e+06 2.313286e+06 1.765878e+06 2.340581e+06 1.966591e+06 1.979817e+06 2.143607e+06 2.257624e+06 2.957048e+06 2.227702e+06 1.898299e+06 2.113071e+06 1.888634e+06 2.018130e+06 1.870819e+06 1.815569e+06 1.801209e+06 2.183124e+06 1.821416e+06 2.366992e+06 1.626326e+06 2.732172e+06 1.240451e+06 1.919463e+06 2.328024e+06 1.498164e+06 1.622623e+06 2.382802e+06 3.275755e+06 2.386360e+06 2.654382e+06 2.449460e+06 2.580215e+06 1.506952e+06 2.952284e+06 1.795138e+06 1.914217e+06 2.229024e+06 1.848241e+06 1.148099e+06 2.171440e+06 2.802902e+06 9.671388e+05 1.158524e+06 2.081168e+06 2.157151e+06 1.553034e+06 2.165498e+06 2.159445e+06 1.742999e+06 1.953465e+06 1.742462e+06 2.294815e+06 2.487280e+06 2.566315e+06 2.783899e+06 2.365387e+06 2.220593e+06 2.226441e+06 2.141747e+06 2.174278e+06 2.061792e+06 2.250290e+06 1.700714e+06 1.983890e+06 1.867800e+06 2.010480e+06 2.483049e+06 2.406734e+06 2.506547e+06 1.691212e+06 2.579222e+06 2.583010e+06 1.553217e+06 1.562051e+06 1.635836e+06 1.637828e+06 2.004770e+06 1.531087e+06 1.643802e+06 1.823631e+06 1.993901e+06 1.935335e+06 2.583568e+06 1.848304e+06 1.480967e+06 2.327942e+06 9.278634e+05 3.966256e+06 2.472807e+06 1.899404e+06 1.514074e+06 2.429678e+06 3.017905e+06 1.571644e+06 1.807373e+06 2.352324e+06 2.958564e+06 3.086348e+06 2.592941e+06 2.025976e+06 2.353999e+06 2.697806e+06 1.481556e+06 2.167211e+06 2.087781e+06 1.853081e+06 2.517925e+06 2.531011e+06 1.394782e+06 2.249846e+06 2.437849e+06 2.097483e+06 2.088645e+06 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3.055938e+06 3.323940e+06 2.991019e+06 2.557492e+06 3.132579e+06 1.696343e+06 5.805433e+06 3.986939e+06 2.613580e+06 2.417434e+06 4.140095e+06 5.006346e+06 2.099553e+06 2.250862e+06 3.134696e+06 4.099680e+06 3.725775e+06 2.529939e+06 3.406532e+06 2.659508e+06 1.796036e+06 2.580919e+06 2.657922e+06 2.773164e+06 2.070371e+06 3.277781e+06 1.766703e+06 3.160837e+06 2.608645e+06 2.363237e+06 2.880828e+06 3.253445e+06 2.566197e+06 3.585446e+06 2.318978e+06 6.730450e+05 2.452754e+06 3.089998e+06 2.433286e+06 2.820810e+06 2.795710e+06 3.499018e+06 2.409554e+06 3.114707e+06 3.017611e+06 3.404257e+06 2.485017e+06 2.229283e+06 3.179478e+06 4.485840e+06 3.450548e+06 4.218573e+06 2.459608e+06 1.714925e+06 4.255116e+06 3.151075e+06 2.462560e+06 3.800980e+06 2.862146e+06 2.539996e+06 2.943618e+06 4.035305e+06 4.455129e+06 3.931260e+06 3.430916e+06 4.239163e+06 3.084259e+06 2.068160e+06 2.120306e+06 4.148222e+06 2.035233e+06 3.619232e+06 6.056729e+06 C7 H4 N2 O3 S_5.583 5.289434e+06 2.477187e+06 3.269686e+06 2.161870e+06 2.457373e+05 2.558221e+06 3.686740e+06 3.295329e+06 160411.42 2.954753e+06 2.781002e+06 2.730686e+06 154683.23 2.364334e+06 2.856357e+06 3.509403e+06 1.576817e+05 2.676082e+06 2.757604e+06 2.452018e+06 1.556365e+05 3.583060e+06 2.091114e+06 3.780829e+06 31856.260 2.321089e+06 3.052485e+06 3.064338e+06 4.323961e+04 2.485783e+06 2.690888e+06 3.696550e+06 85075.26 2.508223e+06 2.833550e+06 2.943683e+06 1.301499e+05 2.282005e+06 2.643965e+06 3.831302e+06 8.311344e+04 2.604487e+06 2.773292e+06 3.309811e+06 1.531301e+05 2.618457e+06 2.625799e+06 2.903643e+06 3.027076e+06 2.407862e+06 4.946566e+06 3.047282e+06 2.103303e+06 3.025085e+06 2.919182e+06 3.686390e+06 4.063608e+06 3.973616e+06 2.642901e+06 2.736736e+06 3.399998e+06 4.005634e+06 2.852323e+06 3.835088e+06 2.707886e+06 3.072099e+06 3.831605e+06 3.154132e+06 2.903751e+06 4.580265e+06 3.243881e+06 3.204817e+06 3.582571e+06 3.591158e+06 4.516551e+06 2.714909e+06 4.639815e+06 3.487531e+06 1.745232e+06 4.253714e+06 2.830424e+06 3.385435e+06 2.935048e+06 2.673024e+06 2.058417e+06 3.527786e+06 2.878553e+06 1.161469e+06 3.656071e+06 3.008259e+06 3.405620e+06 2.985059e+06 2.644397e+06 2.254651e+06 5.102297e+06 2.877575e+06 2.009164e+06 3.147204e+06 2.199749e+06 5.636764e+06 2.684839e+06 2.519992e+06 3.119753e+06 4.742475e+06 1.797469e+06 1.777311e+06 2.842240e+06 5.267048e+06 3.753638e+06 2.770399e+06 3.579239e+06 2.918300e+06 4.033687e+06 2.815722e+06 2.971799e+06 4.394944e+06 3.300998e+06 2.317968e+06 3.372354e+06 3.076574e+06 1.740212e+06 2.830359e+06 2.181572e+06 2.752465e+06 2.843745e+06 2.385367e+06 3.133377e+06 2.788373e+06 3.046956e+06 1.425590e+06 2.927533e+06 3.618068e+06 4.090222e+06 4.085976e+06 3.225473e+06 3.473367e+06 2.147109e+06 5.422287e+06 3.570123e+06 3.570708e+06 2.293587e+06 5.467234e+06 2.497753e+06 1.605094e+06 3.262567e+06 4.059012e+06 1.488594e+06 4.041125e+06 3.062326e+06 1.149861e+06 1.207798e+06 3.471273e+06 3.379185e+06 3.409838e+06 3.446214e+06 2.338610e+06 2.938923e+06 2.611309e+06 3.476849e+06 3.415435e+06 3.539281e+06 3.339497e+06 3.635721e+06 3.191503e+06 2.988137e+06 2.771246e+06 4.025902e+06 3.962559e+06 2.736802e+06 3.453497e+06 1.554967e+06 2.967084e+06 3.016092e+06 3.854832e+06 3.114895e+06 3.116160e+06 4.052958e+06 2.097383e+06 2.712842e+06 1.575662e+06 2.153376e+06 1.982121e+06 2.989826e+06 2.666305e+06 3.071257e+06 1.687417e+06 2.071209e+06 2.999532e+06 2.595322e+06 2.399918e+06 5.573557e+06 2.296627e+06 5.211586e+06 2.568667e+06 1.335943e+06 5.588891e+06 3.566555e+06 5.083598e+06 7.279230e+06 2.708130e+06 3.831037e+06 2.090799e+06 2.696929e+06 2.689611e+06 4.778422e+06 2.509728e+06 3.379784e+06 2.880826e+06 3.390007e+06 1.329926e+06 2.701637e+06 3.696873e+06 3.285436e+06 2.683204e+06 3.551599e+06 2.505692e+06 3.162238e+06 3.501768e+06 2.507162e+06 3.258968e+06 2.940720e+06 2.266930e+06 4.076601e+06 2.495338e+06 6.981899e+05 2.105482e+06 3.432464e+06 2.505651e+06 2.622966e+06 2.874621e+06 3.479845e+06 1.707619e+06 3.614651e+06 2.409161e+06 4.924484e+06 2.490505e+06 3.668712e+06 3.262830e+06 3.625868e+06 3.395800e+06 5.155551e+06 3.429243e+06 3.577429e+06 3.802029e+06 3.296201e+06 2.603170e+06 5.186744e+06 3.220945e+06 2.973600e+06 2.089254e+06 2.719069e+06 3.947219e+06 2.575886e+06 2.864502e+06 3.453008e+06 3.628049e+06 1.615442e+06 2.220918e+06 3.662718e+06 2.927178e+06 3.390245e+06 3.281332e+06 C21 H36 N10 O_5.585 5.494181e+05 1.042087e+06 1.502097e+06 4.016849e+05 3.915804e+05 8.443903e+05 1.222986e+06 1.448298e+06 178031.46 1.259811e+06 1.067285e+06 1.197180e+06 168166.76 1.046561e+06 9.029449e+05 1.184519e+06 1.829478e+05 9.620441e+05 1.082663e+06 1.303893e+06 1.636531e+05 8.630882e+05 1.110002e+06 1.685260e+06 22221.423 9.625702e+05 9.119885e+05 1.082311e+06 5.084298e+04 9.060306e+05 9.732305e+05 1.528506e+06 100637.10 1.129548e+06 1.053409e+06 9.287928e+05 1.253242e+05 1.064582e+06 1.105592e+06 1.383215e+06 1.007420e+05 1.004196e+06 1.045001e+06 1.324010e+06 1.127871e+05 9.648580e+05 9.806750e+05 1.202916e+06 1.410061e+05 1.795021e+05 1.356435e+05 1.676273e+05 1.841478e+05 1.847916e+05 1.595156e+05 1.340783e+05 1.666418e+05 1.702614e+05 1.872392e+05 1.684878e+05 2.217605e+05 1.415407e+05 1.742701e+05 1.831715e+05 1.641844e+05 1.478440e+05 1.659979e+05 1.928928e+05 1.681521e+05 1.601377e+05 1.814437e+05 1.760879e+05 1.281782e+05 1.724562e+05 1.895070e+05 1.875468e+05 1.768209e+05 1.597215e+05 1.683888e+05 1.754203e+05 1.620897e+05 1.647721e+05 1.803511e+05 1.789151e+05 1.599860e+05 1.513622e+05 1.684858e+05 1.898901e+05 1.646976e+05 1.621454e+05 1.913736e+05 1.713044e+05 1.729001e+05 1.702895e+05 1.543966e+05 1.671412e+05 1.554241e+05 1.493140e+05 1.740755e+05 1.683223e+05 1.836660e+05 1.839260e+05 1.692974e+05 1.762476e+05 1.875661e+05 1.902499e+05 1.824852e+05 1.815962e+05 1.813241e+05 1.943357e+05 1.826714e+05 1.576963e+05 1.686527e+05 1.460786e+05 1.634848e+05 2.581619e+05 1.562142e+05 1.627808e+05 1.728058e+05 1.876830e+05 1.470220e+05 1.579984e+05 1.573473e+05 1.887282e+05 1.474276e+05 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1.830914e+05 2.690160e+06 4.809055e+06 1.585761e+06 3.336537e+06 4.302749e+06 6.231130e+06 2.310292e+06 2.043679e+06 4.433986e+06 3.434707e+06 4.590493e+06 5.134011e+06 4.002539e+06 6.358029e+06 4.111672e+06 3.526381e+06 3.590770e+06 4.435635e+06 3.147275e+06 4.989451e+06 1.978329e+06 1.536212e+06 2.109923e+06 3.820623e+06 5.173355e+06 3.074154e+06 4.402110e+06 3.989966e+06 3.158897e+06 3.453056e+06 3.373877e+06 4.739635e+06 4.715926e+06 4.454603e+06 3.602843e+06 3.541610e+06 2.321825e+05 1.630787e+05 1.896114e+05 1.654625e+05 2.485155e+05 2.066923e+05 1.536519e+05 1.854603e+05 1.781138e+05 1.640274e+05 1.668795e+05 1.430955e+05 2.005899e+05 1.616587e+05 1.926910e+05 2.327215e+05 1.760352e+05 2.009725e+05 2.238752e+05 1.676301e+05 1.823645e+05 1.990345e+05 1.668342e+05 C10 H12 N2 O_5.586 1.769658e+08 1.001484e+06 8.662270e+05 7.327949e+05 4.997689e+05 6.137983e+05 1.016129e+06 1.341602e+06 272909.74 9.308115e+05 7.874451e+05 9.370238e+05 292722.49 7.491947e+05 1.048965e+06 9.671647e+05 3.338670e+05 8.744828e+05 7.600062e+05 1.260224e+06 2.262700e+05 5.512848e+05 1.014171e+06 1.274977e+06 211370.810 7.400243e+05 8.208912e+05 9.091551e+05 7.834716e+04 8.350212e+05 8.902134e+05 1.173214e+06 168131.40 8.158796e+05 8.717237e+05 8.936168e+05 2.971684e+05 9.256849e+05 9.126373e+05 9.373980e+05 1.457933e+05 7.620077e+05 9.223327e+05 1.097384e+06 1.725996e+05 1.044217e+06 7.999024e+05 8.880884e+05 2.488383e+05 6.104269e+05 2.129985e+05 2.897741e+05 1.010455e+06 3.184658e+05 2.110562e+05 1.857486e+06 2.309603e+05 2.250347e+05 1.199422e+06 5.739842e+05 3.654336e+05 1.770866e+05 2.269249e+05 3.786728e+05 3.473891e+05 1.848971e+05 4.584583e+05 3.215515e+05 3.233044e+05 4.121955e+05 2.417399e+05 4.187070e+05 1.735591e+05 2.423492e+05 2.885817e+05 4.424360e+05 2.841861e+05 2.431403e+05 2.218377e+05 4.722436e+05 2.177169e+05 2.209761e+05 4.264197e+05 3.258923e+05 3.032233e+05 2.096929e+05 2.345039e+05 2.356676e+05 3.071621e+05 2.338447e+05 3.144239e+05 3.670795e+05 3.058044e+05 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3.851487e+05 3.588891e+05 4.532491e+05 2.385180e+05 2.292574e+05 1.097043e+06 6.826680e+05 3.346704e+05 3.562997e+05 2.289246e+05 1.240519e+06 1.980743e+05 5.628390e+07 2.429956e+05 3.402387e+05 1.140609e+06 3.193427e+05 2.392317e+05 2.769715e+05 2.321799e+05 2.939357e+05 3.556655e+05 6.283356e+05 3.586884e+05 2.706104e+05 2.323792e+05 1.876431e+05 3.961044e+05 3.170490e+05 2.690516e+05 3.567758e+05 2.266424e+05 2.903524e+05 3.390664e+05 3.860869e+05 2.598420e+05 3.413122e+05 3.846548e+05 2.278846e+05 3.428950e+05 8.406749e+05 4.774879e+05 6.451332e+05 4.014961e+05 2.080948e+05 3.225994e+05 1.869737e+05 2.071835e+05 3.796299e+05 2.384428e+05 2.345995e+05 3.115936e+05 3.891298e+05 3.492076e+05 2.624560e+05 3.796200e+05 4.493627e+05 2.733892e+05 2.705279e+05 3.292459e+05 3.229001e+05 1.873174e+05 4.398465e+05 2.207607e+05 6.245619e+05 2.968281e+05 5.583289e+05 4.761802e+05 4.811222e+05 5.078572e+05 2.758323e+05 2.542257e+05 2.995518e+05 3.300303e+05 2.620329e+05 2.507676e+05 4.320138e+05 3.485137e+05 2.187435e+05 2.046237e+05 1.975560e+05 6.761023e+05 3.604232e+05 3.674322e+05 4.347416e+05 2.331825e+05 3.429187e+05 3.478688e+05 2.758786e+05 2.824274e+05 3.245293e+05 2.992600e+05 C10 H15 N O_5.62 4.535506e+05 2.167209e+06 2.155385e+06 2.014590e+06 3.813802e+05 1.582159e+06 2.343956e+06 2.803809e+06 285424.70 1.762749e+06 2.128489e+06 2.182006e+06 318199.46 1.784656e+06 2.083503e+06 2.235390e+06 3.345777e+05 2.059439e+06 1.968039e+06 2.158745e+06 3.249173e+05 1.654998e+06 2.120576e+06 2.879574e+06 40586.640 1.865328e+06 2.122624e+06 2.115460e+06 6.677140e+04 1.716158e+06 2.152124e+06 2.123201e+06 194880.69 2.148225e+06 2.181545e+06 2.062005e+06 2.313023e+05 1.968453e+06 2.106681e+06 2.130520e+06 1.899142e+05 1.959046e+06 2.309423e+06 2.257696e+06 2.079352e+05 1.851214e+06 1.975292e+06 2.222417e+06 2.563725e+05 3.381507e+05 2.544205e+05 3.319370e+05 3.471923e+05 3.765025e+05 3.314820e+05 2.358622e+05 3.213057e+05 3.042995e+05 3.686267e+05 2.847743e+05 3.932142e+05 2.527431e+05 3.268884e+05 3.432838e+05 3.494300e+05 2.704428e+05 3.268990e+05 3.644740e+05 3.367608e+05 3.096459e+05 2.588996e+05 3.196869e+05 2.500295e+05 3.247376e+05 3.385821e+05 3.194044e+05 4.282103e+05 3.167720e+05 3.084038e+05 4.102086e+08 2.762650e+05 3.363368e+05 3.581550e+05 3.306136e+05 3.077926e+05 2.910574e+05 2.760809e+05 3.159919e+05 3.149186e+05 3.127385e+05 3.633686e+05 2.860212e+05 3.189298e+05 2.863583e+05 3.151122e+05 3.158113e+05 3.481385e+05 2.974688e+05 3.243667e+05 3.227278e+05 3.186273e+05 3.319829e+05 3.014566e+05 3.571390e+05 3.664560e+05 3.469885e+05 3.676033e+05 3.270293e+05 3.079879e+05 3.340979e+05 3.478182e+05 2.871410e+05 3.084657e+05 2.917302e+05 2.966982e+05 3.363992e+05 2.910458e+05 3.297527e+05 3.484652e+05 3.684754e+05 2.832854e+05 2.884428e+05 2.974304e+05 3.566579e+05 2.959447e+05 3.735335e+05 2.908989e+05 2.592482e+05 2.839353e+05 2.990903e+05 3.224331e+05 3.860425e+05 2.574685e+05 3.352410e+05 2.994141e+07 3.253772e+05 2.203567e+05 2.883059e+05 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3.042972e+05 2.596844e+05 2.939072e+05 3.362759e+05 2.901246e+05 2.913434e+05 2.738673e+05 3.437866e+05 2.726927e+05 2.941691e+05 2.732497e+05 3.492922e+05 2.794077e+05 3.201994e+05 3.114526e+05 2.960003e+05 2.845843e+05 3.347773e+05 3.231586e+05 3.236539e+05 3.706668e+05 3.254836e+05 3.721546e+05 2.944363e+05 2.844112e+05 3.136367e+05 2.788671e+05 3.008568e+05 3.414845e+05 4.066168e+05 2.785481e+05 3.203873e+05 3.190759e+05 3.187422e+05 2.922171e+05 2.786850e+05 3.454434e+05 2.659006e+05 3.049230e+05 2.933359e+05 3.234155e+05 2.923948e+05 4.275737e+05 2.991273e+05 3.563123e+05 3.395170e+05 3.029407e+05 215.89843_5.622 1.870397e+08 1.518860e+08 8.652407e+07 1.147950e+08 7.935913e+05 6.014831e+07 1.644187e+08 1.626590e+08 507689.58 1.434897e+08 8.954012e+07 1.037643e+08 498297.39 1.118931e+08 1.140062e+08 1.360428e+08 4.568019e+05 9.742333e+07 1.522096e+08 1.069562e+08 4.255160e+05 1.170529e+08 1.446951e+08 1.497741e+08 61953.372 7.435857e+07 1.104601e+08 1.277973e+08 1.145315e+05 1.362977e+08 1.126732e+08 1.233207e+08 292021.97 1.078978e+08 1.316216e+08 1.532257e+08 5.005585e+05 8.446073e+07 1.355570e+08 1.493978e+08 3.257592e+05 7.923475e+07 7.659315e+07 1.743227e+08 3.035075e+05 1.339799e+08 1.035490e+08 1.201003e+08 8.172459e+07 1.435143e+08 8.033163e+07 7.377372e+07 9.901426e+07 1.270236e+08 1.245772e+08 8.625079e+07 1.040518e+08 1.267246e+08 6.869957e+07 9.450092e+07 1.361704e+08 9.721562e+07 9.938041e+07 1.408543e+08 1.050107e+08 7.722861e+07 9.981483e+07 1.266046e+08 1.123963e+08 1.109624e+08 4.870952e+07 1.019771e+08 1.142353e+08 9.313666e+07 1.346733e+08 3.975094e+07 1.001746e+08 9.568665e+07 7.457612e+07 9.693728e+07 8.163073e+07 8.718079e+07 1.186022e+08 1.049137e+08 8.946906e+07 7.934664e+07 7.637525e+07 7.409616e+07 8.736037e+07 5.371314e+07 1.508575e+08 1.090758e+08 1.141420e+08 1.564254e+08 1.472759e+08 9.313752e+07 1.407740e+08 1.077471e+08 9.287516e+07 1.135334e+08 1.355417e+08 1.278051e+08 8.446882e+07 9.771328e+07 1.601873e+08 1.074513e+08 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1.693221e+07 8.876809e+07 1.662210e+08 1.548462e+08 1.035520e+08 8.077880e+07 9.697292e+07 1.592209e+07 1.871585e+08 7.109189e+07 1.161640e+08 7.273297e+07 9.254330e+07 3.270319e+07 9.668089e+07 1.026478e+08 7.102384e+07 1.201890e+08 9.092184e+07 1.075248e+08 1.060800e+08 1.046929e+08 8.916814e+07 8.066972e+07 9.321778e+07 1.749072e+08 1.262126e+08 1.213997e+08 1.168551e+08 1.116186e+08 1.075509e+08 7.646422e+07 1.026968e+08 6.033297e+07 1.158429e+08 1.276503e+08 8.247077e+07 1.416850e+08 1.023464e+08 1.572724e+08 1.182400e+08 1.521584e+08 1.329346e+08 1.465213e+08 1.167619e+08 1.218142e+08 1.725765e+08 1.626610e+08 1.588975e+08 1.234944e+08 1.981458e+08 5.127010e+07 1.527947e+08 1.190902e+08 1.795141e+08 1.474637e+08 9.563053e+07 1.492223e+08 1.290277e+08 9.492120e+07 9.742385e+07 9.981249e+07 7.813652e+07 7.753107e+07 1.099005e+08 7.966842e+07 7.130735e+07 9.421652e+07 7.331599e+07 6.542252e+07 1.115307e+08 2.134524e+08 6.401219e+07 6.785649e+07 1.394558e+08 1.201745e+08 9.714693e+07 8.602219e+07 1.474022e+08 C2 H3 N3 O6 P2 S_5.663 3.013967e+07 2.592491e+07 1.349400e+07 2.524502e+07 4.397748e+05 2.322828e+07 3.090598e+07 2.697680e+07 322251.79 2.427420e+07 2.181914e+07 2.646237e+07 301587.65 1.867370e+07 2.366963e+07 2.475531e+07 3.046280e+05 2.544381e+07 2.188969e+07 2.273977e+07 2.745659e+05 2.508608e+07 2.239360e+07 2.646375e+07 39324.757 2.765283e+07 2.025274e+07 2.507168e+07 7.166556e+04 2.305392e+07 2.482575e+07 2.418898e+07 206314.48 1.807695e+07 2.729937e+07 2.720465e+07 3.300170e+05 2.038049e+07 2.604698e+07 2.302770e+07 2.089926e+05 2.178389e+07 2.216056e+07 2.672098e+07 2.084350e+05 2.779399e+07 1.976018e+07 2.473813e+07 2.154101e+07 2.933582e+07 1.732706e+07 1.773089e+07 1.842627e+07 2.253739e+07 1.797948e+07 1.747473e+07 2.396977e+07 2.580323e+07 2.192968e+07 3.153476e+07 2.154487e+07 1.932882e+07 2.158178e+07 2.719381e+07 1.679640e+07 1.645168e+07 2.782769e+07 2.335116e+07 2.108286e+07 2.310771e+07 2.244057e+07 2.139034e+07 2.371548e+07 1.901213e+07 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3.391915e+05 5.158133e+05 3.480633e+06 8.571219e+05 2.810207e+06 2.799663e+06 8.588863e+06 1.411127e+07 2.613056e+06 5.111876e+06 3.520945e+06 5.924535e+06 1.133999e+06 1.328798e+06 4.849351e+06 1.945534e+07 2.298833e+06 1.299146e+07 4.018926e+06 4.358038e+06 4.001513e+06 7.954645e+06 3.768152e+06 6.448993e+06 1.029096e+07 1.563606e+06 1.179405e+07 1.700937e+06 4.042560e+06 3.845965e+05 2.114444e+06 1.988222e+07 5.962434e+06 6.033521e+06 3.909995e+06 1.086633e+06 2.917787e+06 3.566375e+06 2.555066e+05 1.528683e+06 9.605040e+06 2.236395e+06 1.254441e+06 4.477980e+06 1.568264e+06 7.442033e+05 3.758869e+06 1.205767e+07 1.868383e+06 1.230965e+06 9.570680e+06 7.745672e+05 1.507188e+06 4.754831e+06 9.645802e+06 4.271085e+05 3.279826e+06 6.842391e+05 1.293669e+07 2.024887e+06 4.608963e+05 2.537675e+06 3.177158e+06 7.404320e+06 2.871667e+06 2.658279e+06 C8 H15 N O3_5.673 4.819047e+05 1.950865e+06 1.350421e+06 1.757889e+06 3.057892e+05 1.546949e+06 2.326676e+06 2.655782e+06 148817.95 1.701261e+06 1.749306e+06 1.961254e+06 125751.68 2.241304e+06 1.918055e+06 2.356317e+06 1.503658e+05 1.170599e+06 2.093591e+06 2.486662e+06 1.535654e+05 1.073635e+06 2.114968e+06 2.497904e+06 23358.602 1.232734e+06 2.283958e+06 2.573233e+06 3.869787e+04 1.167474e+06 1.966894e+06 2.435782e+06 98734.33 1.089751e+06 2.572220e+06 2.627262e+06 1.588368e+05 9.354397e+05 2.091839e+06 2.649224e+06 1.039293e+05 9.993819e+05 2.103436e+06 2.843532e+06 1.028568e+05 9.607080e+05 2.089583e+06 1.982479e+06 9.089164e+05 7.960375e+05 9.306245e+05 4.629067e+06 1.155958e+06 1.300258e+06 2.467841e+06 3.485163e+06 2.063302e+06 2.766100e+06 4.634150e+06 1.919677e+06 3.595857e+06 1.359429e+06 3.537250e+06 2.034427e+06 1.527906e+06 9.274174e+05 2.186794e+06 1.228769e+06 2.622140e+06 1.424093e+06 1.001299e+06 4.215460e+06 1.599307e+06 9.826316e+05 1.803645e+06 1.621908e+06 2.206125e+06 1.059679e+06 2.813329e+06 1.942329e+06 1.890547e+06 1.320665e+06 7.375230e+05 2.239258e+06 1.254510e+06 1.714704e+06 7.324184e+05 1.454594e+06 1.284633e+06 1.504666e+06 2.518517e+06 1.758532e+06 2.044550e+06 1.556958e+06 1.981577e+06 1.737182e+06 1.877068e+06 1.014275e+06 8.368708e+05 1.465237e+06 1.888023e+06 1.313003e+06 1.451469e+06 1.340712e+06 1.764524e+06 1.484442e+06 1.244942e+06 1.105476e+06 1.429420e+06 1.698690e+06 1.601333e+06 1.737254e+06 2.317873e+06 6.444613e+05 5.026251e+05 2.502773e+06 1.400641e+06 2.273474e+06 2.165049e+06 1.911799e+06 8.773610e+05 1.215784e+06 6.979549e+05 9.814810e+05 1.332994e+06 1.594270e+06 1.416262e+06 1.304132e+06 2.335844e+06 2.250481e+06 2.606339e+06 2.180183e+06 6.314034e+05 2.050643e+06 1.096221e+06 1.184995e+06 1.309702e+06 2.050535e+06 1.365049e+06 1.906298e+06 1.487989e+06 2.636764e+06 2.115567e+06 2.493312e+06 1.769156e+06 1.246835e+06 4.902480e+05 1.880093e+06 2.142668e+06 1.136317e+06 5.523633e+05 1.034595e+06 2.285335e+06 1.497258e+06 1.173942e+06 2.674369e+06 1.635481e+06 1.099172e+06 1.207056e+06 7.093409e+05 5.893212e+05 1.687615e+06 2.096988e+06 1.481118e+06 1.671402e+06 9.111753e+05 1.796013e+06 1.881731e+06 3.717091e+05 9.180314e+05 1.711836e+06 7.161943e+05 2.015632e+06 1.234837e+06 1.531824e+06 1.930717e+06 2.773862e+06 1.718326e+06 1.195913e+06 1.006621e+06 1.578156e+05 9.016491e+05 1.152649e+06 1.400060e+06 1.176875e+06 4.148908e+05 1.491109e+06 1.945624e+06 1.841322e+06 8.526219e+05 1.012259e+06 1.290150e+06 1.789299e+05 1.241878e+06 1.548983e+05 1.426931e+06 4.459421e+06 2.436253e+06 1.157877e+06 1.419401e+06 2.648810e+06 9.335995e+05 8.336880e+05 1.602684e+06 2.129566e+06 1.401625e+06 1.411490e+06 5.380013e+05 1.898417e+06 4.177522e+05 1.363578e+06 1.497808e+06 1.020888e+06 1.059212e+06 1.009692e+06 1.744624e+06 6.565009e+05 1.262942e+06 1.177553e+06 1.963253e+06 1.144017e+06 1.123637e+06 1.880380e+06 1.469674e+06 1.634694e+06 9.470534e+05 9.266690e+05 1.577265e+06 1.233629e+06 2.066496e+06 1.809821e+06 1.508642e+06 8.226158e+05 2.447180e+06 2.305284e+06 8.093685e+05 3.081483e+06 1.552043e+06 1.320078e+06 1.371045e+06 4.146632e+06 1.732192e+06 9.234095e+05 2.607941e+06 7.127801e+05 7.100984e+05 2.905275e+06 2.262513e+06 2.386738e+06 1.482020e+06 1.100369e+06 2.222119e+06 1.742187e+06 2.811692e+06 2.194125e+06 6.197431e+05 2.100659e+06 1.610438e+06 2.040920e+06 8.588784e+05 1.455811e+06 2.700642e+06 169.52577_5.679 5.465921e+05 9.446573e+05 5.497303e+05 4.085489e+05 4.184303e+05 6.153280e+05 6.426742e+05 8.075097e+05 336632.44 7.402842e+05 9.120680e+05 7.794995e+05 339717.16 5.686704e+05 9.796343e+05 5.211560e+05 4.329762e+05 5.112051e+05 7.279015e+05 8.370767e+05 3.971023e+05 5.953377e+05 5.756014e+05 9.994237e+05 48154.629 9.448720e+05 5.677353e+05 7.667288e+05 1.213816e+05 6.187987e+05 6.529742e+05 6.886279e+05 251490.03 7.658571e+05 7.742183e+05 5.988004e+05 4.345279e+05 9.537805e+05 5.862420e+05 8.865719e+05 2.447767e+05 6.448048e+05 7.195006e+05 8.507577e+05 2.270356e+05 6.120603e+05 5.118000e+05 9.079259e+05 1.164457e+06 7.112417e+05 1.406086e+06 5.884042e+05 4.364742e+05 8.472866e+05 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7.672099e+07 9.167009e+07 70847.755 6.167274e+07 7.251064e+07 8.176977e+07 1.577570e+05 7.386165e+07 7.177879e+07 8.263493e+07 334686.24 6.648575e+07 7.430998e+07 8.435932e+07 5.373337e+05 7.421532e+07 8.542936e+07 7.603722e+07 3.555918e+05 6.585288e+07 6.426291e+07 8.478190e+07 3.596504e+05 8.327306e+07 6.968317e+07 7.802862e+07 6.489884e+07 9.009477e+07 5.808534e+07 6.102063e+07 5.481252e+07 7.512823e+07 5.872562e+07 5.999135e+07 7.925848e+07 7.352150e+07 5.919093e+07 9.020662e+07 7.367108e+07 6.710689e+07 6.297352e+07 9.945129e+07 5.467226e+07 5.341075e+07 6.244406e+07 7.553186e+07 7.291557e+07 6.581467e+07 6.512913e+07 6.921365e+07 6.828390e+07 6.132021e+07 7.743518e+07 3.416717e+07 6.941292e+07 5.396410e+07 4.894765e+07 5.920953e+07 6.320404e+07 5.284958e+07 6.635790e+07 5.604905e+07 5.758422e+07 6.150758e+07 4.856968e+07 4.143911e+07 5.453081e+07 5.879712e+07 9.005196e+07 5.114767e+07 7.332894e+07 9.027913e+07 7.823038e+07 5.767696e+07 9.878902e+07 6.064293e+07 5.217593e+07 7.051928e+07 6.217883e+07 6.958625e+07 5.403314e+07 6.236990e+07 8.720947e+07 6.898851e+07 4.912251e+07 8.498607e+07 5.125745e+07 9.644268e+07 7.636304e+07 9.266851e+07 8.771687e+07 5.918799e+07 5.310125e+07 7.862703e+07 9.350740e+07 4.422571e+07 6.843710e+07 1.187390e+08 4.976179e+07 5.419743e+07 4.895275e+07 7.439421e+07 5.174931e+07 6.485439e+07 1.005639e+08 5.965194e+07 8.493123e+07 7.487696e+07 8.061417e+07 3.037231e+07 8.523862e+07 8.776335e+07 8.236295e+07 7.063158e+07 6.519776e+07 9.760340e+07 5.342391e+07 8.227082e+07 5.376826e+07 1.179595e+08 9.058300e+07 7.393832e+07 9.429631e+07 9.744268e+07 6.076733e+07 8.167384e+07 8.020838e+07 1.275006e+08 6.963777e+07 1.202631e+08 9.086859e+07 6.466242e+07 5.793509e+07 6.030272e+07 8.434237e+07 8.212629e+07 7.800438e+07 5.510993e+07 6.645112e+07 6.816227e+07 6.621692e+07 4.693201e+07 8.595845e+07 6.590761e+07 7.526124e+07 6.216752e+07 5.730466e+07 7.149312e+07 7.037902e+07 8.772789e+07 8.230021e+07 6.761267e+07 6.432620e+07 7.285220e+07 6.722037e+07 6.687779e+07 5.894702e+07 4.812554e+07 9.505014e+07 6.214125e+07 6.901177e+07 1.754913e+08 3.643527e+07 9.940225e+07 1.026294e+08 7.651167e+07 1.455108e+08 6.609124e+07 1.996784e+08 1.005252e+08 5.997033e+07 7.875550e+07 1.182053e+08 7.983298e+07 1.292246e+08 1.573035e+08 8.030426e+07 8.714861e+07 1.565610e+08 1.170695e+08 7.313250e+07 7.620821e+07 6.121281e+07 5.076444e+07 7.282724e+07 6.703500e+07 1.007345e+08 7.021417e+07 7.443272e+07 6.705179e+07 6.799633e+07 6.825664e+07 5.937584e+07 6.700057e+07 3.849748e+07 7.657028e+07 7.348164e+07 6.480583e+07 7.900968e+07 5.658503e+07 7.378978e+07 7.625952e+07 8.585260e+07 9.476604e+07 9.222281e+07 7.496938e+07 7.450169e+07 9.225391e+07 8.556595e+07 9.773376e+07 8.239949e+07 1.116027e+08 1.253862e+08 1.124455e+08 1.107825e+08 6.648235e+07 1.163738e+08 6.711384e+07 8.552354e+07 7.541277e+07 7.372110e+07 1.130821e+08 6.348466e+07 5.661612e+07 6.656612e+07 6.662085e+07 7.540741e+07 6.728031e+07 6.659223e+07 8.902093e+07 7.086478e+07 8.335945e+07 1.390743e+08 5.525750e+07 5.781709e+07 8.110931e+07 6.682500e+07 5.663893e+07 7.947867e+07 7.873589e+07 C7 H4 Br N3 O S_5.683 5.092403e+07 4.680482e+07 3.355244e+07 2.378056e+07 4.053182e+05 1.680650e+07 3.929558e+07 3.982543e+07 312218.94 3.613378e+07 4.142471e+07 3.227480e+07 310691.86 2.097498e+07 2.662130e+07 3.447463e+07 3.034702e+05 2.878615e+07 4.169673e+07 2.977663e+07 2.582104e+05 4.166641e+07 3.071845e+07 4.182249e+07 39444.417 1.845085e+07 3.302232e+07 3.532745e+07 9.524059e+04 3.941535e+07 3.725051e+07 2.966699e+07 216400.11 1.763483e+07 4.601780e+07 4.989625e+07 3.962276e+05 1.502533e+07 2.642174e+07 4.135803e+07 1.989412e+05 1.537982e+07 3.866307e+07 4.272519e+07 1.858672e+05 4.065783e+07 3.578883e+07 1.924082e+07 1.997568e+07 7.200227e+07 2.847181e+07 3.314673e+07 3.785803e+07 3.177108e+07 3.249575e+07 2.689140e+07 4.254293e+07 3.847657e+07 2.433021e+07 2.917807e+07 4.267091e+07 3.376751e+07 3.245044e+07 4.491167e+07 2.921572e+07 2.511069e+07 4.857462e+07 4.339829e+07 2.551389e+07 3.144170e+07 2.543298e+07 2.679612e+07 3.584891e+07 1.515172e+07 3.531388e+07 1.012930e+07 3.137693e+07 2.595932e+07 3.368935e+07 2.455208e+07 2.235396e+07 3.151225e+07 4.164906e+07 3.384923e+07 1.072872e+07 1.201921e+07 2.435488e+07 1.965624e+07 2.559955e+07 9.151878e+06 5.566109e+07 2.389589e+07 2.049896e+07 2.640508e+07 3.858708e+07 2.542689e+07 4.654860e+07 2.639106e+07 2.495107e+07 3.944570e+07 4.060279e+07 4.322422e+07 2.419138e+07 3.648728e+07 5.321488e+07 3.131714e+07 4.523457e+07 2.829543e+07 2.558884e+07 7.850792e+07 3.983660e+07 3.519089e+07 4.544086e+07 2.035735e+07 4.078129e+07 2.316711e+07 3.860846e+07 2.777738e+07 4.159522e+07 7.749419e+07 2.174350e+07 2.405153e+07 2.123198e+07 1.958684e+07 2.050524e+07 3.621571e+07 5.201932e+07 3.176102e+07 5.299426e+07 2.373849e+07 1.698571e+07 1.890681e+07 4.826545e+07 3.815545e+07 6.142459e+07 3.504574e+07 2.856929e+07 4.077420e+07 1.054086e+07 4.057329e+07 2.262113e+07 5.966895e+07 4.790428e+07 3.733335e+07 5.866875e+07 5.064025e+07 3.125279e+07 4.943720e+07 2.552112e+07 6.576024e+07 3.310529e+07 6.906199e+07 4.275804e+07 3.073970e+07 1.949188e+07 3.160672e+07 4.584978e+07 3.256690e+07 1.498331e+07 3.796218e+07 3.452542e+07 3.840108e+07 4.010061e+07 3.055792e+07 4.830656e+07 2.953650e+07 4.606871e+07 9.052167e+06 2.979684e+07 5.016136e+07 3.426648e+07 3.939296e+07 3.785137e+07 2.927646e+07 3.408569e+07 2.841798e+07 3.837543e+07 1.605452e+07 3.555218e+07 2.300888e+07 1.694906e+07 3.818628e+07 3.784573e+07 8.126873e+07 1.510994e+07 4.951038e+07 3.154259e+07 4.479262e+07 5.667942e+07 3.661323e+07 1.240600e+08 4.871441e+07 2.377715e+07 2.237314e+07 5.968827e+07 2.570900e+07 6.152406e+07 7.922759e+07 1.960469e+07 1.282853e+07 7.526281e+07 5.062389e+07 2.153872e+07 5.286374e+07 5.114808e+07 2.965103e+07 4.454482e+07 2.941295e+07 4.903479e+07 3.668667e+07 3.453413e+07 3.635523e+07 4.114862e+07 2.761486e+07 1.327939e+07 3.240459e+07 7.486609e+07 3.165701e+07 4.362872e+07 2.884813e+07 5.095038e+07 2.406923e+07 3.986206e+07 3.522007e+07 4.187741e+07 3.201223e+07 4.591733e+07 2.854688e+07 3.074197e+07 4.755863e+07 4.574785e+07 3.749766e+07 3.195869e+07 6.038455e+07 6.715331e+07 5.201844e+07 1.734248e+07 4.633008e+07 5.522240e+07 3.129773e+07 4.424985e+07 2.933180e+07 3.466772e+07 4.014136e+07 3.574453e+07 1.332928e+07 2.209645e+07 3.267843e+07 1.502758e+07 2.186912e+07 4.277392e+07 3.315523e+07 9.235824e+06 5.053502e+07 5.918388e+07 2.151722e+07 3.006195e+07 4.975868e+07 2.898731e+07 4.196415e+07 3.015748e+07 3.619328e+07 C6 H2 Br O2 P_5.689 1.936874e+08 1.516732e+08 1.321104e+08 6.171870e+07 9.610041e+05 6.380254e+07 1.659336e+08 1.628354e+08 621091.51 1.434976e+08 9.156807e+07 1.033309e+08 585150.81 1.114391e+08 1.136842e+08 1.358171e+08 5.731423e+05 9.727825e+07 1.520894e+08 1.069014e+08 5.104678e+05 1.169967e+08 1.446341e+08 1.497122e+08 76587.604 7.432872e+07 1.104277e+08 1.277899e+08 1.812830e+05 1.363056e+08 1.127261e+08 1.234033e+08 365225.10 1.079653e+08 1.315760e+08 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3.738937e+06 3.563177e+06 3.457584e+06 2.746010e+06 4.208677e+06 1.859222e+06 5.362300e+05 6.075818e+06 2.380442e+06 2.077045e+06 1.485356e+08 2.183029e+06 1.291349e+06 1.534208e+06 3.599017e+05 4.377809e+05 6.606936e+06 1.072127e+06 2.038454e+06 4.337979e+06 7.172139e+06 2.042454e+07 3.643385e+06 6.405498e+06 3.234693e+06 7.410571e+06 1.349187e+06 2.043422e+06 6.169141e+06 3.002318e+07 2.604758e+06 1.675487e+07 6.822391e+06 4.960936e+06 2.594673e+06 1.095422e+07 3.020875e+06 4.800268e+06 1.541572e+07 1.279664e+06 9.111132e+06 1.979014e+06 3.852429e+06 3.324025e+05 2.034479e+06 2.014729e+07 1.201285e+07 9.265172e+06 3.725012e+06 1.000307e+06 3.350826e+06 4.702259e+06 5.855091e+05 1.724566e+06 1.706593e+07 2.636281e+06 1.288460e+06 6.013547e+06 1.821135e+06 7.293881e+05 4.959785e+06 1.302051e+07 1.962877e+06 1.621610e+06 1.120618e+07 8.578946e+05 1.935413e+06 4.402280e+06 7.695688e+06 3.240831e+05 3.420859e+06 7.142206e+05 1.764139e+07 3.503317e+06 4.614054e+05 2.524692e+06 5.943303e+06 8.953903e+06 2.996073e+06 2.935380e+06 C7 H15 N O2_5.741 6.539815e+06 3.692336e+06 3.541604e+06 3.467699e+06 1.762066e+05 4.610440e+06 4.492278e+06 4.982889e+06 157601.91 3.317636e+06 3.915256e+06 4.726065e+06 160594.70 3.344235e+06 3.865499e+06 4.169675e+06 1.804969e+05 3.220684e+06 3.943358e+06 4.417771e+06 2.037923e+05 3.431628e+06 3.645682e+06 6.453431e+06 20861.298 2.425666e+06 4.616244e+06 3.336563e+06 6.179456e+04 4.005848e+06 3.498645e+06 4.187697e+06 103635.59 3.995374e+06 3.613969e+06 3.473062e+06 3.466110e+05 4.053274e+06 5.738998e+06 3.885614e+06 1.058648e+05 3.269311e+06 3.868330e+06 4.221990e+06 1.963266e+05 3.502562e+06 3.756498e+06 4.372870e+06 7.018095e+06 3.123237e+06 5.146527e+06 4.522789e+06 9.023978e+06 3.566605e+06 5.361018e+06 4.985867e+06 6.656067e+06 4.749368e+06 4.767553e+06 5.656449e+06 5.351630e+06 7.751769e+06 6.550126e+06 6.096805e+06 4.275220e+06 1.633948e+06 4.833632e+06 2.091780e+06 1.543564e+06 1.549445e+06 5.446661e+06 3.052898e+06 2.536679e+06 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4.707153e+06 3.472057e+06 6.525696e+06 5.180940e+06 7.424452e+06 5.022020e+06 5.068614e+06 6.355747e+06 5.255035e+06 5.965234e+06 5.442954e+06 6.503541e+06 5.455595e+06 5.891805e+06 6.129160e+06 4.576133e+06 6.916054e+06 6.186906e+06 5.163777e+06 5.017674e+06 5.700936e+06 4.414214e+06 8.044127e+06 4.617971e+06 6.672957e+06 5.067523e+06 5.629801e+06 4.009280e+06 5.016824e+06 5.349119e+06 7.625767e+06 5.572216e+06 9.036923e+06 6.492584e+06 6.758388e+06 1.002785e+07 3.890534e+06 6.472678e+06 8.876256e+06 6.935044e+06 7.924698e+06 5.476164e+06 8.520832e+06 8.686142e+06 4.946860e+06 7.729845e+06 8.017888e+06 4.120978e+06 4.517577e+06 5.763691e+06 6.706233e+06 6.170168e+06 7.158940e+06 6.821577e+06 C10 H8 N10 O5 S_5.789 2.622436e+07 1.564123e+07 1.100265e+07 1.275944e+07 1.748403e+05 8.212816e+06 1.410586e+07 1.525836e+07 147098.25 1.186854e+07 1.185178e+07 1.537632e+07 152331.08 8.248976e+06 1.367842e+07 1.244017e+07 1.475819e+05 1.186735e+07 1.306173e+07 1.403745e+07 1.382381e+05 1.054191e+07 1.316937e+07 1.704059e+07 21623.703 6.704914e+06 1.389072e+07 1.309278e+07 3.895158e+04 1.176884e+07 1.014803e+07 1.490928e+07 96277.05 1.351445e+07 1.303228e+07 1.008038e+07 1.618646e+05 1.148143e+07 1.521117e+07 1.290484e+07 9.321072e+04 1.063398e+07 1.378587e+07 1.271817e+07 1.025412e+05 1.233315e+07 1.096373e+07 1.360233e+07 1.276453e+07 1.553526e+07 1.178333e+07 1.805674e+07 1.431984e+07 1.483297e+07 1.646147e+07 1.618475e+07 1.628723e+07 1.510702e+07 2.181969e+07 1.767753e+07 2.691294e+07 1.584086e+07 1.900328e+07 1.668549e+07 1.323383e+07 1.133134e+07 1.409791e+07 1.375393e+07 7.974407e+06 1.301386e+07 1.450271e+07 1.140277e+07 1.548755e+07 9.533587e+06 1.851689e+07 1.263115e+07 1.603005e+07 1.641806e+07 1.871121e+07 1.402349e+07 1.759776e+07 1.415248e+07 1.223747e+07 9.747124e+06 1.325840e+07 1.179793e+07 9.374155e+06 9.848005e+06 1.684832e+07 1.228922e+07 1.741523e+07 7.291453e+06 9.259450e+06 1.459090e+07 1.367525e+07 1.103260e+07 1.012586e+07 1.613283e+07 7.463582e+06 1.496688e+07 7.703608e+06 1.301985e+07 1.169139e+07 1.408857e+07 8.088485e+06 1.137919e+07 1.015622e+07 9.128587e+06 2.630093e+07 1.537463e+07 7.986015e+06 1.439992e+07 1.319846e+07 1.204482e+07 7.663730e+06 1.142905e+07 1.312289e+07 1.253161e+07 1.366596e+07 2.264722e+07 7.691338e+06 9.787515e+06 5.906349e+06 1.141703e+07 1.066529e+07 1.066719e+07 9.228809e+06 1.086637e+07 1.542635e+07 1.568470e+07 2.100287e+07 1.897178e+07 1.051707e+07 1.412481e+07 1.112358e+07 1.130641e+07 1.318465e+07 1.362186e+07 1.420973e+07 1.270360e+07 1.342423e+07 1.278902e+07 9.069188e+06 1.256853e+07 1.525733e+07 1.053061e+07 7.769425e+06 1.268433e+07 9.994593e+06 9.012239e+06 7.231008e+06 9.718539e+06 1.105181e+07 2.194786e+07 1.004277e+07 1.451674e+07 1.341655e+07 1.073614e+07 1.072509e+07 1.204369e+07 1.340619e+07 1.610479e+07 1.298861e+07 1.347650e+07 1.042984e+07 1.718077e+07 1.471489e+07 1.666579e+07 1.375211e+07 1.409920e+07 1.535590e+07 1.324436e+07 1.312502e+07 1.596687e+07 1.678360e+07 1.118252e+07 1.723949e+07 1.084142e+07 1.232143e+07 1.049533e+07 6.799497e+06 1.211591e+07 1.083118e+07 7.400360e+06 9.278478e+06 1.241296e+07 1.422212e+07 1.410337e+07 1.243341e+07 1.464689e+07 8.539349e+06 1.055570e+07 5.239089e+06 2.402973e+07 6.396046e+06 1.245054e+07 9.277409e+06 1.426424e+07 1.867160e+07 1.522901e+07 5.430784e+06 1.562882e+07 1.558876e+07 1.276115e+07 1.011846e+07 1.142005e+07 1.337243e+07 1.484160e+07 1.262980e+07 8.747864e+06 1.590645e+07 1.322523e+07 1.698898e+07 1.041757e+07 1.278954e+07 1.436140e+07 6.118743e+06 1.186261e+07 9.728176e+06 1.605152e+07 1.076476e+07 1.293627e+07 1.623980e+07 9.525523e+06 1.513530e+07 1.163163e+07 1.192401e+07 1.082543e+07 1.320643e+07 9.480299e+06 2.336492e+07 9.923160e+06 1.337236e+07 9.844462e+06 1.097895e+07 9.114335e+06 1.254832e+07 1.018068e+07 1.638062e+07 1.409906e+07 2.322133e+07 1.658220e+07 1.226853e+07 2.180610e+07 1.152908e+07 1.339607e+07 2.034448e+07 1.517502e+07 1.999906e+07 1.283333e+07 1.417915e+07 1.941309e+07 1.032649e+07 1.664994e+07 1.565054e+07 9.367401e+06 1.101610e+07 1.392033e+07 8.592344e+06 1.351034e+07 1.758800e+07 1.527022e+07 169.50748_5.79 2.742808e+06 1.514604e+06 1.625364e+06 1.603434e+06 1.672364e+05 1.636723e+06 1.638036e+06 1.727001e+06 148644.08 1.632347e+06 1.549099e+06 1.906425e+06 152142.30 1.255001e+06 1.806770e+06 1.709759e+06 1.472155e+05 1.469626e+06 1.483753e+06 1.676451e+06 1.291897e+05 1.374459e+06 1.562385e+06 2.473456e+06 17479.520 1.203847e+06 1.553533e+06 1.627731e+06 3.288493e+04 1.431157e+06 1.472404e+06 1.910701e+06 84837.08 1.579215e+06 1.609350e+06 1.564941e+06 1.464891e+05 1.468727e+06 1.962396e+06 1.806289e+06 9.012619e+04 1.190672e+06 1.598571e+06 1.591662e+06 9.711044e+04 1.671987e+06 1.508791e+06 1.731597e+06 1.873219e+06 2.343816e+06 1.305964e+06 2.260900e+06 1.727538e+06 1.581626e+06 2.236707e+06 1.917043e+06 1.972051e+06 2.045766e+06 2.689646e+06 2.527592e+06 3.085394e+06 2.916177e+06 2.581120e+06 2.446964e+06 2.018867e+06 1.596386e+06 1.655592e+06 2.017276e+06 1.245527e+06 1.192088e+06 1.976335e+06 1.419465e+06 2.138842e+06 9.751155e+05 2.150159e+06 1.545490e+06 1.706060e+06 1.952145e+06 2.186920e+06 1.865097e+06 2.053616e+06 1.862417e+06 1.673497e+06 1.572453e+06 1.658102e+06 1.967228e+06 1.458979e+06 2.656595e+06 1.950835e+06 1.475790e+06 1.706948e+06 1.415530e+06 1.311444e+06 1.790511e+06 1.786128e+06 1.546711e+06 1.586451e+06 1.890346e+06 1.135121e+06 1.921491e+06 1.258217e+06 1.326257e+06 1.325516e+06 1.574783e+06 1.123618e+06 1.211626e+06 1.308226e+06 1.351257e+06 2.339405e+06 1.698807e+06 8.657732e+05 1.710910e+06 1.404646e+06 1.248169e+06 1.963412e+06 1.592995e+06 1.684093e+06 1.765368e+06 1.853261e+06 2.653121e+06 1.069399e+06 1.192919e+06 7.177467e+05 1.254176e+06 1.326997e+06 1.572910e+06 1.373417e+06 1.327836e+06 1.877194e+06 1.767222e+06 2.420188e+06 2.041967e+06 1.558722e+06 1.740468e+06 1.268453e+06 1.215308e+06 2.750635e+06 1.360712e+06 1.442616e+06 1.468379e+06 1.818053e+06 1.744077e+06 1.253712e+06 1.410305e+06 1.657008e+06 1.148808e+06 1.182363e+06 1.996721e+06 1.419139e+06 1.035148e+06 9.534780e+05 1.422345e+06 1.059181e+06 2.120457e+06 1.387832e+06 1.710800e+06 1.495930e+06 1.270040e+06 1.379320e+06 1.545609e+06 1.369096e+06 1.810436e+06 1.376240e+06 1.473313e+06 1.589618e+06 1.978004e+06 1.969220e+06 1.981565e+06 1.675878e+06 1.730626e+06 1.931458e+06 1.521754e+06 1.517272e+06 1.753447e+06 1.947036e+06 1.301796e+06 2.160783e+06 1.617033e+06 2.176170e+06 1.350185e+06 8.687448e+05 1.421641e+06 1.279122e+06 9.373260e+05 1.049443e+06 1.631345e+06 1.304040e+06 1.424155e+06 1.349074e+06 2.239894e+06 8.540186e+05 1.394523e+06 6.155587e+05 1.832254e+06 6.659306e+05 1.629555e+06 1.834857e+06 1.415978e+06 2.046839e+06 1.694046e+06 1.161122e+06 1.661907e+06 1.825263e+06 1.414453e+06 1.408602e+06 1.667011e+06 1.491712e+06 1.356804e+06 1.352722e+06 1.036813e+06 1.982121e+06 1.583857e+06 2.085587e+06 1.215095e+06 1.536531e+06 1.586552e+06 7.482654e+05 1.568096e+06 1.218082e+06 1.839368e+06 1.363923e+06 1.424343e+06 1.828861e+06 1.431848e+06 1.773966e+06 1.290650e+06 2.485836e+06 1.495815e+06 1.920497e+06 1.163217e+06 2.292281e+06 1.114807e+06 1.774933e+06 1.783199e+06 1.850647e+06 1.318381e+06 1.512087e+06 1.508822e+06 1.879036e+06 1.762602e+06 2.349827e+06 1.766476e+06 1.825238e+06 2.454174e+06 1.399811e+06 1.920678e+06 2.454710e+06 1.716635e+06 2.560239e+06 1.287383e+06 1.974539e+06 1.806523e+06 1.464509e+06 1.910311e+06 2.203303e+06 1.524873e+06 1.169854e+06 1.924946e+06 1.837842e+06 1.537850e+06 1.713279e+06 1.625118e+06 C11 H22 N2 O3_5.791 5.115062e+06 1.146852e+06 1.357370e+06 1.063493e+06 1.962918e+05 1.461733e+06 1.434723e+06 1.557027e+06 161843.57 1.224669e+06 1.053991e+06 1.512393e+06 164376.30 1.307921e+06 1.166461e+06 1.289251e+06 1.589269e+05 1.290426e+06 1.338718e+06 1.404715e+06 1.432791e+05 1.110154e+06 1.345872e+06 1.768957e+06 21153.779 9.779140e+05 1.144815e+06 1.102585e+06 3.686077e+04 1.490618e+06 1.253793e+06 1.606775e+06 91798.09 1.229584e+06 1.266325e+06 1.371676e+06 1.628835e+05 1.120989e+06 1.384502e+06 1.308804e+06 9.330228e+04 1.046464e+06 1.324928e+06 1.489789e+06 9.090351e+04 1.334326e+06 1.268259e+06 1.266924e+06 3.282238e+05 4.676171e+05 9.011603e+05 1.679456e+05 2.828007e+05 2.765494e+05 1.468068e+05 2.357546e+05 2.094303e+06 8.404225e+06 2.325965e+07 1.884865e+05 6.132465e+06 3.187882e+05 6.606253e+05 1.780478e+05 1.140016e+06 2.012760e+05 2.362022e+06 2.988727e+06 2.435995e+06 3.105507e+06 1.696352e+05 1.941483e+06 1.727917e+05 1.715620e+05 4.971271e+06 1.837681e+05 1.509049e+07 1.937705e+05 1.399601e+07 1.915407e+05 1.580939e+05 1.008870e+06 6.025764e+06 4.721085e+05 1.612647e+05 3.445015e+06 6.770923e+06 1.288832e+07 2.230855e+06 1.485509e+06 5.790920e+06 1.803907e+05 1.666037e+05 2.162122e+05 8.665694e+06 2.247447e+05 1.520770e+06 2.682668e+06 1.531218e+06 2.136502e+05 8.115499e+06 3.703324e+05 1.533993e+05 1.876277e+05 1.769742e+05 2.479068e+05 1.789632e+05 1.642178e+06 1.720342e+05 4.694838e+06 1.590874e+05 2.806708e+05 5.717428e+06 1.525491e+05 1.472623e+05 6.445147e+06 4.494510e+06 3.220584e+05 4.118247e+06 1.832473e+05 1.160991e+07 4.233161e+05 2.383893e+06 6.032671e+05 1.446549e+05 1.608246e+06 3.221149e+05 2.216464e+05 3.611765e+06 3.078407e+05 2.375109e+05 6.215372e+06 2.483404e+05 5.587813e+06 5.555886e+06 2.338446e+05 1.050861e+06 1.503001e+05 1.934273e+05 6.632639e+05 2.397221e+05 3.039969e+05 4.143274e+05 3.768978e+05 2.392681e+05 8.372771e+06 1.444651e+05 2.301571e+05 1.667412e+06 1.597212e+05 6.530912e+06 1.635299e+05 2.996360e+05 1.717577e+05 2.098157e+06 2.505177e+05 1.725813e+05 3.214510e+05 3.245707e+05 4.480705e+05 3.439774e+05 8.895060e+05 1.660680e+05 2.041592e+05 1.664625e+05 1.767450e+05 2.033515e+05 3.368008e+05 1.576891e+05 2.406510e+06 2.508785e+05 2.210678e+05 2.446495e+05 1.521946e+05 3.356063e+05 1.804773e+05 2.102788e+05 1.859635e+05 3.171657e+05 1.822193e+05 1.898516e+05 7.753569e+05 2.666767e+06 1.393434e+05 1.621075e+05 1.697524e+05 2.899995e+05 1.210896e+06 1.489403e+05 1.670261e+05 1.161834e+05 1.550470e+05 1.779684e+05 1.766264e+05 1.778274e+05 2.933065e+05 1.375387e+05 1.496677e+05 7.864960e+05 1.618036e+05 1.234972e+05 1.436899e+05 7.256563e+06 4.073015e+06 2.419218e+05 1.697789e+05 1.715637e+05 1.836406e+06 8.183266e+05 2.603708e+05 1.776515e+06 2.708272e+05 1.649905e+06 1.969034e+05 1.288759e+05 2.101834e+05 9.238333e+04 1.606339e+05 1.646926e+05 1.776800e+05 4.989234e+05 5.561632e+05 1.887753e+05 1.366106e+05 1.556704e+05 1.490379e+05 2.055177e+05 1.408110e+05 1.565429e+05 1.869138e+05 1.706678e+05 1.468470e+05 1.780228e+05 1.798735e+05 3.101699e+05 3.412781e+05 2.455333e+05 1.670779e+05 2.646637e+05 1.646440e+05 3.449173e+05 2.108854e+05 1.829313e+05 7.631110e+06 2.958977e+05 1.435234e+05 3.254935e+05 1.565595e+05 2.557628e+05 2.634376e+05 1.448837e+05 4.562767e+05 1.492826e+05 1.694043e+05 2.897519e+05 1.676395e+05 2.442444e+06 2.968692e+05 2.065644e+06 4.191898e+05 7.145970e+06 5.434229e+06 O-Propanoylcarnitine_5.791 5.364581e+07 2.158040e+07 2.685998e+07 2.805143e+07 2.367059e+05 2.452619e+07 2.927487e+07 3.251793e+07 185409.39 2.676579e+07 2.730408e+07 2.352551e+07 191102.58 2.488006e+07 2.730983e+07 2.782651e+07 1.874790e+05 2.501155e+07 2.347649e+07 3.166598e+07 1.629475e+05 2.365448e+07 2.873493e+07 3.620095e+07 25506.823 2.110696e+07 2.021870e+07 2.136925e+07 4.461446e+04 2.986841e+07 2.891379e+07 3.148792e+07 109033.08 2.467373e+07 2.689546e+07 2.841016e+07 1.971909e+05 2.478086e+07 2.776326e+07 2.887930e+07 1.215466e+05 1.841926e+07 2.341819e+07 3.267652e+07 1.195096e+05 2.873010e+07 2.544718e+07 2.614783e+07 3.199916e+07 2.158511e+07 1.637916e+07 2.301280e+07 3.450927e+07 2.832584e+07 4.525416e+07 5.720531e+07 2.545689e+07 3.487011e+07 7.806075e+07 3.186094e+07 8.156469e+07 5.189382e+07 3.597760e+07 2.145828e+07 2.363765e+07 3.053365e+07 3.075848e+07 1.816844e+07 2.889411e+07 2.344693e+07 1.621733e+07 6.529018e+07 4.739354e+07 1.034753e+07 5.088738e+07 3.368729e+07 2.299981e+07 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2.709868e+07 1.927395e+07 4.827746e+07 1.620145e+07 2.840244e+07 2.574568e+07 1.632403e+07 5.466013e+07 1.968089e+07 2.223663e+07 3.314568e+07 2.323405e+07 2.274862e+07 3.875307e+07 1.536646e+07 2.862511e+07 1.809106e+07 1.528620e+07 2.950312e+07 2.544464e+07 3.302811e+07 4.146359e+07 2.857923e+07 3.564260e+07 2.472422e+07 2.611708e+07 1.540681e+07 1.756383e+07 1.635399e+07 1.871775e+07 2.205164e+07 9.605577e+06 1.090294e+07 3.174587e+07 4.230362e+07 4.896127e+07 1.925415e+07 3.061144e+07 1.462943e+07 2.226094e+07 1.065878e+07 2.738290e+07 6.317357e+07 5.327229e+07 4.658140e+07 4.379458e+07 2.949180e+07 2.515271e+07 2.799363e+07 2.376362e+07 1.885741e+07 3.837789e+07 3.241742e+07 1.493718e+07 2.978184e+07 2.956490e+07 1.855312e+07 1.991943e+07 2.941617e+07 2.365545e+07 1.949411e+07 2.978180e+07 1.255590e+07 1.780807e+07 3.504495e+07 2.549885e+07 3.309848e+07 2.734900e+07 3.202015e+07 4.315908e+07 2.119839e+07 1.198581e+07 3.926808e+07 3.062091e+07 2.840840e+07 2.982635e+07 2.856752e+07 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3.420203e+06 6.969610e+05 2.186319e+06 5.704900e+06 3.238607e+06 5.477023e+06 2.978473e+06 4.438613e+06 3.518780e+06 2.764695e+05 9.999398e+05 8.501257e+05 4.091480e+06 7.553319e+05 9.588607e+05 6.417679e+05 2.583104e+06 3.120656e+06 6.191445e+06 4.746637e+06 3.530673e+06 1.051274e+06 7.203243e+05 5.097317e+06 5.431304e+05 7.634019e+05 8.380186e+05 3.722772e+06 7.693432e+05 3.062754e+06 3.798838e+06 5.566177e+06 2.222334e+06 5.752107e+06 2.526655e+06 9.688100e+06 2.693589e+06 4.401042e+06 3.529350e+06 4.419003e+06 1.216250e+06 8.355061e+05 7.925885e+05 7.205604e+06 9.931791e+05 3.844159e+06 2.612515e+06 6.221355e+06 6.946619e+05 3.403139e+06 2.480213e+06 3.552997e+06 6.139546e+06 6.179201e+06 5.482194e+06 6.155706e+06 4.219782e+06 2.142372e+06 2.843012e+06 4.346498e+06 8.506143e+05 5.570738e+06 6.499166e+06 C10 H16 N2 O2_5.833 8.613722e+05 5.244624e+05 4.867692e+05 3.016792e+05 1.669610e+05 4.355658e+05 4.136013e+05 4.294642e+05 144535.17 4.086300e+05 4.192387e+05 4.075444e+05 110385.84 5.377807e+05 5.058828e+05 4.061133e+05 1.177800e+05 3.732047e+05 4.273080e+05 4.886306e+05 1.041417e+05 2.582079e+05 5.951435e+05 5.165144e+05 15963.930 3.504596e+05 3.385613e+05 4.618283e+05 2.446341e+04 4.738365e+05 1.339447e+05 4.812794e+05 75300.15 3.449384e+05 5.573170e+05 4.267136e+05 1.427795e+05 3.404857e+05 3.668635e+05 6.798011e+05 8.086891e+04 3.533775e+05 4.854610e+05 2.015074e+05 8.496660e+04 4.785300e+05 3.620424e+05 5.437775e+05 2.002421e+06 1.019628e+06 2.073955e+05 1.545705e+05 1.368010e+05 3.027626e+05 4.185433e+05 8.938656e+04 1.760897e+05 2.659986e+05 8.310325e+05 1.422541e+05 1.349418e+05 4.152321e+05 1.135762e+05 6.400719e+05 2.457881e+05 1.850176e+05 1.062436e+06 2.525336e+05 1.776091e+05 1.581179e+05 3.584395e+05 6.111386e+05 1.216958e+05 1.998276e+05 1.322241e+05 2.344994e+05 1.204344e+05 2.831872e+05 4.531326e+05 1.616933e+05 3.652607e+05 2.495174e+05 1.682791e+05 2.446868e+05 1.176525e+05 1.350865e+05 7.067675e+05 1.485652e+06 2.738193e+05 1.419326e+05 1.391592e+05 2.250070e+05 1.214079e+05 1.421240e+05 5.943276e+05 1.461218e+05 2.729814e+05 2.204696e+05 2.312286e+05 1.170696e+05 2.266083e+05 3.065576e+05 2.208531e+06 1.733554e+05 1.173265e+06 2.319177e+06 7.002173e+05 1.246606e+05 3.765772e+05 2.751284e+05 1.825741e+05 5.573524e+05 3.598074e+05 3.141335e+05 5.247548e+05 5.629835e+05 1.371247e+05 8.664180e+05 1.724739e+05 1.542008e+05 1.376847e+05 4.654800e+05 4.846023e+05 5.058178e+05 3.787248e+05 7.966810e+05 8.042510e+05 1.249847e+05 1.208071e+06 2.278167e+05 1.632351e+05 6.321105e+05 2.167513e+05 2.942456e+05 1.628219e+05 6.039526e+05 1.939120e+06 7.831652e+05 1.666759e+05 1.304129e+05 4.079704e+05 7.960310e+05 2.870325e+05 2.934201e+06 9.468807e+05 1.843303e+05 1.315703e+05 4.717568e+05 2.354652e+05 1.360537e+05 2.645097e+05 3.894362e+05 1.624807e+06 6.320789e+05 1.296854e+05 1.592463e+05 3.398449e+06 1.259239e+05 1.304139e+05 1.015995e+05 4.080356e+05 1.509536e+05 2.976535e+05 1.577416e+05 2.040065e+06 2.219696e+06 2.236880e+05 1.608235e+06 9.825474e+05 2.184661e+05 6.792748e+05 1.303835e+05 2.995051e+05 9.713354e+05 3.896204e+05 5.879953e+05 5.881288e+05 2.018337e+05 6.481309e+05 1.846834e+05 4.584405e+05 1.026793e+05 8.182464e+05 5.911588e+05 2.297969e+05 6.865131e+05 1.498198e+05 4.755690e+05 1.228017e+05 3.996649e+05 2.230476e+06 1.278924e+05 4.272355e+06 5.462510e+05 1.661898e+05 8.462672e+05 4.626288e+05 1.254922e+05 2.165329e+05 7.341709e+05 1.820100e+05 5.143740e+05 7.918820e+05 1.471810e+06 1.156679e+06 2.484552e+05 2.819145e+05 2.134563e+05 1.515483e+06 1.690547e+05 3.255811e+05 2.054607e+05 2.126024e+05 1.772082e+05 8.754017e+04 1.322412e+05 1.035998e+05 5.899683e+05 6.242182e+05 1.631784e+05 3.828941e+05 1.129217e+05 3.733069e+05 7.096134e+05 4.616175e+05 6.228861e+05 7.219245e+05 2.052030e+05 3.367814e+05 2.439464e+05 6.539297e+05 1.381468e+05 4.377202e+05 3.321429e+05 2.011263e+05 2.536799e+05 7.111729e+05 5.082092e+05 1.241410e+05 1.586597e+05 1.352476e+05 1.468389e+05 7.207999e+05 6.966289e+05 5.857874e+05 2.141370e+05 8.964095e+05 6.237561e+05 1.132509e+05 5.866252e+05 1.193321e+05 3.214096e+05 1.168757e+05 1.290209e+05 6.924528e+05 2.232894e+05 1.482510e+05 1.955602e+05 1.684112e+06 2.103930e+05 4.296504e+05 1.203132e+05 C11 H16 N2 O3 S_5.846 4.606685e+05 6.172936e+05 7.140781e+05 9.565246e+05 2.827489e+05 1.268320e+06 1.530622e+06 1.619575e+06 158684.55 8.778247e+05 1.106436e+06 1.709911e+06 142050.49 4.391491e+05 1.048524e+06 1.387909e+06 1.647234e+05 5.817797e+05 1.169894e+06 1.563812e+06 1.355218e+05 6.120417e+05 1.128343e+06 1.823415e+06 20337.763 6.184268e+05 1.160272e+06 1.352233e+06 3.357568e+04 6.276837e+05 1.078144e+06 1.566303e+06 99259.25 6.961664e+05 1.334066e+06 1.382833e+06 1.729774e+05 6.185641e+05 1.116143e+06 2.014682e+06 1.192033e+05 4.419546e+05 1.450471e+06 9.020295e+05 1.236789e+05 6.060843e+05 9.763556e+05 1.455517e+06 2.787167e+05 1.641816e+05 1.577547e+05 1.890929e+05 1.666942e+05 1.749450e+05 1.625958e+05 1.383132e+05 1.565314e+05 1.722245e+05 1.959096e+05 1.446438e+05 1.816700e+05 2.201698e+05 1.712475e+05 1.883264e+05 1.957443e+05 1.748021e+05 1.696132e+05 1.881371e+05 1.544070e+05 1.525946e+05 1.636137e+05 1.642953e+05 1.498091e+05 1.554158e+05 1.764783e+05 1.705213e+05 1.575000e+05 1.550085e+05 1.648847e+05 1.948843e+05 1.419341e+05 1.582953e+05 2.020672e+05 1.646617e+05 1.574572e+05 1.896292e+05 1.808182e+05 1.581930e+05 1.630332e+05 1.610658e+05 1.769852e+05 1.344315e+05 1.689397e+05 1.331692e+05 2.131665e+05 1.655646e+05 1.984763e+05 1.881465e+05 1.693624e+05 1.635841e+05 1.633830e+05 1.672647e+05 1.524758e+05 1.806823e+05 1.780391e+05 1.718158e+05 1.742902e+05 1.720585e+05 1.714548e+05 1.795976e+05 1.698252e+05 1.518938e+05 1.690756e+05 1.775152e+05 1.371027e+05 1.941723e+05 1.604612e+05 2.012667e+05 1.912498e+05 1.906569e+05 1.874634e+05 1.912230e+05 1.920453e+05 1.741704e+05 1.912024e+05 1.980378e+05 1.681509e+05 1.481280e+05 1.294073e+05 1.476996e+05 1.686628e+05 1.892200e+05 1.783807e+05 1.871553e+05 1.667672e+05 1.678831e+05 1.502931e+05 1.614239e+05 1.433811e+05 1.562072e+05 1.933977e+05 1.603419e+05 1.696874e+05 1.610599e+05 1.777441e+05 1.959017e+05 1.738457e+05 1.874681e+05 1.303399e+05 1.734685e+05 1.523428e+05 1.793503e+05 1.619807e+05 1.811810e+05 1.677309e+05 1.493381e+05 1.776316e+05 1.387146e+05 1.730605e+05 1.393058e+05 1.693366e+05 1.928013e+05 1.626654e+05 1.572385e+05 1.931273e+05 1.584257e+05 1.912045e+05 1.799157e+05 1.898854e+05 1.790576e+05 1.374516e+05 1.627122e+05 1.924603e+05 1.679778e+05 1.480021e+05 1.382182e+05 1.784721e+05 1.898211e+05 1.790915e+05 1.542231e+05 1.572072e+06 1.768273e+07 1.269173e+06 4.020675e+05 7.601958e+06 6.725048e+05 2.492042e+06 2.224389e+06 1.116810e+06 1.525590e+06 1.149028e+06 1.012150e+07 1.794807e+05 2.542752e+05 2.528312e+07 1.357181e+06 3.752870e+07 2.245639e+07 2.593058e+06 6.038184e+05 8.941363e+05 6.249665e+05 1.995344e+05 1.334317e+05 1.571007e+06 1.711174e+05 5.504168e+05 1.363508e+06 6.703381e+05 2.406285e+05 1.012857e+06 1.782819e+06 5.733770e+05 8.227058e+05 7.494656e+06 6.425368e+05 1.656858e+05 3.943106e+05 1.810402e+05 1.162431e+06 2.140259e+06 1.457043e+06 8.262413e+05 1.810786e+05 1.624945e+05 1.352805e+05 3.281322e+05 4.027650e+07 2.088911e+05 1.804656e+06 1.533367e+05 1.278466e+07 5.340725e+06 1.376688e+06 2.677433e+05 2.234000e+05 9.883352e+05 1.266656e+07 1.673519e+06 2.089689e+05 1.542178e+05 1.483459e+05 1.588488e+05 1.815120e+05 1.817897e+05 1.692347e+05 1.705255e+05 1.799359e+05 1.674978e+05 1.715375e+05 1.379039e+05 1.753543e+05 1.264580e+05 1.422889e+05 2.106133e+05 1.665644e+05 1.696133e+05 2.524126e+05 1.649391e+05 1.906485e+05 1.736818e+05 1.686971e+05 C9 H10 O3 S_5.849 1.518381e+06 1.499733e+07 1.326913e+07 1.874730e+07 8.928920e+05 2.515839e+07 3.043513e+07 3.282040e+07 451993.03 1.617557e+07 2.429077e+07 3.172503e+07 401128.77 1.234083e+07 2.364093e+07 2.999999e+07 4.426527e+05 9.956042e+06 2.263038e+07 3.070160e+07 3.794525e+05 1.176148e+07 2.592507e+07 3.762706e+07 57982.346 9.255408e+06 2.499226e+07 2.834865e+07 9.718904e+04 1.527057e+07 1.918609e+07 3.246971e+07 294174.03 1.234146e+07 2.615650e+07 3.208564e+07 4.950594e+05 1.211351e+07 2.468920e+07 3.708829e+07 3.453143e+05 1.153113e+07 2.879243e+07 1.427261e+07 3.381571e+05 1.461524e+07 2.215287e+07 2.861073e+07 6.460600e+05 4.353387e+05 4.173536e+05 5.466138e+05 4.911625e+05 5.091231e+05 4.356869e+05 3.525128e+05 4.468046e+05 4.872710e+05 5.468052e+05 3.830703e+05 5.389501e+05 5.914011e+05 4.550111e+05 5.419069e+05 5.639448e+05 4.655733e+05 4.784688e+05 5.511393e+05 4.332765e+05 4.388394e+05 4.824390e+05 4.659941e+05 3.855643e+05 4.440627e+05 5.013774e+05 4.903698e+05 4.427851e+05 4.872805e+05 4.321939e+05 5.604473e+05 4.006227e+05 4.348949e+05 5.780907e+05 4.571789e+05 4.460704e+05 5.349052e+05 4.836194e+05 4.396403e+05 4.654805e+05 4.617156e+05 5.248691e+05 3.781826e+05 4.856894e+05 3.689362e+05 5.992483e+05 4.583866e+05 5.741214e+05 5.518966e+05 4.669068e+05 4.372287e+05 4.353628e+05 4.869094e+05 4.387350e+05 5.284559e+05 5.146827e+05 5.058859e+05 5.147800e+05 5.000957e+05 4.927646e+05 5.316388e+05 5.022702e+05 4.360618e+05 4.859013e+05 5.137656e+05 3.700270e+05 6.276619e+05 4.591140e+05 5.813653e+05 5.674925e+05 5.502974e+05 5.413395e+05 5.491401e+05 5.434616e+05 5.078171e+05 5.456074e+05 5.673479e+05 4.878767e+05 3.664007e+05 3.477723e+05 3.977605e+05 4.848094e+05 5.406221e+05 4.731694e+05 5.419550e+05 4.425815e+05 4.723271e+05 3.914197e+05 4.643832e+05 4.120432e+05 4.473493e+05 5.563228e+05 4.645664e+05 4.265160e+05 4.630241e+05 5.278746e+05 5.803337e+05 5.014655e+05 5.612333e+05 3.570066e+05 4.999401e+05 4.052161e+05 5.263109e+05 4.625876e+05 5.331326e+05 4.784940e+05 4.488225e+05 5.002117e+05 3.987643e+05 4.958547e+05 3.700891e+05 5.006709e+05 5.591906e+05 4.618641e+05 4.123375e+05 5.558217e+05 4.138797e+05 5.474709e+05 5.106650e+05 5.498055e+05 5.121214e+05 3.785845e+05 4.638213e+05 5.539779e+05 4.832987e+05 3.819575e+05 3.754195e+05 5.282009e+05 5.454072e+05 4.907347e+05 4.393313e+05 3.192610e+07 2.909751e+08 2.447583e+07 8.192992e+06 1.550042e+08 1.515078e+07 4.587185e+07 4.641318e+07 2.361044e+07 3.376744e+07 2.606812e+07 2.759422e+08 7.064475e+07 3.268766e+06 4.392049e+08 2.684111e+07 6.342659e+08 4.088840e+08 3.959709e+07 1.432370e+07 1.795706e+07 1.770917e+07 5.705490e+05 4.349862e+06 2.785019e+07 5.032701e+06 1.496506e+07 3.085414e+07 1.361068e+07 3.929202e+06 2.408817e+07 3.916582e+07 1.451073e+07 1.520710e+07 1.392169e+08 1.356075e+07 5.360449e+05 9.726145e+06 1.951640e+06 2.158304e+07 3.985663e+07 2.822450e+07 2.036361e+07 5.535353e+06 9.704120e+05 2.081192e+06 4.400096e+06 7.414272e+08 4.111772e+06 3.732993e+07 1.400868e+06 3.051461e+08 1.414872e+08 3.105178e+07 3.474950e+06 4.391028e+06 2.361612e+07 2.877520e+08 3.113944e+07 6.330683e+05 4.423048e+05 4.290812e+05 4.567448e+05 5.705284e+05 4.892203e+05 4.422351e+05 4.977501e+05 5.339416e+05 4.670657e+05 4.548283e+05 3.698671e+05 5.168520e+05 3.524665e+05 4.102964e+05 6.300519e+05 4.540013e+05 4.968265e+05 7.464121e+05 4.429161e+05 5.469061e+05 5.080417e+05 4.638909e+05 C9 H13 N O3 S_5.878 1.522910e+06 1.534500e+07 1.375774e+07 1.953043e+07 8.095825e+05 2.626532e+07 3.173920e+07 3.419905e+07 417300.52 1.687310e+07 2.517194e+07 3.313479e+07 406095.34 1.288051e+07 2.445543e+07 3.113911e+07 4.180770e+05 1.036041e+07 2.371284e+07 3.200249e+07 3.956939e+05 1.218875e+07 2.686765e+07 3.922902e+07 65387.030 9.744285e+06 2.598811e+07 2.942192e+07 9.503896e+04 1.572384e+07 2.011414e+07 3.382846e+07 287875.80 1.288237e+07 2.733768e+07 3.330162e+07 4.870400e+05 1.254946e+07 2.563066e+07 3.890194e+07 3.589774e+05 1.186280e+07 2.986337e+07 1.495894e+07 3.506123e+05 1.510821e+07 2.294980e+07 2.987042e+07 5.134406e+05 4.434044e+05 4.242464e+05 5.542001e+05 5.244172e+05 5.309570e+05 4.452604e+05 3.635410e+05 4.401933e+05 4.822380e+05 5.429146e+05 3.781430e+05 5.291106e+05 5.629094e+05 4.506137e+05 5.440849e+05 5.439277e+05 4.682341e+05 4.604312e+05 5.461398e+05 4.402532e+05 4.328109e+05 4.900385e+05 4.263345e+05 3.830513e+05 4.694927e+05 5.086808e+05 5.315691e+05 4.567430e+05 4.783772e+05 4.243818e+05 5.861653e+05 3.960935e+05 4.305713e+05 5.611464e+05 4.361027e+05 4.484387e+05 5.330746e+05 5.136053e+05 4.488751e+05 4.607474e+05 4.570519e+05 5.568493e+05 3.737739e+05 4.927918e+05 3.734964e+05 5.787556e+05 4.551461e+05 5.716967e+05 5.821355e+05 4.683814e+05 4.427726e+05 4.311720e+05 4.836308e+05 4.759788e+05 5.293160e+05 5.231122e+05 5.019540e+05 5.702397e+05 4.530248e+05 4.864529e+05 5.332505e+05 5.045208e+05 4.216870e+05 4.814160e+05 5.119326e+05 3.718210e+05 6.406940e+05 4.544717e+05 5.924824e+05 5.525855e+05 5.433936e+05 5.527158e+05 5.765489e+05 5.416308e+05 4.789391e+05 5.642490e+05 5.884276e+05 4.475476e+05 3.712951e+05 3.414041e+05 3.934209e+05 4.791477e+05 5.225232e+05 4.655798e+05 5.524100e+05 4.380246e+05 4.844415e+05 3.891158e+05 4.389956e+05 4.540023e+05 4.335955e+05 5.554367e+05 4.565336e+05 4.507680e+05 4.589042e+05 5.332907e+05 5.427844e+05 4.997862e+05 5.769260e+05 3.479493e+05 5.434596e+05 4.009830e+05 5.708832e+05 4.271551e+05 5.512332e+05 4.359413e+05 4.496192e+05 5.296525e+05 3.926882e+05 4.909560e+05 3.663967e+05 5.667025e+05 5.545843e+05 4.704590e+05 4.100408e+05 5.751124e+05 4.164350e+05 5.590273e+05 5.082476e+05 5.478057e+05 5.745211e+05 3.742849e+05 4.590713e+05 5.591860e+05 4.785881e+05 3.795277e+05 3.662814e+05 4.989059e+05 5.082901e+05 4.858789e+05 4.603250e+05 3.347042e+07 3.063945e+08 2.560461e+07 8.453041e+06 1.614141e+08 1.566649e+07 4.809336e+07 4.839519e+07 2.440646e+07 3.530717e+07 2.708909e+07 2.832784e+08 6.876371e+07 3.331924e+06 4.638466e+08 2.792441e+07 6.695648e+08 4.292904e+08 4.206012e+07 1.475702e+07 1.856118e+07 1.805597e+07 5.357361e+05 4.344716e+06 2.928543e+07 5.092743e+06 1.534538e+07 3.203488e+07 1.404662e+07 3.975725e+06 2.506334e+07 4.076125e+07 1.497250e+07 1.588924e+07 1.452640e+08 1.401564e+07 5.729091e+05 1.000476e+07 1.954961e+06 2.256352e+07 4.171043e+07 2.943443e+07 2.095855e+07 5.492958e+06 9.736947e+05 2.162142e+06 4.677608e+06 7.801331e+08 4.259810e+06 3.893851e+07 1.392418e+06 3.174058e+08 1.460599e+08 3.220626e+07 3.559408e+06 4.557550e+06 2.440297e+07 2.985034e+08 3.260687e+07 6.262050e+05 4.489950e+05 4.110740e+05 4.568056e+05 5.775331e+05 4.839056e+05 4.397021e+05 4.961757e+05 5.342128e+05 4.623007e+05 4.432995e+05 3.658754e+05 4.891599e+05 3.396064e+05 4.505141e+05 6.229665e+05 4.495496e+05 4.225417e+05 7.826884e+05 4.405124e+05 5.453829e+05 5.169929e+05 4.636478e+05 C15 H13 N O2_5.903 1.356599e+06 8.496057e+05 1.048363e+06 1.121119e+06 2.170838e+05 1.455707e+06 1.233581e+06 1.404370e+06 147062.13 1.061984e+06 1.180970e+06 1.360628e+06 155402.52 1.069089e+06 1.115442e+06 1.201002e+06 1.535319e+05 9.542759e+05 1.146371e+06 1.245172e+06 1.384987e+05 1.201541e+06 1.165400e+06 1.566962e+06 23691.992 8.539214e+05 1.078248e+06 1.018449e+06 3.158285e+04 1.312966e+06 1.167838e+06 1.284367e+06 97386.53 1.225616e+06 1.085388e+06 1.186359e+06 1.655940e+05 1.174602e+06 1.058292e+06 1.261850e+06 1.139926e+05 1.179396e+06 1.169735e+06 1.016306e+06 1.113703e+05 1.265871e+06 1.086067e+06 1.272955e+06 9.219859e+05 1.370076e+06 1.233967e+06 2.196238e+06 1.616391e+06 2.591091e+06 2.323410e+06 3.362888e+06 2.422191e+06 2.467359e+06 1.866055e+06 1.790649e+06 4.084417e+06 2.970557e+06 1.208890e+06 1.379158e+06 2.569362e+06 1.176140e+06 1.123189e+06 1.052531e+06 7.434901e+05 2.822199e+06 1.326004e+06 2.454124e+06 1.867415e+06 7.443964e+05 1.915315e+06 1.194177e+06 1.102479e+06 1.258355e+06 2.492028e+06 5.081494e+05 8.962309e+05 1.226979e+06 1.462753e+06 3.756847e+05 1.029774e+06 5.814479e+05 9.550492e+05 2.101445e+06 1.191367e+06 2.437084e+05 4.920124e+05 6.545587e+05 2.146042e+06 5.866468e+05 3.600624e+05 9.532367e+05 1.555106e+06 1.784847e+06 1.415668e+06 7.995464e+05 4.239854e+05 2.376676e+05 7.774938e+05 8.378567e+05 3.274023e+05 4.902302e+05 1.048290e+06 1.047979e+06 1.609877e+06 2.325760e+06 8.669670e+05 2.627508e+06 1.731179e+06 8.317749e+05 6.589137e+05 1.513367e+06 1.322309e+06 8.825529e+05 1.768358e+05 2.010138e+06 1.214162e+06 8.569973e+05 8.987641e+05 1.440035e+06 1.778236e+06 7.137966e+05 8.771356e+05 3.984458e+05 9.899374e+05 9.414096e+05 8.381986e+05 2.313472e+06 3.804470e+05 1.224560e+06 1.578323e+06 1.017634e+06 1.106038e+06 9.583395e+05 1.727203e+06 6.851393e+05 7.088941e+05 1.474520e+06 1.184605e+06 1.819524e+06 9.176794e+05 1.600876e+06 9.017290e+05 2.176027e+06 2.383139e+06 5.517054e+05 4.673183e+05 1.297110e+06 5.943030e+05 2.317841e+06 1.208269e+06 1.273691e+06 1.888017e+06 7.667805e+05 5.179404e+05 1.509719e+06 1.390772e+06 9.528786e+05 1.543819e+06 2.025102e+06 7.286570e+05 1.505666e+06 4.329818e+05 1.158592e+06 1.676777e+05 1.384955e+06 2.350410e+06 1.520909e+06 2.607463e+06 1.156277e+06 1.929490e+06 1.038495e+06 1.686729e+06 1.116987e+06 7.629970e+05 8.820395e+05 6.670805e+05 6.213373e+05 7.345461e+05 2.187657e+05 1.683871e+05 1.821789e+05 5.822750e+05 9.170158e+05 1.162826e+06 8.827856e+05 1.607976e+05 2.445522e+06 1.877976e+05 6.136558e+05 5.942087e+05 1.010302e+06 4.555976e+06 2.224209e+06 1.893196e+06 1.066878e+06 7.294856e+05 5.864433e+05 2.397806e+06 1.391634e+06 1.429744e+06 1.505368e+06 7.135930e+05 1.743458e+06 6.705127e+05 2.260668e+05 1.433760e+06 8.933172e+05 2.007477e+06 1.254926e+06 1.398144e+06 1.799282e+06 6.634443e+05 8.518204e+05 8.915726e+05 1.578462e+06 1.251985e+06 1.485204e+06 3.037185e+06 5.688022e+05 3.465763e+05 8.897902e+05 7.186091e+05 3.131954e+05 1.597279e+06 8.074036e+05 1.527227e+06 7.823750e+05 9.758593e+05 1.978310e+06 8.126960e+05 1.096591e+06 1.690490e+06 1.375423e+06 5.564993e+05 1.979763e+06 3.910806e+06 1.373293e+06 1.015513e+06 3.026170e+06 1.196161e+06 1.075375e+06 2.827469e+06 2.515256e+05 1.794438e+06 7.171527e+05 6.849255e+05 1.881681e+06 8.191502e+05 1.686651e+06 8.118873e+05 1.642683e+06 1.297824e+06 1.651088e+06 2.127093e+05 1.164309e+06 4.732375e+05 1.440673e+06 C8 H4 N O2 P_6.003 5.472946e+09 1.135930e+09 4.673817e+08 4.369073e+07 8.971179e+07 4.433175e+08 2.463923e+09 7.624539e+08 11138643.37 6.982243e+08 7.720501e+08 9.278389e+08 28438377.37 6.552245e+08 8.266219e+08 9.804716e+08 3.865660e+06 7.489924e+08 1.576579e+09 5.852052e+08 1.773255e+06 8.596254e+08 6.780384e+08 6.307434e+08 70096571.429 8.552704e+08 1.468005e+09 8.337966e+08 9.532213e+05 8.234768e+08 8.347987e+08 6.974421e+08 21696009.81 1.102764e+09 1.061399e+09 9.798756e+08 9.320156e+08 1.073792e+09 1.311171e+08 1.056368e+09 8.886147e+08 7.441827e+08 9.964519e+08 8.109259e+08 2.058744e+08 1.192765e+09 6.968793e+08 9.918133e+08 2.299552e+08 8.449159e+08 1.491518e+08 6.220917e+07 1.137906e+09 1.434141e+09 7.422766e+08 1.559445e+09 1.063137e+09 7.496897e+08 1.791529e+09 7.089345e+08 1.325117e+09 1.111882e+09 8.438818e+08 1.411386e+09 2.214565e+09 9.478553e+08 8.038766e+08 8.304411e+08 1.343259e+09 9.680256e+08 1.043007e+09 7.326979e+08 7.284546e+08 7.137941e+08 6.985846e+08 7.810277e+08 6.446760e+08 1.663751e+09 1.756884e+09 1.374502e+09 3.831640e+08 6.057716e+08 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7.257756e+08 7.103159e+08 1.074651e+09 6.776217e+08 9.901478e+08 6.791200e+08 5.919548e+08 1.186468e+09 7.792941e+08 1.303139e+09 8.036618e+08 6.269190e+08 8.936787e+08 1.162849e+09 7.992000e+08 7.564532e+08 7.137834e+08 8.164939e+08 7.439817e+08 2.323088e+08 7.613053e+08 7.077303e+08 7.047393e+08 7.913874e+08 6.070259e+08 8.505862e+08 7.351916e+08 1.705739e+09 1.233267e+09 5.896215e+08 1.673515e+09 4.630700e+08 7.580495e+08 7.971336e+08 8.956110e+08 1.321522e+09 8.515898e+08 9.430602e+08 6.657064e+08 5.214685e+08 1.060814e+09 7.809068e+08 5.866565e+08 1.152835e+09 5.538738e+08 8.668847e+07 7.286288e+08 6.005376e+08 1.289180e+09 1.060086e+09 2.380571e+08 6.674869e+08 5.420451e+08 6.067666e+08 4.938007e+08 5.786015e+08 6.623252e+08 1.022149e+09 1.580658e+09 8.070902e+08 7.030868e+08 1.196744e+08 5.762778e+08 6.450286e+08 9.498069e+08 9.492440e+08 7.885204e+08 1.015451e+09 6.603025e+08 5.549716e+08 8.988190e+08 6.908563e+08 1.023732e+09 7.085920e+08 7.143576e+08 7.786323e+08 7.815056e+08 1.527534e+09 6.192148e+08 7.314014e+08 9.281002e+08 8.158345e+08 7.627751e+08 6.458829e+08 8.466770e+08 7.784621e+08 1.199746e+08 6.732811e+08 5.972767e+08 6.001356e+08 7.749041e+08 5.517997e+08 8.227631e+08 6.937563e+08 6.553829e+08 1.019161e+09 6.983664e+08 7.949051e+08 1.226919e+09 7.950584e+08 2.381135e+09 6.001667e+08 8.952848e+08 C14 H18 N2 O3_6.003 1.752085e+06 7.226128e+05 8.426530e+05 9.613233e+05 1.853132e+05 8.563808e+05 9.375680e+05 1.114462e+06 146951.76 9.240773e+05 7.822239e+05 9.469003e+05 129166.43 8.313843e+05 8.627662e+05 8.720047e+05 1.631628e+05 9.096429e+05 8.971085e+05 9.413034e+05 1.288176e+05 6.974121e+05 9.016517e+05 1.157685e+06 19595.410 8.264076e+05 8.808379e+05 8.752768e+05 2.766263e+04 8.397241e+05 8.193617e+05 1.126018e+06 114488.44 7.489485e+05 8.187287e+05 9.171370e+05 1.796553e+05 8.947748e+05 8.595383e+05 1.054456e+06 1.221791e+05 8.321581e+05 1.116102e+06 3.988416e+05 1.138126e+05 1.023930e+06 8.366415e+05 1.019042e+06 1.332033e+06 7.825348e+05 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7.921516e+08 8.787111e+08 4.878165e+08 1.143367e+09 1.178906e+09 8.233397e+08 42841193.172 9.272407e+08 8.556764e+08 8.449054e+08 6.898930e+06 1.152286e+09 9.788779e+08 8.279485e+08 49438021.35 1.004992e+09 9.720321e+08 1.091713e+09 6.226713e+08 8.445802e+08 1.282836e+09 1.359079e+09 1.478611e+07 4.011594e+08 1.038692e+09 3.397213e+07 3.237596e+07 1.402219e+09 9.578998e+08 1.140444e+09 3.556440e+08 2.782919e+08 4.780678e+08 1.222404e+09 1.162250e+09 9.778938e+08 5.183675e+08 1.765074e+08 1.347763e+09 6.529513e+07 8.731520e+08 1.370716e+09 7.161855e+08 2.193749e+08 1.409071e+09 1.646011e+09 1.227066e+09 1.575657e+09 5.126058e+08 1.031345e+09 9.948489e+08 1.748255e+09 2.816177e+09 8.799170e+08 4.507669e+08 9.122922e+08 1.157631e+09 1.048442e+09 1.097299e+09 7.547139e+08 7.549901e+08 8.553475e+08 1.224471e+09 8.740533e+08 8.092696e+08 1.178793e+09 8.980354e+08 1.605320e+09 1.337686e+09 1.462697e+09 1.450573e+09 9.093990e+08 8.437496e+08 1.284298e+09 1.103752e+09 1.483270e+09 3.482967e+08 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1.312593e+07 1.178376e+09 1.368828e+08 1.311348e+09 1.028466e+09 1.030737e+09 1.043322e+09 1.288273e+09 1.219289e+09 2.472492e+08 8.071637e+08 1.945198e+08 9.466001e+08 9.829728e+08 2.071470e+09 1.570036e+08 1.561311e+09 1.545056e+09 1.149902e+09 1.912695e+08 5.742693e+08 8.270215e+08 9.560661e+08 1.357510e+09 1.145341e+09 1.361040e+09 1.034810e+09 8.413232e+08 2.074104e+08 9.403795e+08 8.850116e+08 1.086126e+09 1.412047e+09 9.318909e+08 9.632723e+08 7.337339e+08 1.286496e+09 7.471944e+08 8.352198e+08 9.032458e+08 1.052792e+09 8.563573e+08 7.480613e+08 3.676017e+08 1.349856e+09 1.189624e+09 9.520180e+08 7.645574e+08 1.708735e+09 1.936353e+09 8.648099e+08 1.283571e+09 8.905979e+08 1.214795e+09 6.276771e+08 9.749815e+08 8.253221e+08 1.515270e+09 9.178789e+08 4.053394e+08 7.182217e+08 1.394593e+08 4.422634e+07 9.143268e+08 4.059751e+08 8.319676e+08 1.706654e+09 4.267347e+08 8.044668e+08 6.790638e+08 1.008852e+09 4.041534e+08 1.046286e+09 1.452566e+08 9.383915e+08 1.376946e+08 7.956609e+08 5.453189e+07 9.397370e+08 7.386533e+08 1.256981e+09 1.676980e+09 1.866589e+09 9.981175e+08 1.793609e+09 9.528543e+08 3.648237e+07 9.980441e+08 7.019827e+07 9.197455e+08 C6 H11 N O2 S_6.054 7.618893e+06 1.492798e+06 1.153714e+06 1.301407e+06 2.046556e+05 1.332028e+06 1.596140e+06 1.541390e+06 162516.90 1.226589e+06 1.210680e+06 1.600963e+06 143712.91 1.206980e+06 1.254558e+06 1.293239e+06 1.536237e+05 1.909574e+06 1.167129e+06 1.044148e+06 1.276442e+05 1.447834e+06 1.473065e+06 1.366242e+06 26602.286 1.418584e+06 1.335238e+06 1.460287e+06 3.910357e+04 1.439396e+06 1.113675e+06 1.686801e+06 129297.81 1.242712e+06 1.315633e+06 1.269458e+06 1.955425e+05 1.381472e+06 1.464006e+06 1.585853e+06 1.270944e+05 1.096442e+06 1.691565e+06 7.907516e+05 1.321984e+05 1.631385e+06 1.277949e+06 1.504740e+06 9.404490e+05 2.992080e+05 1.603659e+05 2.538613e+06 1.132650e+06 1.312188e+06 1.179647e+06 1.612982e+05 3.919585e+05 2.126808e+05 7.521434e+05 1.609437e+06 2.399070e+06 2.408191e+06 4.044203e+05 1.412921e+06 5.338586e+05 3.379091e+05 2.642696e+05 3.743091e+05 2.419609e+05 3.575534e+05 7.712209e+05 6.546922e+06 3.686136e+06 2.365238e+06 3.569399e+05 1.507006e+06 2.398860e+06 6.354452e+05 1.461666e+05 4.259758e+05 1.660055e+05 7.425522e+05 2.142852e+05 1.482154e+05 1.417596e+06 3.131090e+06 1.438090e+06 5.759751e+05 1.246200e+07 1.645620e+06 5.089183e+05 5.359252e+05 2.666610e+06 1.694213e+05 1.791606e+06 7.025851e+06 8.827800e+05 5.864786e+05 3.845887e+05 1.780400e+05 2.869202e+06 7.416742e+05 6.446505e+05 6.903126e+05 3.293106e+05 6.358180e+05 7.354538e+05 2.218994e+06 4.786834e+05 3.320964e+05 6.721351e+05 2.203492e+06 4.028263e+06 4.223294e+06 2.763041e+06 2.115081e+05 1.655517e+05 1.716383e+06 3.313322e+06 8.517009e+05 1.818644e+05 5.364277e+05 1.735851e+05 3.898330e+06 2.006101e+06 6.643794e+06 4.796604e+05 6.496273e+05 5.953446e+05 7.041660e+05 2.615844e+05 2.135825e+05 1.580444e+06 3.575626e+05 1.324765e+06 1.915899e+06 2.857664e+06 1.422309e+06 1.357881e+06 2.042636e+05 1.865257e+05 1.846125e+05 1.548728e+06 1.278896e+06 3.976635e+06 8.117677e+05 1.728704e+05 8.361779e+05 5.033596e+05 3.936007e+06 8.616762e+05 3.358292e+05 5.128835e+05 5.261235e+06 2.048371e+05 3.896994e+06 3.804182e+05 4.068415e+05 1.230654e+06 8.890165e+05 4.669539e+06 1.927200e+05 2.081041e+06 2.342879e+05 2.506319e+06 2.187476e+06 1.801938e+06 4.998364e+06 3.092758e+06 2.548199e+05 7.088053e+06 2.080027e+05 3.636170e+05 9.868416e+05 8.146401e+05 1.005335e+06 1.046747e+06 1.045305e+06 6.425673e+05 3.122976e+05 2.124853e+05 2.859522e+05 2.052240e+06 1.239839e+06 3.044806e+05 1.030007e+06 2.775283e+05 1.802698e+05 4.596828e+05 4.920707e+05 8.171955e+05 6.539909e+05 2.186040e+05 3.911242e+05 1.916149e+05 2.849286e+06 3.196823e+06 3.232531e+05 4.556540e+05 1.472639e+06 1.719289e+06 6.608355e+05 2.812408e+06 2.628836e+06 1.392950e+06 1.162041e+06 2.790873e+05 1.923033e+05 1.475682e+06 7.060320e+05 3.894406e+06 6.599725e+05 2.328327e+06 4.180021e+05 1.279818e+06 1.538040e+05 8.140599e+05 3.052487e+06 7.003685e+05 2.067807e+06 7.546272e+05 1.497292e+05 8.539437e+06 2.465530e+06 6.996557e+05 1.356484e+05 1.979382e+05 1.313995e+06 1.077507e+06 3.308015e+05 5.845338e+05 3.517491e+05 1.001734e+06 1.823087e+06 1.134057e+06 2.224375e+06 8.577294e+05 6.370831e+06 8.752719e+05 8.049391e+05 9.301005e+05 1.164910e+06 6.885347e+05 1.539602e+06 1.967554e+06 1.380273e+06 7.215140e+06 1.107842e+06 1.149410e+06 6.294921e+05 1.303846e+05 5.129060e+06 1.704544e+05 6.098939e+06 1.334489e+06 3.558824e+05 9.417861e+05 4.178310e+05 1.828566e+06 3.614255e+05 2.032760e+06 4.703022e+05 C11 H11 Br N2 O2_6.077 4.172557e+06 2.804712e+06 2.804962e+06 2.695028e+06 1.519259e+05 3.336110e+06 3.418739e+06 3.117190e+06 125793.54 3.288078e+06 3.105008e+06 3.181790e+06 117157.72 2.964209e+06 2.859460e+06 3.301088e+06 1.455747e+05 2.812794e+06 2.814969e+06 2.964457e+06 1.141025e+05 2.784896e+06 3.573237e+06 3.435400e+06 21533.453 2.828873e+06 2.788673e+06 2.946881e+06 3.101673e+04 3.624098e+06 2.617081e+06 3.484981e+06 110097.00 2.547318e+06 3.172400e+06 2.983044e+06 1.426211e+05 3.020013e+06 3.145411e+06 3.536514e+06 1.075165e+05 2.768570e+06 3.536537e+06 2.081355e+06 1.015046e+05 3.280667e+06 2.624755e+06 3.576239e+06 2.229263e+06 2.223890e+06 5.056094e+06 4.425224e+06 4.471761e+06 3.174572e+06 3.946776e+06 3.601582e+06 3.637673e+06 6.422203e+06 6.935643e+06 2.443702e+06 6.845085e+06 6.183739e+06 2.853099e+06 3.274896e+06 4.689377e+06 2.129597e+06 5.196459e+06 3.238682e+06 3.908745e+06 4.735382e+06 4.460582e+06 4.474645e+06 3.597690e+06 2.769186e+06 3.320538e+06 2.488313e+06 4.009424e+06 4.215592e+06 9.382235e+06 3.997425e+06 4.571345e+06 3.509959e+06 1.774868e+06 2.662853e+06 3.026477e+06 3.799226e+06 2.201641e+06 1.980599e+06 2.566121e+06 3.377707e+06 3.097680e+06 1.338605e+06 3.027647e+06 2.378299e+06 1.715434e+06 2.392453e+06 1.455999e+06 4.324914e+06 2.727166e+06 3.545828e+06 2.031082e+06 1.942483e+06 4.129758e+06 2.370532e+06 2.354241e+06 2.392434e+06 1.813129e+06 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5.892418e+06 C11 H8 O7 S_6.078 2.183421e+06 1.315831e+06 1.359377e+06 1.267072e+06 1.517845e+05 1.672713e+06 1.953250e+06 1.532428e+06 126133.02 1.555154e+06 1.460242e+06 1.530704e+06 119038.91 1.485761e+06 1.533809e+06 1.519076e+06 1.458470e+05 1.398150e+06 1.351996e+06 1.409176e+06 1.099014e+05 1.529768e+06 1.680061e+06 1.813037e+06 20525.993 1.397795e+06 1.406156e+06 1.454520e+06 3.050389e+04 1.647031e+06 1.269126e+06 1.744622e+06 107378.79 1.382784e+06 1.435075e+06 1.555550e+06 1.391976e+05 1.545900e+06 1.537768e+06 1.736520e+06 1.082700e+05 1.357828e+06 1.687221e+06 1.147625e+06 1.040390e+05 1.575087e+06 1.218795e+06 1.823856e+06 1.114664e+06 1.048005e+06 2.708806e+06 2.147718e+06 2.297663e+06 1.504693e+06 1.974563e+06 2.011015e+06 1.749000e+06 3.582697e+06 3.897766e+06 1.164137e+06 3.160013e+06 3.149362e+06 1.259560e+06 1.677918e+06 2.503970e+06 1.191224e+06 2.804906e+06 1.446373e+06 2.057975e+06 2.353545e+06 2.155510e+06 2.305692e+06 1.871461e+06 1.334234e+06 1.811530e+06 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6.744155e+08 1.627813e+08 3.379343e+08 4.036258e+08 4.949841e+08 2.611255e+08 2.304325e+08 8.591963e+08 4.605026e+08 4.716738e+08 2.469923e+08 4.174302e+08 5.200849e+08 7.289069e+08 4.506040e+08 8.205221e+08 8.106108e+08 4.313174e+08 1.060253e+09 9.599506e+08 9.297368e+08 C4 H2 N10 P2_6.245 6.326389e+05 3.727512e+05 5.924346e+05 4.626368e+05 2.776782e+05 3.798478e+05 6.477580e+05 3.478441e+05 204828.73 3.609613e+05 3.415017e+05 6.105361e+05 200068.04 4.332913e+05 6.012736e+05 5.429026e+05 1.718568e+05 2.543725e+05 4.465186e+05 5.757141e+05 1.408298e+05 2.752399e+05 2.303840e+05 6.197451e+05 20478.819 2.148790e+05 4.882252e+05 4.248870e+05 2.337981e+04 3.189132e+05 3.862256e+05 5.190944e+05 106191.39 5.539766e+05 4.866928e+05 3.481912e+05 1.520195e+05 5.266716e+05 3.895888e+05 6.068251e+05 1.309289e+05 3.036849e+05 4.133774e+05 6.415117e+05 1.285056e+05 4.462286e+05 5.118813e+05 3.189278e+05 2.845674e+05 4.943440e+05 3.728976e+05 2.377435e+05 5.017358e+05 1.382121e+06 2.656156e+05 5.155257e+06 1.358920e+07 1.025592e+07 6.598098e+06 5.619079e+05 2.293417e+05 2.949116e+05 2.665907e+05 3.350846e+05 2.439566e+05 5.191204e+05 5.570578e+05 5.795061e+05 5.167240e+05 6.612854e+05 7.635795e+05 2.063449e+05 3.242154e+05 1.929765e+05 5.926948e+05 3.888959e+05 2.265066e+05 3.628207e+05 2.519638e+05 3.466562e+05 2.841133e+05 2.393644e+05 2.265679e+05 5.707214e+05 3.822362e+05 2.069950e+05 2.678914e+05 4.404148e+05 4.161127e+05 2.128738e+05 4.006842e+05 2.514170e+05 3.051018e+05 3.820163e+05 2.050680e+05 4.661886e+05 6.987521e+05 2.374162e+05 2.275938e+05 2.232373e+05 2.025490e+05 1.973890e+05 2.261506e+05 2.644696e+05 1.734022e+05 1.990500e+05 1.938907e+05 2.692319e+05 2.118763e+05 2.289931e+05 2.344033e+05 6.591972e+05 3.636227e+05 3.337942e+05 2.425867e+05 5.912852e+05 5.547250e+05 2.489700e+05 3.689329e+05 4.703528e+05 1.695926e+05 2.127611e+05 4.665891e+05 4.722463e+05 3.969613e+05 6.068277e+05 5.829195e+05 3.051058e+05 2.095028e+05 2.339738e+05 2.463214e+05 4.563558e+05 5.705148e+05 2.178272e+05 2.148795e+05 6.137226e+05 2.709177e+05 2.663800e+05 2.061218e+05 2.530997e+05 2.078520e+05 9.895708e+05 4.348478e+05 7.054588e+05 2.690377e+05 2.876331e+05 2.254987e+05 9.858047e+05 3.748608e+05 7.540846e+05 2.936976e+05 2.049780e+05 1.999000e+05 2.254377e+05 3.673883e+05 4.039989e+05 2.326436e+05 3.659668e+05 3.562848e+05 2.245187e+05 1.949387e+05 2.061325e+05 1.936328e+05 3.755671e+05 1.783106e+05 1.956521e+05 2.237822e+05 2.291445e+05 3.079738e+05 5.648942e+05 4.947777e+05 2.994672e+05 2.753255e+05 2.516043e+05 5.778247e+05 2.423889e+05 2.938963e+05 2.000032e+05 4.171964e+05 3.331852e+05 2.040892e+05 2.383680e+05 4.908845e+05 2.722602e+05 2.356563e+05 3.682962e+05 3.017571e+05 3.054703e+05 2.499323e+05 6.401003e+05 8.504536e+05 5.892726e+05 6.779102e+05 2.362362e+05 1.970779e+05 3.867789e+05 3.733210e+05 2.294945e+05 4.895083e+05 4.697823e+05 2.658165e+05 3.051299e+05 3.565139e+05 2.916475e+05 3.307424e+05 2.093287e+05 2.500279e+05 4.808342e+05 4.861992e+05 2.590900e+05 2.385472e+05 2.137649e+05 4.378094e+05 2.311843e+05 3.576716e+05 3.135423e+05 7.738152e+05 1.701525e+05 2.312774e+05 3.529458e+05 2.987080e+05 2.393973e+05 2.108485e+05 2.650311e+05 2.745991e+05 2.523106e+05 3.941481e+05 2.665935e+05 4.557089e+05 4.920897e+05 2.108082e+05 5.245311e+05 3.891635e+05 2.868038e+05 2.133039e+05 3.849808e+05 6.969012e+05 3.232961e+05 6.130105e+05 6.047466e+05 2.105677e+05 2.826230e+05 2.665536e+05 2.717069e+05 2.157505e+05 4.192564e+05 3.349268e+05 1.761526e+05 2.251020e+05 2.418943e+05 2.434682e+05 2.509350e+05 4.051211e+05 5.125358e+05 3.047942e+05 1.820995e+05 3.140205e+05 2.066611e+05 3.985281e+05 3.636473e+05 3.335335e+05 4.324607e+05 C4 H7 N7 O2 P2_6.256 5.150220e+06 2.389320e+06 3.376863e+06 3.087514e+06 5.823167e+05 3.433022e+06 3.602437e+06 2.963917e+06 446844.22 3.010108e+06 2.923578e+06 3.209928e+06 474802.07 2.685760e+06 2.912959e+06 3.624912e+06 5.856353e+05 3.498356e+06 2.228340e+06 2.670741e+06 3.190865e+05 3.867153e+06 3.249332e+06 3.699620e+06 51849.005 2.705341e+06 2.742868e+06 2.489454e+06 5.500600e+04 3.349658e+06 3.750225e+06 3.003203e+06 235109.00 2.622801e+06 3.177157e+06 3.178663e+06 2.932388e+05 3.487630e+06 2.939943e+06 3.515258e+06 2.779192e+05 2.360319e+06 2.946381e+06 3.455721e+06 2.509568e+05 3.242284e+06 2.821403e+06 3.188719e+06 1.850639e+06 2.542730e+06 2.509564e+06 1.449862e+06 1.562027e+06 6.717028e+06 2.793156e+06 2.070765e+07 5.930317e+07 3.458338e+07 3.017844e+07 3.744501e+06 1.705808e+06 2.593942e+06 2.777437e+06 2.979817e+06 3.908343e+06 2.775353e+06 2.900828e+06 2.688749e+06 3.314955e+06 3.600281e+06 4.402137e+06 1.706923e+06 4.088701e+06 1.824422e+06 3.100891e+06 3.152874e+06 1.698986e+06 2.819453e+06 1.899981e+06 1.284943e+06 2.726372e+06 2.358062e+06 1.686390e+06 2.903614e+06 2.533365e+06 2.343743e+06 1.621135e+06 1.411356e+06 2.221947e+06 2.105927e+06 3.831636e+06 2.171629e+06 4.177040e+06 3.439327e+06 1.718050e+06 2.444568e+06 4.130321e+06 1.553314e+06 1.986477e+06 2.010793e+06 3.588246e+06 1.896531e+06 2.487573e+06 2.247949e+06 1.617783e+06 1.519581e+06 1.487774e+06 2.343164e+06 2.314035e+06 2.310003e+06 1.278223e+06 3.625947e+06 3.189350e+06 1.976522e+06 2.576914e+06 1.886252e+06 3.862198e+06 2.010681e+06 2.161396e+06 3.135820e+06 1.292291e+06 1.375982e+06 2.294821e+06 3.141614e+06 3.326595e+06 2.955970e+06 1.654846e+06 2.195800e+06 3.507630e+06 1.739785e+06 3.582232e+06 2.292689e+06 3.141742e+06 1.935410e+06 2.601986e+06 3.551806e+06 2.690029e+06 2.424702e+06 1.946114e+06 2.434437e+06 1.631117e+06 5.537780e+06 2.258679e+06 4.799873e+06 2.922184e+06 2.430718e+06 2.339475e+06 3.763353e+06 3.912497e+06 2.548097e+06 3.010283e+06 1.681746e+06 2.708665e+06 1.716164e+06 2.703531e+06 3.362889e+06 2.819254e+06 2.392052e+06 1.756845e+06 2.678195e+06 1.869616e+06 2.094417e+06 2.900882e+06 2.034416e+06 1.376558e+06 3.237406e+06 1.462459e+06 2.493161e+06 1.752188e+06 4.367209e+06 2.373613e+06 2.613202e+06 1.882645e+06 2.963390e+06 1.570213e+06 2.100249e+06 1.977182e+06 1.562845e+06 3.294309e+06 1.052364e+06 2.230435e+06 2.247090e+06 3.056948e+06 2.497301e+06 2.309359e+06 2.599297e+06 2.875020e+06 2.126294e+06 2.437001e+06 2.936733e+06 3.667962e+06 4.939813e+06 5.664000e+06 1.961444e+06 1.654192e+06 4.373141e+06 2.855376e+06 2.746032e+06 2.820090e+06 4.100722e+06 2.506003e+06 2.796735e+06 2.409277e+06 3.075883e+06 3.264001e+06 1.960018e+06 2.707163e+06 4.666062e+06 1.743247e+06 2.953217e+06 2.542639e+06 2.383070e+06 3.873122e+06 2.183249e+06 2.124836e+06 2.568075e+06 4.126241e+06 2.011430e+06 1.849723e+06 3.149299e+06 2.817049e+06 3.301769e+06 2.020434e+06 2.531288e+06 2.963552e+06 2.507137e+06 2.803521e+06 3.797487e+06 3.364136e+06 3.436599e+06 1.837149e+06 3.142079e+06 2.926352e+06 2.465520e+06 4.099133e+06 2.770511e+06 3.895256e+06 2.173046e+06 3.090842e+06 3.700665e+06 2.255830e+06 2.257881e+06 2.358572e+06 2.392768e+06 2.063343e+06 1.441919e+06 2.945687e+06 1.960940e+06 2.500131e+06 2.749959e+06 2.375934e+06 1.633370e+06 3.977346e+06 5.131136e+06 2.384401e+06 1.639337e+06 1.602187e+06 2.498731e+06 1.695138e+06 1.905480e+06 2.453911e+06 4.634530e+06 C17 H7 N6 O P S_6.265 1.560294e+06 8.308047e+05 7.316566e+05 7.273990e+05 1.455769e+05 7.795090e+05 7.890969e+05 1.126803e+06 115056.56 6.133858e+05 7.250650e+05 9.755177e+05 131316.83 6.395821e+05 8.131467e+05 8.045889e+05 1.289419e+05 7.243623e+05 5.149977e+05 9.470296e+05 1.130166e+05 8.731264e+05 8.414315e+05 1.008034e+06 18682.870 5.652046e+05 8.274216e+05 4.214607e+05 2.120928e+04 1.182074e+06 5.362168e+05 9.683485e+05 92419.77 7.824973e+05 8.093370e+05 7.077264e+05 1.099267e+05 7.723582e+05 8.822711e+05 8.814642e+05 9.475145e+04 5.216871e+05 9.294753e+05 9.338748e+05 8.459108e+04 7.489573e+05 6.423932e+05 8.403985e+05 6.925102e+05 3.796655e+05 4.392935e+05 4.649492e+05 3.285039e+05 2.246993e+06 1.669988e+06 3.552736e+06 1.835542e+07 1.035589e+07 7.369761e+06 1.193730e+06 9.057829e+05 1.022774e+06 5.251558e+05 5.130961e+05 8.752758e+05 6.444762e+05 7.259386e+05 7.675708e+05 8.176618e+05 9.114732e+05 1.167974e+06 2.461415e+05 4.889676e+05 2.001571e+05 8.156607e+05 7.402340e+05 7.145385e+05 8.277025e+05 9.831612e+05 5.348514e+05 7.382262e+05 9.965853e+05 5.249194e+05 6.297165e+05 2.988280e+05 4.765422e+05 2.969642e+05 4.644571e+05 6.009562e+05 6.134664e+05 8.532992e+05 3.269878e+05 1.061890e+06 4.969339e+05 3.424105e+05 2.822468e+05 8.337266e+05 6.013301e+05 2.760837e+05 4.975212e+05 6.628083e+05 3.267168e+05 5.090110e+05 4.990085e+05 3.686908e+05 6.185161e+05 2.187970e+05 5.755011e+05 5.534751e+05 4.105323e+05 3.302784e+05 1.232361e+06 6.980292e+05 6.092498e+05 2.517760e+05 3.156395e+05 1.004396e+06 3.299329e+05 8.470946e+05 8.992368e+05 1.462084e+05 4.387284e+05 4.602726e+05 3.667289e+05 2.239885e+05 7.041708e+05 4.252075e+05 2.160587e+05 7.812409e+05 1.001109e+06 1.035103e+06 5.306382e+05 6.988203e+05 3.757778e+05 5.519584e+05 9.763465e+05 5.034619e+05 7.754725e+05 4.313405e+05 6.848009e+05 4.671437e+05 1.607883e+06 2.818676e+05 1.178428e+06 6.628549e+05 2.470785e+05 2.012179e+05 1.327991e+06 8.102310e+05 6.085699e+05 3.552249e+05 2.742400e+05 6.545290e+05 7.846858e+05 5.486133e+05 4.635223e+05 5.750560e+05 3.249347e+05 5.654847e+05 7.051642e+05 5.511034e+05 3.166107e+05 8.095658e+05 5.730500e+05 2.611914e+05 8.252637e+05 6.763833e+05 6.025997e+05 5.118111e+05 1.039052e+06 1.009354e+06 7.686564e+05 6.175877e+05 1.253809e+06 5.424824e+05 4.719975e+05 9.374005e+05 3.629923e+05 9.823367e+05 3.301855e+05 1.708798e+05 4.420589e+05 6.958064e+05 6.165845e+05 3.684292e+05 6.778574e+05 7.561269e+05 3.982043e+05 5.567446e+05 1.034414e+06 1.392555e+06 9.698169e+05 2.513043e+05 6.733526e+05 2.251386e+05 1.075202e+06 1.144116e+06 9.091529e+05 7.846753e+05 8.698473e+05 8.963740e+05 8.003902e+05 6.286564e+05 7.007694e+05 3.722123e+05 3.957972e+05 5.850032e+05 7.915769e+05 5.755934e+05 2.455562e+05 4.587323e+05 7.776092e+05 1.045826e+06 5.265530e+05 7.585476e+05 7.672653e+05 1.110934e+06 4.536913e+05 6.700569e+05 6.720244e+05 5.870379e+05 4.014572e+05 7.416195e+05 4.866735e+05 1.034157e+06 5.148481e+05 5.656608e+05 6.340229e+05 1.102169e+06 8.878006e+05 1.251092e+06 5.542047e+05 6.601535e+05 4.042267e+05 2.466275e+05 7.953483e+05 4.822852e+05 6.777724e+05 8.734975e+05 4.193347e+05 5.939733e+05 3.377991e+05 3.766339e+05 6.164794e+05 1.673615e+05 4.379246e+05 6.415598e+05 2.148169e+05 8.102844e+05 6.228175e+05 7.672773e+05 6.203589e+05 5.678347e+05 8.910972e+05 2.047654e+05 5.339242e+05 1.761486e+05 1.257071e+06 5.047513e+05 2.159339e+05 1.151769e+06 9.647395e+05 C7 H17 N2 O11 P_6.266 3.670792e+06 1.723866e+06 1.126267e+06 1.261497e+06 1.380565e+05 1.513927e+06 1.507971e+06 1.889269e+06 111528.40 1.365408e+06 1.669757e+06 1.579152e+06 147218.68 1.223714e+06 9.888050e+05 1.519518e+06 1.512393e+05 1.561360e+06 1.245957e+06 1.812961e+06 1.276423e+05 1.270362e+06 1.535408e+06 1.448648e+06 19235.049 1.769435e+06 1.326080e+06 1.274025e+06 2.100565e+04 1.518617e+06 1.343065e+06 2.020509e+06 93540.06 1.200449e+06 1.160675e+06 1.504548e+06 1.133081e+05 1.581495e+06 1.400038e+06 1.561632e+06 1.004544e+05 1.524589e+06 1.439962e+06 1.412591e+06 9.373459e+04 1.605845e+06 1.153569e+06 1.651690e+06 1.616575e+06 1.200732e+06 1.760391e+06 3.746302e+06 2.342943e+06 1.356288e+06 5.431079e+06 6.240482e+05 1.912201e+06 2.049009e+06 1.735925e+06 2.966636e+06 3.919808e+06 2.693822e+06 2.425073e+06 1.077117e+06 1.222793e+06 5.758201e+05 1.724137e+06 2.106672e+06 9.748951e+05 2.185956e+06 1.560770e+06 1.073114e+06 1.908722e+06 1.665303e+06 1.548060e+06 1.276931e+06 2.245403e+06 2.177183e+06 4.945165e+06 1.487218e+06 1.872350e+06 2.123399e+06 1.189719e+06 9.274159e+05 1.248657e+06 2.418519e+06 7.124884e+05 1.089415e+06 2.128381e+06 1.441175e+06 1.058297e+06 7.301111e+05 1.415706e+06 8.145528e+05 1.101177e+06 4.903159e+05 9.921767e+05 2.281657e+06 6.243688e+05 2.252595e+06 1.016001e+06 1.850524e+06 1.925049e+06 1.618650e+06 8.980894e+05 1.611413e+06 4.432243e+05 1.487662e+06 2.658359e+06 1.264533e+06 2.522521e+05 2.003986e+06 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2.983570e+06 1.500251e+06 1.050419e+06 1.630742e+05 1.227669e+06 4.562304e+05 2.865352e+06 3.161915e+06 2.014405e+06 1.761252e+06 1.391142e+06 1.968272e+06 2.461202e+06 1.312733e+06 1.745112e+06 6.183915e+05 1.451558e+06 1.727496e+06 1.381410e+06 2.514732e+06 5.609981e+05 7.727837e+05 2.532414e+06 2.008923e+06 1.104018e+06 2.592160e+06 1.571701e+06 1.442333e+06 9.868718e+05 2.155908e+06 1.056075e+06 1.362510e+06 1.659259e+06 1.142926e+06 1.293522e+06 2.031154e+06 1.026932e+06 7.713430e+05 7.573558e+05 2.418852e+06 1.296929e+06 4.597425e+06 1.114040e+06 1.315120e+06 1.152355e+06 8.639636e+05 1.526466e+06 4.871135e+05 1.260700e+06 1.033943e+06 9.528605e+05 4.993825e+06 1.395598e+06 7.234799e+05 2.221991e+06 1.094305e+06 1.707554e+06 1.750581e+06 1.630651e+06 1.563389e+06 2.147409e+06 2.199639e+06 3.881975e+06 6.433970e+05 1.276239e+06 1.635658e+06 2.169236e+06 1.154388e+06 2.230411e+06 2.496276e+06 9.909729e+05 3.574218e+06 1.531949e+06 C3 H5 N4 O P_6.266 4.910748e+06 2.184968e+06 3.021000e+06 2.716823e+06 2.274063e+05 3.157120e+06 3.416851e+06 2.644519e+06 191165.16 2.708532e+06 2.361487e+06 2.986789e+06 198588.42 2.617750e+06 2.632198e+06 3.018304e+06 3.845274e+05 2.847342e+06 2.371705e+06 2.936760e+06 1.327185e+05 3.429054e+06 2.570264e+06 3.305235e+06 22608.296 2.384160e+06 2.518121e+06 2.143315e+06 2.455886e+04 3.317803e+06 3.417665e+06 2.588572e+06 107304.01 2.182066e+06 2.833134e+06 2.943524e+06 1.280015e+05 3.250191e+06 2.477722e+06 3.369686e+06 1.246647e+05 2.263510e+06 2.883643e+06 3.333172e+06 1.248781e+05 1.961206e+06 3.015488e+06 2.806696e+06 1.823919e+06 2.258199e+06 1.778320e+06 1.159025e+06 1.178808e+06 6.647497e+06 2.312633e+06 1.505125e+07 6.056821e+07 3.874864e+07 2.621276e+07 3.464846e+06 1.442717e+06 2.473720e+06 2.298935e+06 2.617100e+06 3.464317e+06 3.188833e+06 2.443194e+06 2.395999e+06 2.688197e+06 2.927891e+06 4.267328e+06 1.338692e+06 4.412050e+06 1.388116e+06 2.674062e+06 2.738839e+06 1.337117e+06 2.476183e+06 1.798037e+06 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2.088204e+06 3.868547e+06 2.536164e+06 3.436261e+06 2.303879e+06 2.957075e+06 3.847932e+06 1.936734e+06 1.836666e+06 2.018433e+06 2.061523e+06 1.628417e+06 1.373276e+06 2.658448e+06 1.766917e+06 1.954010e+06 2.487710e+06 1.995812e+06 1.398612e+06 3.681208e+06 5.291591e+06 2.072202e+06 1.344560e+06 1.364718e+06 2.115655e+06 1.395449e+06 1.591090e+06 2.230400e+06 4.238402e+06 C5 H14 N7 O5 P3_6.267 6.367960e+07 9.002182e+06 3.803748e+07 3.304385e+07 4.323370e+05 2.493181e+07 3.949289e+07 3.469477e+07 214846.23 3.502119e+07 1.803756e+07 3.533222e+07 245832.35 2.035432e+07 3.623701e+07 3.562947e+07 2.273530e+05 1.849326e+07 2.464895e+07 3.421474e+07 1.773576e+05 2.725824e+07 3.492443e+07 2.469777e+07 25786.780 3.178522e+07 2.888741e+07 2.647996e+07 2.745454e+04 3.169048e+07 3.961584e+07 2.896590e+07 138345.95 1.854298e+07 2.351890e+07 2.766927e+07 1.696589e+05 3.287997e+07 3.696318e+07 3.382591e+07 1.492679e+05 2.213152e+07 2.460942e+07 3.584752e+07 1.521734e+05 3.131573e+07 2.729354e+07 2.744994e+07 3.489062e+07 3.049583e+07 3.290072e+07 3.649887e+07 4.951393e+07 3.151064e+07 4.328541e+07 1.978863e+07 3.769226e+07 3.053523e+07 2.485733e+07 3.938929e+07 2.890190e+07 3.564710e+07 3.980117e+07 2.717826e+07 2.796148e+07 2.448608e+07 3.248836e+07 4.009011e+07 2.584345e+07 3.669098e+07 2.696251e+07 1.844123e+07 3.121852e+07 1.554506e+07 2.670134e+07 3.043601e+07 3.330257e+07 2.274633e+07 3.611004e+07 1.784390e+07 2.113130e+07 3.407838e+07 1.696671e+07 3.058389e+07 3.304022e+07 3.057585e+07 2.515730e+07 2.502488e+07 3.062452e+07 3.106342e+07 2.564104e+07 2.652634e+07 3.536724e+07 2.422840e+07 2.287430e+07 2.158750e+07 2.796354e+07 3.654176e+07 2.470039e+07 1.962860e+07 2.654250e+07 3.228041e+07 4.028313e+07 1.755558e+07 2.693957e+07 7.239643e+06 2.376397e+07 2.244777e+07 2.397103e+07 3.116364e+07 1.580666e+07 3.030788e+07 2.831974e+07 1.120276e+07 2.156825e+07 3.913315e+07 2.695016e+07 3.483413e+07 1.921139e+07 3.450684e+07 2.235463e+07 3.263789e+07 1.645441e+07 1.973974e+07 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3.486370e+07 2.898368e+07 3.028171e+07 3.171874e+07 2.337986e+07 3.700034e+07 4.186242e+07 2.823506e+07 3.513561e+07 2.878977e+07 1.673419e+07 3.635425e+07 2.397788e+07 4.598495e+07 3.493218e+07 3.700597e+07 2.313422e+07 2.784590e+07 2.749329e+07 2.742675e+07 1.987217e+07 1.769020e+07 2.954734e+07 3.453789e+07 2.742312e+07 2.806119e+07 2.081117e+07 4.349509e+07 2.815892e+07 4.020246e+07 2.615081e+07 3.284847e+07 2.201799e+07 1.451129e+07 2.500717e+07 3.473234e+07 2.215640e+07 2.856450e+07 1.821019e+07 3.272021e+07 3.901655e+07 2.995033e+07 3.018217e+07 2.406209e+07 3.551977e+07 3.411240e+07 4.715886e+07 2.466081e+07 4.286776e+07 2.213724e+07 3.911222e+07 1.245377e+07 2.551363e+07 3.417020e+07 3.425653e+07 3.398875e+07 2.765418e+07 4.366144e+07 2.741878e+07 3.941608e+07 3.944757e+07 C13 H18 N2 O13 P2_6.268 4.757897e+06 1.708119e+06 3.077147e+06 2.524177e+06 1.713847e+05 3.408808e+06 2.453740e+06 2.164491e+06 136847.98 2.570678e+06 2.953602e+06 2.757228e+06 142365.16 2.211173e+06 2.617094e+06 2.706701e+06 1.249999e+05 2.805272e+06 2.481395e+06 3.279042e+06 1.205369e+05 1.867800e+06 2.647247e+06 2.268722e+06 20076.966 2.904562e+06 2.860853e+06 1.571683e+06 2.114534e+04 3.308811e+06 2.754541e+06 2.194230e+06 95940.07 3.195653e+06 2.390970e+06 2.104968e+06 1.249549e+05 2.921658e+06 2.729838e+06 2.660104e+06 1.140752e+05 2.241301e+06 2.751541e+06 2.665198e+06 1.438960e+05 3.017009e+06 2.198947e+06 2.630777e+06 2.046932e+06 3.052932e+06 3.246633e+06 4.575439e+06 4.021805e+06 2.727242e+06 4.777789e+06 1.865380e+06 2.989001e+06 2.179247e+06 2.307098e+06 2.953731e+06 3.009803e+06 3.887797e+06 3.659127e+06 2.523027e+06 2.793421e+06 7.714894e+05 2.320994e+06 3.341076e+06 1.710160e+06 3.570485e+06 3.607100e+06 2.062277e+06 3.826372e+06 3.697786e+06 2.450820e+06 2.246112e+06 1.849696e+06 3.599952e+06 3.844292e+06 1.450606e+06 1.942495e+06 2.151788e+06 2.362488e+06 2.113121e+06 2.470601e+06 2.691110e+06 1.544207e+06 1.999441e+06 3.368435e+06 2.050067e+06 3.298555e+06 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2.991704e+06 3.065342e+06 3.484485e+06 2.899361e+06 2.308720e+06 2.522729e+06 3.906288e+06 1.444991e+06 3.777858e+06 4.021154e+06 2.247310e+06 2.713004e+06 3.328341e+06 1.836325e+06 2.127798e+06 3.650451e+06 2.960588e+06 C3 H N6 P_6.269 7.138684e+07 1.433533e+07 1.659865e+07 2.543232e+07 7.252309e+05 1.317392e+07 3.139617e+07 1.365643e+07 397644.73 1.817688e+07 2.622724e+07 1.343712e+07 442806.25 2.906141e+07 1.372170e+07 1.470016e+07 4.196017e+05 2.066785e+07 1.129878e+07 2.712569e+07 2.894312e+05 2.330490e+07 1.349575e+07 2.385129e+07 40370.454 2.041085e+07 1.681015e+07 2.288510e+07 4.750861e+04 2.605842e+07 1.403559e+07 1.198892e+07 264004.02 1.639878e+07 1.928342e+07 1.231668e+07 2.817333e+05 2.926730e+07 2.600645e+07 2.481035e+07 3.178343e+05 1.482974e+07 1.084221e+07 1.106529e+07 2.790736e+05 2.974633e+07 2.687324e+07 1.375983e+07 3.031633e+07 1.331670e+07 3.580924e+07 2.975926e+07 4.105430e+07 1.187836e+07 4.455485e+07 1.135790e+07 1.016678e+07 1.000964e+07 2.552965e+07 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2.146242e+07 4.654302e+07 1.141511e+07 1.303914e+07 9.609149e+06 1.578966e+07 1.554019e+07 2.589022e+07 1.057456e+07 1.662505e+07 2.690879e+07 8.453753e+06 2.222062e+07 2.059018e+07 5.775742e+06 1.260580e+07 1.484391e+07 3.084015e+07 2.095931e+07 3.365681e+07 1.160896e+07 8.831668e+06 2.502379e+07 1.320072e+07 1.200050e+07 1.433247e+07 1.908218e+07 2.267787e+07 1.749454e+07 1.387639e+07 3.108059e+07 2.650246e+07 9.769941e+06 1.091632e+07 1.171031e+07 1.335830e+07 3.366448e+07 2.595953e+07 2.416985e+07 1.581069e+07 1.285529e+07 3.152011e+07 1.332427e+07 1.313624e+07 2.554014e+07 1.619759e+07 1.541436e+07 3.349756e+07 3.818708e+07 1116.00772_6.27 5.152132e+06 2.834937e+06 1.843875e+06 1.947148e+06 1.249792e+05 2.627995e+06 2.546869e+06 2.174967e+06 105909.58 2.086474e+06 2.851950e+06 2.094749e+06 121809.59 2.099054e+06 2.559217e+06 2.536411e+06 1.137088e+05 2.251787e+06 1.868899e+06 2.536834e+06 1.027804e+05 2.192937e+06 2.367876e+06 2.772265e+06 16014.653 2.240462e+06 2.387530e+06 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1.300561e+06 1.656223e+06 3.050493e+06 2.164987e+06 1.939427e+06 1.609899e+06 2.032799e+06 2.241255e+06 5.205664e+06 2.239129e+06 1.424244e+06 2.177632e+05 2.919719e+06 8.739170e+05 2.771702e+06 2.940129e+06 3.933768e+06 3.238085e+06 1.852270e+06 5.077311e+06 3.658399e+06 2.056598e+06 2.874377e+06 7.949149e+05 3.489014e+06 2.870258e+06 2.018375e+06 3.440241e+06 8.265898e+05 1.214122e+06 2.952801e+06 2.860604e+06 2.373068e+06 5.030880e+06 2.604700e+06 2.247484e+06 1.658855e+06 2.639018e+06 2.597600e+06 1.657992e+06 1.566932e+06 2.053751e+06 1.910409e+06 2.580035e+06 1.614225e+06 1.632694e+06 9.312225e+05 2.041327e+06 2.181714e+06 5.660081e+06 1.608964e+06 2.395593e+06 2.189976e+06 1.749890e+06 2.507250e+06 7.690960e+05 2.072022e+06 2.311876e+06 1.414921e+06 6.042231e+06 3.265424e+06 1.261179e+06 4.126160e+06 2.159221e+06 2.438634e+06 2.858645e+06 2.628007e+06 3.176509e+06 2.515395e+06 3.788342e+06 4.871815e+06 1.201464e+06 2.101618e+06 1.977466e+06 2.433621e+06 1.821739e+06 3.521409e+06 3.571407e+06 1.591018e+06 2.672444e+06 2.833579e+06 C5 H11 N4 O P3_6.27 5.798569e+06 2.061351e+06 2.935067e+06 2.400636e+06 1.878611e+05 3.223334e+06 3.439914e+06 2.558969e+06 149539.78 2.437528e+06 2.913868e+06 2.803851e+06 167653.33 2.256554e+06 2.671290e+06 2.986885e+06 1.465993e+05 2.841277e+06 2.442193e+06 3.114384e+06 1.316387e+05 2.407079e+06 2.595862e+06 2.853575e+06 20976.040 3.053919e+06 2.646755e+06 2.107561e+06 2.339688e+04 3.175746e+06 2.715866e+06 2.398654e+06 110910.41 3.197451e+06 2.393833e+06 2.674811e+06 1.485847e+05 2.938194e+06 2.788686e+06 2.756755e+06 1.370024e+05 2.331082e+06 2.836431e+06 2.802325e+06 1.284713e+05 3.172938e+06 2.311440e+06 2.763119e+06 2.880904e+06 3.032056e+06 3.413786e+06 5.204846e+06 4.160524e+06 2.730139e+06 4.877392e+06 1.959432e+06 2.766177e+06 2.365199e+06 3.117451e+06 3.479937e+06 4.586800e+06 4.088797e+06 4.131586e+06 2.559265e+06 2.869552e+06 1.707465e+06 2.248893e+06 3.346252e+06 1.672983e+06 3.157449e+06 3.336056e+06 1.971860e+06 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2.410054e+06 1.491700e+06 2.898083e+06 3.018740e+06 4.519201e+06 2.020517e+06 2.751255e+06 2.161980e+06 2.128754e+06 3.284473e+06 1.865541e+06 2.601710e+06 2.562765e+06 1.802694e+06 4.424370e+06 3.208781e+06 2.137002e+06 4.706158e+06 2.603839e+06 3.145281e+06 2.994641e+06 3.477189e+06 3.604936e+06 2.659099e+06 2.560186e+06 4.153634e+06 1.400101e+06 3.529295e+06 3.778356e+06 2.676250e+06 2.375481e+06 3.390431e+06 2.824197e+06 2.170580e+06 4.273861e+06 3.013659e+06 C10 H10 N2 O10 S_6.271 1.007193e+07 4.477184e+06 5.286725e+06 3.482258e+06 3.123087e+05 4.096982e+06 4.384803e+06 3.961462e+06 215067.11 4.995053e+06 3.669881e+06 4.847844e+06 222788.09 3.655953e+06 4.716983e+06 5.290068e+06 1.823775e+05 3.085623e+06 4.203690e+06 4.725590e+06 1.559586e+05 4.451696e+06 4.242424e+06 4.133736e+06 23637.931 4.674808e+06 4.052483e+06 3.708075e+06 2.435212e+04 4.825324e+06 4.623297e+06 5.337845e+06 111676.87 3.388721e+06 2.819687e+06 4.932338e+06 1.506747e+05 5.644093e+06 4.957611e+06 4.013301e+06 1.599309e+05 2.659893e+06 4.006321e+06 4.936037e+06 1.457702e+05 4.826124e+06 3.770299e+06 4.611681e+06 4.581202e+06 4.248439e+06 5.277540e+06 6.918199e+06 5.298411e+06 4.449477e+06 7.008599e+06 3.515103e+06 5.071029e+06 4.168300e+06 5.421044e+06 5.988844e+06 5.250670e+06 6.192873e+06 6.343219e+06 4.437373e+06 4.477893e+06 1.895626e+06 4.542164e+06 6.114674e+06 3.704406e+06 5.769884e+06 5.439851e+06 2.220846e+06 6.951744e+06 2.895865e+06 4.263986e+06 4.061337e+06 5.129495e+06 5.242500e+06 7.727974e+06 4.674518e+06 5.902810e+06 4.494887e+06 4.624695e+06 2.613498e+06 4.261015e+06 5.061720e+06 3.449862e+06 2.465425e+06 6.165194e+06 4.603393e+06 4.784479e+06 4.339899e+06 5.140183e+06 4.422357e+06 4.198363e+06 1.589894e+06 4.670642e+06 4.358503e+06 3.317362e+06 4.456489e+06 2.690779e+06 4.206432e+06 5.324912e+06 6.033711e+06 3.105638e+06 7.118143e+06 2.538958e+06 3.056768e+06 5.001693e+06 3.673556e+06 1.682760e+06 3.864488e+06 2.340334e+06 3.119913e+06 3.175977e+06 4.848838e+06 4.450662e+06 5.932818e+06 3.348925e+06 4.543463e+06 3.779442e+06 4.659389e+06 2.806936e+06 2.284893e+06 2.542339e+06 4.387787e+06 5.423239e+06 4.573132e+06 4.494573e+06 8.187895e+06 6.158822e+06 3.911462e+06 4.088969e+06 4.117047e+06 5.431567e+06 2.455550e+06 3.425457e+06 5.405339e+06 2.927092e+06 4.314620e+06 3.713310e+06 3.825049e+06 3.684651e+06 4.710373e+06 6.189912e+06 2.014429e+06 3.082328e+06 3.573657e+06 3.524419e+06 3.130878e+06 2.002217e+06 3.270958e+06 4.182558e+06 6.009576e+06 3.288815e+06 4.172354e+06 3.757675e+06 3.908742e+06 4.919055e+06 4.960403e+06 3.127610e+06 3.558993e+06 6.311365e+06 6.339052e+06 4.414023e+06 6.196901e+06 6.520253e+06 5.174437e+06 4.959013e+06 4.169345e+06 6.087384e+06 5.697945e+06 5.393330e+06 6.382831e+06 4.986926e+06 4.295143e+06 4.744351e+06 5.216886e+06 5.844918e+06 4.786544e+06 2.681413e+06 4.464671e+06 3.510627e+06 4.706827e+06 3.994641e+06 3.964698e+06 3.854198e+06 4.528998e+06 6.798660e+06 5.313196e+06 4.525625e+06 4.536152e+06 1.007889e+06 4.423692e+06 2.930074e+06 8.420399e+06 5.175328e+06 4.071114e+06 4.440587e+06 3.545394e+06 6.874481e+06 4.068218e+06 3.828767e+06 3.942827e+06 4.307291e+06 4.981513e+06 5.226923e+06 4.688282e+06 5.518582e+06 2.503548e+06 3.711118e+06 3.382459e+06 5.050633e+06 2.618754e+06 4.637016e+06 2.905403e+06 4.679260e+06 2.959530e+06 5.305728e+06 5.743012e+06 3.499843e+06 6.472838e+06 4.024407e+06 4.444150e+06 4.751258e+06 3.216042e+06 4.179191e+06 2.522564e+06 4.253407e+06 5.380792e+06 7.081858e+06 4.041830e+06 4.257145e+06 2.400612e+06 2.330236e+06 4.524771e+06 1.987773e+06 4.147745e+06 5.293869e+06 3.642931e+06 6.761304e+06 6.753986e+06 3.111791e+06 7.645677e+06 3.417588e+06 4.586446e+06 4.359530e+06 4.144360e+06 3.437536e+06 5.034350e+06 4.767470e+06 3.946518e+06 2.542843e+06 4.263204e+06 5.552080e+06 4.753295e+06 4.204375e+06 5.284008e+06 3.952872e+06 4.487678e+06 5.932783e+06 3.818469e+06 C9 H10 N2 O6 P2_6.271 1.209960e+08 1.359979e+07 4.422990e+07 4.974307e+07 9.110506e+05 3.006359e+07 6.000734e+07 3.537156e+07 436176.18 4.555351e+07 3.976645e+07 3.915172e+07 498401.89 3.616663e+07 3.940008e+07 3.957115e+07 4.732581e+05 3.320927e+07 2.707891e+07 5.431132e+07 3.406488e+05 4.250134e+07 3.271442e+07 4.042442e+07 48314.080 4.310848e+07 3.570766e+07 4.241504e+07 5.380319e+04 4.870467e+07 4.357772e+07 3.138841e+07 295708.52 2.300160e+07 3.630040e+07 2.887887e+07 3.291424e+05 5.271789e+07 5.201084e+07 4.821404e+07 3.441521e+05 3.066898e+07 2.636889e+07 3.781077e+07 3.000093e+05 5.073587e+07 4.557847e+07 3.066596e+07 5.435850e+07 3.619139e+07 5.869566e+07 5.325429e+07 7.908894e+07 3.402451e+07 7.384442e+07 2.106947e+07 3.822880e+07 2.933239e+07 3.974929e+07 6.310811e+07 5.563737e+07 6.168779e+07 7.296043e+07 4.223002e+07 4.314352e+07 3.682669e+07 2.918105e+07 4.263214e+07 3.914069e+07 5.283355e+07 3.056496e+07 2.745114e+07 5.636719e+07 1.675469e+07 4.274993e+07 4.650442e+07 4.582145e+07 2.472120e+07 4.321956e+07 3.498353e+07 2.498475e+07 3.847068e+07 2.992066e+07 5.027897e+07 4.531860e+07 4.994579e+07 3.577073e+07 2.795387e+07 3.176726e+07 4.611795e+07 2.994535e+07 2.891353e+07 3.596401e+07 3.955666e+07 3.289946e+07 2.896886e+07 4.291161e+07 5.868767e+07 2.656229e+07 4.611168e+07 3.011105e+07 3.105273e+07 4.022422e+07 2.049799e+07 3.838240e+07 2.548281e+07 3.665995e+07 2.403539e+07 2.537496e+07 5.058449e+07 2.528856e+07 4.459099e+07 2.793423e+07 2.002462e+07 3.446709e+07 4.244808e+07 2.807174e+07 4.763944e+07 2.266830e+07 4.927509e+07 2.283222e+07 4.081406e+07 1.548694e+07 2.041821e+07 2.573202e+07 4.840497e+07 3.816738e+07 4.368629e+07 2.874234e+07 5.030730e+07 4.267247e+07 3.528320e+07 3.285554e+07 3.463106e+07 4.856829e+07 4.012863e+07 3.894287e+07 3.338615e+07 3.096998e+07 3.033311e+07 3.310049e+07 2.716066e+07 4.186520e+07 4.734895e+07 6.827048e+07 3.796895e+07 1.989099e+07 5.224824e+07 2.328265e+07 3.429612e+07 2.606235e+07 3.130377e+07 3.153123e+07 6.849250e+07 2.673832e+07 2.844801e+07 3.047745e+07 2.107696e+07 5.016821e+07 5.055163e+07 4.706020e+07 3.130534e+07 5.666847e+07 3.781143e+07 3.188778e+07 3.819941e+07 6.734634e+07 5.423134e+07 2.708162e+07 5.126867e+07 5.299771e+07 2.649955e+07 4.205590e+07 5.970817e+07 3.875369e+07 3.743350e+07 4.793184e+07 5.277915e+07 3.879376e+07 4.541976e+07 3.149753e+07 3.389185e+07 5.293924e+07 3.134123e+07 4.708308e+07 5.792499e+07 3.714824e+07 2.134934e+07 6.132799e+07 4.102064e+07 5.449258e+07 2.259767e+07 1.588486e+07 5.287312e+07 3.076459e+07 7.154349e+07 5.633989e+07 4.285314e+07 3.643852e+07 3.474174e+07 6.549128e+07 3.574760e+07 4.113163e+07 4.770165e+07 5.122769e+07 4.837871e+07 5.431353e+07 4.679007e+07 4.950352e+07 3.579449e+07 3.871979e+07 2.976844e+07 4.457495e+07 3.770116e+07 8.565141e+07 3.687072e+07 3.319405e+07 2.269121e+07 3.287564e+07 3.778254e+07 4.656523e+07 2.305508e+07 2.875225e+07 4.747929e+07 3.322130e+07 4.245610e+07 3.645047e+07 2.249965e+07 3.498119e+07 3.237466e+07 6.034030e+07 3.853587e+07 5.493805e+07 2.388460e+07 1.570052e+07 4.168121e+07 3.841656e+07 2.516055e+07 3.259107e+07 3.082159e+07 4.678137e+07 4.381016e+07 3.712047e+07 5.182380e+07 4.102790e+07 3.731170e+07 3.901974e+07 5.275688e+07 2.819599e+07 6.438595e+07 4.165065e+07 5.392343e+07 2.337279e+07 2.817321e+07 5.686864e+07 3.871188e+07 3.732492e+07 4.414540e+07 4.925998e+07 3.571964e+07 6.233283e+07 6.230327e+07 C3 H9 N2 O4 P_6.271 1.529231e+06 8.700125e+05 7.239241e+05 7.230586e+05 1.619861e+05 8.179656e+05 8.287724e+05 9.386709e+05 129450.97 6.590452e+05 7.723845e+05 9.725403e+05 147011.46 6.662875e+05 8.296409e+05 8.091557e+05 1.389549e+05 7.421284e+05 5.127909e+05 9.396048e+05 1.202341e+05 8.657682e+05 8.794496e+05 1.001562e+06 19938.537 5.625555e+05 8.273365e+05 4.227114e+05 2.283029e+04 1.186412e+06 5.386767e+05 9.723045e+05 99515.82 7.854159e+05 8.111616e+05 7.085725e+05 1.180441e+05 8.001433e+05 8.834119e+05 8.803992e+05 1.013916e+05 5.227655e+05 9.163880e+05 9.065861e+05 8.762765e+04 8.073769e+05 6.035121e+05 8.745146e+05 6.021551e+05 3.919479e+05 4.165107e+05 4.649165e+05 3.295360e+05 2.251781e+06 1.685122e+06 3.279536e+06 1.818224e+07 1.028553e+07 7.378988e+06 1.247295e+06 9.097535e+05 9.799889e+05 5.334108e+05 5.137694e+05 8.760425e+05 6.149905e+05 7.090345e+05 7.695925e+05 8.134787e+05 9.097193e+05 1.230360e+06 2.443343e+05 4.560022e+05 1.982331e+05 1.067489e+06 7.951935e+05 7.106128e+05 8.440861e+05 1.034057e+06 5.354618e+05 1.042505e+06 9.962086e+05 5.255907e+05 6.447435e+05 2.967137e+05 4.665241e+05 2.839635e+05 4.769856e+05 5.952316e+05 6.084451e+05 8.749931e+05 3.511755e+05 1.047279e+06 5.314588e+05 3.346832e+05 2.816062e+05 8.333886e+05 5.973034e+05 2.753043e+05 5.100812e+05 6.713652e+05 3.280471e+05 5.072352e+05 5.002592e+05 3.693083e+05 6.665048e+05 2.354910e+05 7.263910e+05 5.537854e+05 4.124029e+05 4.381276e+05 1.250712e+06 6.981927e+05 6.903784e+05 2.651736e+05 3.259017e+05 9.951647e+05 3.300067e+05 8.507539e+05 9.006524e+05 1.756858e+05 4.335969e+05 4.512841e+05 3.682613e+05 2.205483e+05 7.051224e+05 4.534286e+05 2.004730e+05 8.198645e+05 1.052501e+06 1.034268e+06 5.313381e+05 6.654477e+05 3.774775e+05 5.708316e+05 9.837270e+05 4.741097e+05 7.733795e+05 4.303445e+05 6.788096e+05 4.621976e+05 1.685515e+06 2.885057e+05 1.177047e+06 6.917370e+05 2.535184e+05 2.015976e+05 1.333951e+06 8.910989e+05 6.094710e+05 4.023125e+05 2.754682e+05 6.482535e+05 7.870527e+05 5.435794e+05 4.932749e+05 5.764244e+05 3.481579e+05 5.606890e+05 7.305904e+05 5.530349e+05 3.172103e+05 7.936045e+05 5.421218e+05 2.615558e+05 8.433336e+05 6.772879e+05 5.917015e+05 5.095968e+05 1.040341e+06 1.055337e+06 7.618669e+05 6.182201e+05 1.249932e+06 5.071722e+05 5.012949e+05 9.413831e+05 3.634389e+05 1.023085e+06 3.298392e+05 1.968208e+05 4.143019e+05 6.965710e+05 6.618419e+05 3.648858e+05 6.797295e+05 7.987613e+05 3.704218e+05 5.971878e+05 1.082368e+06 1.398713e+06 1.040570e+06 2.518096e+05 6.741612e+05 2.252950e+05 1.151188e+06 1.122546e+06 9.103996e+05 7.880280e+05 8.683869e+05 9.457276e+05 8.058596e+05 6.293873e+05 6.887320e+05 3.798169e+05 4.026029e+05 5.855157e+05 8.110174e+05 5.702066e+05 2.484808e+05 4.767171e+05 7.723214e+05 1.041761e+06 5.316947e+05 7.020257e+05 7.627774e+05 1.066593e+06 4.478567e+05 6.778147e+05 6.669665e+05 6.296857e+05 4.250044e+05 7.016020e+05 4.741154e+05 1.024261e+06 5.459390e+05 5.652173e+05 6.234378e+05 1.043189e+06 9.200484e+05 1.100150e+06 5.408134e+05 6.623093e+05 4.016001e+05 2.691401e+05 7.962470e+05 4.901027e+05 7.061196e+05 9.274691e+05 4.313220e+05 6.863404e+05 3.672003e+05 3.760519e+05 6.454526e+05 1.964775e+05 4.133496e+05 6.599574e+05 2.157128e+05 8.045846e+05 6.344746e+05 6.917606e+05 6.231984e+05 6.085679e+05 9.222396e+05 2.284328e+05 5.349431e+05 2.084644e+05 8.338362e+05 5.087295e+05 2.410501e+05 1.193930e+06 9.712540e+05 C8 H9 N O8 P2_6.271 5.057273e+07 1.862833e+07 2.693204e+07 1.444768e+07 6.700565e+05 2.678853e+07 2.126178e+07 2.918004e+07 401832.26 1.536217e+07 2.407886e+07 2.210924e+07 440235.58 2.045057e+07 2.465212e+07 2.100898e+07 3.957813e+05 1.634099e+07 2.101310e+07 2.395739e+07 3.224078e+05 2.153310e+07 2.348691e+07 2.150109e+07 47316.398 2.671297e+07 1.623551e+07 2.080748e+07 5.171578e+04 2.429021e+07 2.181986e+07 2.329967e+07 239117.03 2.155286e+07 1.409511e+07 2.449715e+07 3.063234e+05 2.831489e+07 2.223082e+07 2.278241e+07 3.003987e+05 1.548900e+07 2.043026e+07 2.305358e+07 2.818167e+05 2.710321e+07 1.758653e+07 2.307185e+07 2.407479e+07 2.724024e+07 2.937408e+07 2.386172e+07 3.380350e+07 1.784908e+07 3.693082e+07 1.862590e+07 2.624550e+07 2.656508e+07 2.745676e+07 2.411952e+07 3.384757e+07 2.752697e+07 3.403756e+07 2.147405e+07 2.242884e+07 1.415306e+07 1.883864e+07 2.906314e+07 1.236015e+07 2.704308e+07 2.709506e+07 1.182392e+07 3.172653e+07 1.326320e+07 2.150557e+07 2.108230e+07 2.270021e+07 2.350139e+07 3.289103e+07 2.253189e+07 2.897304e+07 2.626479e+07 1.770258e+07 1.474469e+07 1.825623e+07 2.851606e+07 1.243789e+07 1.786363e+07 2.813423e+07 2.310956e+07 1.701372e+07 1.987773e+07 2.535618e+07 1.931892e+07 1.677456e+07 9.600812e+06 2.298251e+07 2.727778e+07 1.778703e+07 2.622081e+07 1.482502e+07 1.729015e+07 2.835281e+07 2.405476e+07 1.427436e+07 2.532603e+07 1.115837e+07 1.971150e+07 2.006984e+07 2.250987e+07 9.143084e+06 2.144250e+07 1.314143e+07 1.612526e+07 1.424988e+07 2.354817e+07 1.854153e+07 2.817898e+07 1.888909e+07 2.423171e+07 1.764340e+07 2.328433e+07 1.272203e+07 1.219487e+07 1.221641e+07 2.252988e+07 1.804616e+07 2.100299e+07 2.110724e+07 3.547585e+07 3.308957e+07 1.619672e+07 1.639245e+07 1.864814e+07 2.647269e+07 1.908875e+07 1.838697e+07 1.945650e+07 1.610804e+07 2.059516e+07 2.037568e+07 1.516032e+07 1.840728e+07 2.582141e+07 2.883000e+07 1.404162e+07 1.256760e+07 2.019798e+07 1.678253e+07 1.478918e+07 9.725246e+06 1.401639e+07 2.094729e+07 3.107215e+07 1.663753e+07 1.793406e+07 2.029150e+07 1.918363e+07 2.323185e+07 2.156694e+07 1.621561e+07 1.834666e+07 2.179135e+07 2.906009e+07 2.294022e+07 2.854614e+07 3.364217e+07 2.033989e+07 2.491164e+07 2.324894e+07 2.553360e+07 2.623798e+07 2.168298e+07 3.187104e+07 2.940777e+07 2.034610e+07 2.238671e+07 2.735222e+07 2.079310e+07 1.865543e+07 1.326579e+07 2.238549e+07 2.511639e+07 2.037769e+07 1.863131e+07 1.470283e+07 2.118056e+07 1.951952e+07 1.986601e+07 2.767968e+07 2.376604e+07 1.402904e+07 5.099224e+06 2.653981e+07 1.501245e+07 2.523395e+07 2.581630e+07 2.546965e+07 1.647986e+07 1.738122e+07 3.186475e+07 2.152486e+07 2.028937e+07 2.261067e+07 2.503541e+07 2.754939e+07 2.611759e+07 2.795879e+07 2.692012e+07 1.623651e+07 1.876363e+07 1.719863e+07 2.583650e+07 1.484438e+07 3.006576e+07 1.566088e+07 2.223459e+07 1.654802e+07 2.609575e+07 1.954409e+07 2.044806e+07 2.529949e+07 1.696580e+07 1.802243e+07 2.061968e+07 1.806755e+07 2.050736e+07 1.169135e+07 2.227100e+07 2.133187e+07 3.023789e+07 1.994368e+07 1.472021e+07 1.981429e+07 1.593346e+07 2.221716e+07 1.281847e+07 1.524713e+07 2.483397e+07 1.735148e+07 3.178077e+07 2.512736e+07 1.356236e+07 3.718662e+07 1.737265e+07 2.404018e+07 2.403341e+07 2.297894e+07 1.702518e+07 2.552778e+07 2.351399e+07 2.672842e+07 1.638254e+07 2.066476e+07 2.946152e+07 2.691800e+07 1.780217e+07 2.547285e+07 2.082388e+07 2.138642e+07 2.124063e+07 2.617879e+07 C7 H7 N5 O3_6.271 4.894173e+07 2.100208e+07 2.774846e+07 2.183092e+07 2.008453e+05 4.265822e+07 2.413443e+07 3.054543e+07 144928.60 2.345306e+07 2.826133e+07 3.019190e+07 169723.64 2.620806e+07 2.656277e+07 2.925768e+07 1.671278e+05 2.552377e+07 2.649849e+07 2.905170e+07 1.605951e+05 2.428919e+07 2.973662e+07 2.983187e+07 25206.726 2.835113e+07 2.585766e+07 2.007747e+07 2.718358e+04 3.336272e+07 2.877052e+07 2.793458e+07 121342.66 2.661836e+07 2.427021e+07 2.801597e+07 1.517323e+05 2.955748e+07 2.973819e+07 2.864517e+07 1.362215e+05 2.103644e+07 2.984914e+07 2.883371e+07 1.250300e+05 2.909532e+07 2.462055e+07 2.813684e+07 2.937607e+07 2.194308e+07 2.792402e+07 4.624108e+07 3.614347e+07 2.311241e+07 5.611656e+07 1.802874e+07 3.712370e+07 3.311692e+07 2.791790e+07 4.129939e+07 5.739422e+07 4.298627e+07 3.812134e+07 2.155872e+07 2.513588e+07 1.643497e+07 2.830637e+07 3.780253e+07 1.362374e+07 3.251109e+07 2.818567e+07 1.842207e+07 3.308254e+07 2.371199e+07 2.247345e+07 1.849947e+07 3.303174e+07 3.581273e+07 5.389750e+07 2.676607e+07 3.253224e+07 3.861604e+07 2.300579e+07 2.109188e+07 2.451493e+07 2.564563e+07 1.890390e+07 2.194500e+07 3.388984e+07 2.869046e+07 2.293550e+07 1.957392e+07 3.304684e+07 1.921725e+07 1.881022e+07 1.328803e+07 2.161137e+07 3.768354e+07 1.495876e+07 3.097258e+07 2.079724e+07 3.097255e+07 3.387018e+07 2.531609e+07 1.532457e+07 2.060976e+07 1.603138e+07 2.583275e+07 2.781442e+07 2.739232e+07 9.721095e+06 2.668123e+07 2.310323e+07 1.069025e+07 1.556745e+07 1.956362e+07 2.531568e+07 3.320831e+07 1.861590e+07 3.077931e+07 1.938730e+07 2.608472e+07 1.171891e+07 1.357424e+07 1.182735e+07 2.103067e+07 2.556596e+07 2.474416e+07 3.802781e+07 5.563891e+07 4.214028e+07 2.046959e+07 2.593552e+07 2.028337e+07 2.611808e+07 2.248452e+07 2.212599e+07 3.378246e+07 3.197788e+07 2.188212e+07 2.242687e+07 2.718637e+07 1.748792e+07 2.840544e+07 2.601960e+07 1.193132e+07 1.460868e+07 1.916919e+07 1.906690e+07 1.605230e+07 1.558385e+07 1.863560e+07 2.285317e+07 4.519208e+07 1.702196e+07 1.476078e+07 2.474828e+07 1.756451e+07 2.989063e+07 3.079578e+07 2.811410e+07 3.245758e+07 4.061764e+07 2.353180e+07 1.582400e+07 3.827104e+07 3.339968e+07 3.057766e+07 3.320551e+07 2.635027e+07 4.933217e+07 3.150673e+07 2.543039e+07 4.530183e+07 3.483086e+07 2.313110e+07 3.307122e+07 3.776385e+07 4.023412e+07 2.079902e+07 1.610970e+07 1.438559e+07 2.495454e+07 3.292128e+07 2.629335e+07 2.218965e+07 3.354178e+07 2.450373e+07 3.543567e+07 4.447314e+07 2.732139e+07 1.511913e+07 1.175125e+07 2.627815e+07 1.578369e+07 3.253579e+07 5.273980e+07 3.622881e+07 2.807340e+07 2.650270e+07 4.136768e+07 3.374632e+07 2.459409e+07 3.064138e+07 1.056332e+07 2.146634e+07 2.594593e+07 2.241295e+07 3.795632e+07 1.342231e+07 1.420046e+07 3.385044e+07 3.513236e+07 2.035489e+07 4.455257e+07 2.256488e+07 2.821943e+07 1.964567e+07 3.144181e+07 2.830430e+07 2.403940e+07 2.956736e+07 2.579160e+07 2.751450e+07 3.219022e+07 1.979681e+07 1.917503e+07 1.583958e+07 3.391001e+07 2.294569e+07 5.600001e+07 2.026866e+07 2.030645e+07 2.479642e+07 1.695328e+07 2.677815e+07 1.313478e+07 1.790723e+07 1.982002e+07 1.648858e+07 4.980769e+07 3.171378e+07 1.920266e+07 4.296698e+07 2.243953e+07 2.763061e+07 3.288248e+07 2.948426e+07 3.442538e+07 2.950735e+07 2.760912e+07 4.998742e+07 1.846091e+07 2.210922e+07 2.995303e+07 2.927240e+07 2.107818e+07 3.545014e+07 3.413719e+07 2.088807e+07 4.446868e+07 2.923559e+07 611.92302_6.272 3.747068e+06 2.087525e+06 1.632431e+06 2.091159e+06 1.829016e+05 1.713518e+06 1.835864e+06 2.062764e+06 152377.57 1.534378e+06 1.964761e+06 1.993821e+06 167718.22 1.733791e+06 2.397057e+06 1.604824e+06 1.593240e+05 1.782477e+06 1.338634e+06 2.046796e+06 1.390450e+05 2.199787e+06 1.866180e+06 1.796522e+06 20439.890 1.822797e+06 1.920622e+06 1.487467e+06 1.992449e+04 2.372341e+06 1.943998e+06 1.752419e+06 90546.53 2.018932e+06 1.376895e+06 1.869264e+06 1.163146e+05 2.071307e+06 2.001964e+06 2.713862e+06 1.085633e+05 9.674997e+05 1.884141e+06 1.887388e+06 1.076729e+05 2.019235e+06 1.496887e+06 2.107782e+06 2.296701e+06 1.917332e+06 2.814189e+06 2.352557e+06 2.756688e+06 1.724677e+06 2.733562e+06 8.512824e+05 1.578247e+06 1.384990e+06 2.087315e+06 2.446192e+06 3.245861e+06 2.982846e+06 2.320582e+06 1.655069e+06 1.813061e+06 1.070631e+06 2.061877e+06 2.591635e+06 2.037805e+06 2.485277e+06 2.282363e+06 1.515662e+06 2.611470e+06 2.049662e+06 3.210086e+06 1.643548e+06 2.516545e+06 2.684185e+06 3.212683e+06 1.806165e+06 1.861523e+06 2.453480e+06 1.827477e+06 1.437077e+06 2.055622e+06 2.403052e+06 1.446073e+06 1.233766e+06 1.751276e+06 2.260809e+06 2.260871e+06 1.325692e+06 2.047610e+06 1.135603e+06 2.079253e+06 9.669023e+05 1.538139e+06 2.311203e+06 1.034896e+06 2.533935e+06 1.690146e+06 1.972262e+06 2.800975e+06 1.812254e+06 1.327556e+06 1.748359e+06 1.227381e+06 1.749115e+06 1.852681e+06 1.525782e+06 4.775976e+05 1.962779e+06 1.640217e+06 1.167673e+06 1.104282e+06 1.614537e+06 2.398534e+06 2.046475e+06 1.437283e+06 2.015582e+06 1.554554e+06 1.845272e+06 1.060016e+06 6.772851e+05 7.351039e+05 1.896505e+06 2.049868e+06 2.338171e+06 2.445857e+06 2.372282e+06 3.051255e+06 1.218247e+06 1.909391e+06 2.236734e+06 2.520394e+06 1.456021e+06 1.620393e+06 2.400515e+06 2.540665e+06 2.329234e+06 2.142378e+06 1.695129e+06 1.191455e+06 1.946527e+06 1.973660e+06 8.425356e+05 7.846934e+05 1.411269e+06 1.018962e+06 1.002091e+06 8.743889e+05 1.331397e+06 1.754777e+06 2.623250e+06 9.666000e+05 1.102073e+06 1.682505e+06 1.376752e+06 2.269191e+06 1.687175e+06 1.758149e+06 1.269317e+06 2.706627e+06 2.106356e+06 2.020282e+06 2.260008e+06 2.675001e+06 2.611354e+06 1.462438e+06 1.476169e+06 2.386002e+06 2.919527e+06 1.732507e+06 2.257094e+06 2.182845e+06 1.505074e+06 1.535294e+06 2.262810e+06 3.066522e+06 1.796002e+06 4.315502e+05 1.551852e+06 1.918927e+06 2.153245e+06 1.716425e+06 1.641858e+06 2.069448e+06 1.872733e+06 1.805003e+06 2.581345e+06 2.118317e+06 1.467150e+06 1.680352e+05 2.429399e+06 7.952292e+05 2.508107e+06 3.205356e+06 2.027190e+06 2.152098e+06 1.961673e+06 2.626712e+06 2.187796e+06 1.623287e+06 2.065414e+06 8.548118e+05 2.446652e+06 1.602127e+06 1.854269e+06 2.675009e+06 1.080426e+06 1.105842e+06 2.609376e+06 2.071663e+06 2.113855e+06 2.614384e+06 2.541560e+06 2.170053e+06 1.646026e+06 2.460888e+06 2.134153e+06 1.807930e+06 1.850412e+06 1.850722e+06 1.883232e+06 2.391822e+06 1.455121e+06 1.683241e+06 9.527824e+05 2.800987e+06 1.737938e+06 3.891116e+06 1.559820e+06 1.860631e+06 2.245602e+06 1.544331e+06 2.047913e+06 1.107683e+06 1.786606e+06 2.098184e+06 1.168332e+06 3.103664e+06 2.298271e+06 1.117422e+06 2.686813e+06 1.950833e+06 2.207935e+06 2.071349e+06 2.116790e+06 2.265698e+06 2.080684e+06 1.941519e+06 2.394894e+06 1.258126e+06 1.693147e+06 2.771009e+06 2.141261e+06 1.704119e+06 2.290790e+06 3.141268e+06 1.681905e+06 2.944081e+06 2.468972e+06 C10 H8 N4 O9 P2_6.272 6.509320e+07 3.007119e+07 2.509061e+07 2.918436e+07 3.510231e+05 2.673288e+07 2.913008e+07 3.634720e+07 296073.01 1.854660e+07 3.064969e+07 3.429509e+07 341189.77 2.224748e+07 2.534980e+07 2.844001e+07 3.009877e+05 2.790450e+07 2.226343e+07 3.134884e+07 2.401421e+05 2.774105e+07 3.017274e+07 3.736804e+07 37264.778 2.391763e+07 2.177579e+07 2.619278e+07 4.259788e+04 3.163533e+07 2.655074e+07 3.074319e+07 199301.87 2.826855e+07 2.046846e+07 3.062467e+07 2.566914e+05 3.151900e+07 2.976667e+07 3.309704e+07 2.408346e+05 1.988827e+07 2.696526e+07 3.155758e+07 2.194055e+05 2.747951e+07 2.248382e+07 3.206543e+07 2.998630e+07 2.648698e+07 4.008950e+07 5.460271e+07 4.467369e+07 2.692025e+07 6.149538e+07 1.282192e+07 3.084140e+07 1.944868e+07 4.679984e+07 3.548771e+07 6.996229e+07 4.891613e+07 4.174309e+07 2.752855e+07 2.922716e+07 1.685419e+07 2.326175e+07 4.163613e+07 2.031272e+07 3.403813e+07 3.172339e+07 2.070908e+07 3.806378e+07 2.357855e+07 3.331303e+07 2.241035e+07 4.026445e+07 3.517334e+07 8.267322e+07 3.189754e+07 5.569384e+07 3.966609e+07 2.440002e+07 2.113957e+07 2.052125e+07 3.959692e+07 1.816588e+07 1.813992e+07 3.812755e+07 2.993370e+07 2.731542e+07 2.063749e+07 3.155104e+07 1.548495e+07 2.661915e+07 8.483839e+06 2.298614e+07 4.799038e+07 1.394511e+07 3.550433e+07 2.040928e+07 2.670058e+07 3.795189e+07 3.021834e+07 1.688455e+07 1.911273e+07 1.430456e+07 2.580771e+07 4.337674e+07 2.869028e+07 7.728509e+06 2.821495e+07 1.855183e+07 1.391199e+07 1.341507e+07 2.270812e+07 2.863907e+07 3.457849e+07 2.510840e+07 3.090686e+07 2.032088e+07 2.856014e+07 1.057711e+07 8.680452e+06 9.432987e+06 2.354582e+07 3.383342e+07 2.580509e+07 4.657234e+07 4.661173e+07 4.802275e+07 1.915047e+07 2.560205e+07 2.720200e+07 3.601985e+07 2.036252e+07 1.906176e+07 3.610399e+07 3.251222e+07 2.604584e+07 3.610819e+07 2.231628e+07 1.721366e+07 2.953708e+07 3.152848e+07 1.198105e+07 1.268408e+07 2.182641e+07 2.090948e+07 1.356922e+07 1.085874e+07 1.782655e+07 2.225477e+07 4.800856e+07 9.705505e+06 2.062521e+07 3.117360e+07 1.643443e+07 3.015160e+07 2.978639e+07 2.211737e+07 2.654708e+07 4.049332e+07 3.321559e+07 2.133807e+07 4.533595e+07 5.476442e+07 4.195388e+07 4.238139e+07 2.402307e+07 5.764964e+07 3.412019e+07 3.558462e+07 3.726746e+07 2.659079e+07 2.761546e+07 3.794200e+07 3.714915e+07 4.516646e+07 2.453927e+07 1.151113e+07 1.589934e+07 3.029319e+07 4.051281e+07 1.991123e+07 1.824371e+07 3.923851e+07 2.438533e+07 2.997248e+07 5.457774e+07 2.897262e+07 1.465285e+07 3.619959e+06 2.721714e+07 1.419099e+07 4.859734e+07 5.861190e+07 4.185056e+07 3.601949e+07 2.714359e+07 5.308388e+07 3.336064e+07 2.626255e+07 3.082272e+07 1.761019e+07 3.468010e+07 3.145586e+07 2.390915e+07 4.153345e+07 1.605515e+07 1.891197e+07 4.210231e+07 2.580400e+07 2.043162e+07 5.463826e+07 2.169691e+07 3.087524e+07 2.188689e+07 3.289575e+07 2.249241e+07 2.997874e+07 3.420366e+07 2.542307e+07 2.832761e+07 2.601006e+07 2.305195e+07 2.089146e+07 1.603420e+07 2.797243e+07 2.882195e+07 6.835166e+07 2.417765e+07 2.832053e+07 1.828046e+07 1.906454e+07 3.044222e+07 1.760899e+07 2.039913e+07 2.882890e+07 2.132969e+07 5.357744e+07 3.380498e+07 1.583372e+07 5.575742e+07 2.274065e+07 3.308065e+07 2.614449e+07 2.603351e+07 2.797783e+07 3.418215e+07 4.503930e+07 5.102797e+07 1.826279e+07 2.698993e+07 4.284348e+07 3.348244e+07 2.538023e+07 3.981231e+07 3.682283e+07 2.391302e+07 4.917966e+07 4.305315e+07 URATE 1.202336e+09 5.590092e+08 6.148436e+08 5.811855e+08 5.911770e+05 7.009400e+08 6.711985e+08 6.719146e+08 386462.63 5.711631e+08 6.447108e+08 6.609668e+08 449565.48 6.055791e+08 6.114988e+08 6.246102e+08 4.408836e+05 5.936981e+08 5.664337e+08 6.863652e+08 4.100211e+05 5.447743e+08 7.142798e+08 7.089334e+08 65285.884 6.555047e+08 4.405630e+08 5.608488e+08 7.143183e+04 7.235905e+08 6.865498e+08 6.531359e+08 318978.40 6.035182e+08 4.400313e+08 6.562404e+08 3.832248e+05 6.952774e+08 7.179230e+08 6.721132e+08 3.420072e+05 4.815113e+08 6.153218e+08 6.845195e+08 3.178443e+05 6.410777e+08 5.577165e+08 6.506749e+08 6.682001e+08 5.150023e+08 7.331356e+08 1.076172e+09 9.152553e+08 6.095966e+08 1.180765e+09 4.543293e+08 8.134210e+08 7.578725e+08 8.225573e+08 8.406872e+08 1.212340e+09 9.952154e+08 8.774475e+08 5.281462e+08 6.107710e+08 3.995277e+08 6.632266e+08 7.575759e+08 4.476352e+08 7.587582e+08 6.471068e+08 4.418152e+08 7.566684e+08 5.603324e+08 6.637615e+08 5.523954e+08 7.575792e+08 7.187912e+08 1.182466e+09 5.772763e+08 7.771659e+08 8.342912e+08 3.719702e+08 5.077539e+08 6.084453e+08 7.143838e+08 4.628993e+08 5.566809e+08 7.368764e+08 6.589954e+08 7.429258e+08 4.576347e+08 7.660861e+08 4.731704e+08 4.867937e+08 3.529804e+08 5.238927e+08 8.045507e+08 3.876752e+08 6.709035e+08 4.661652e+08 7.321022e+08 8.446506e+08 5.896049e+08 4.557446e+08 5.494103e+08 3.799510e+08 5.362247e+08 6.996569e+08 6.248288e+08 2.399902e+08 6.121532e+08 5.501804e+08 3.753521e+08 3.455130e+08 5.123241e+08 6.395479e+08 7.550071e+08 5.684660e+08 6.746725e+08 4.366925e+08 5.797063e+08 2.866234e+08 3.218103e+08 2.929480e+08 5.072177e+08 6.071924e+08 5.770236e+08 8.701675e+08 1.252779e+09 9.836840e+08 4.917304e+08 5.539453e+08 5.717306e+08 6.711560e+08 5.242254e+08 4.910298e+08 7.975418e+08 6.770523e+08 6.213711e+08 6.603266e+08 6.642352e+08 4.248877e+08 6.585414e+08 6.497728e+08 3.738107e+08 3.939307e+08 5.086618e+08 4.549321e+08 3.623441e+08 3.594769e+08 4.121872e+08 5.446580e+08 1.036676e+09 3.783831e+08 3.871710e+08 6.136845e+08 4.074105e+08 6.907502e+08 6.383216e+08 6.631222e+08 6.597901e+08 9.358890e+08 7.135769e+08 5.907990e+08 8.466092e+08 8.603945e+08 8.193357e+08 7.360206e+08 5.902453e+08 1.050362e+09 6.731325e+08 6.711790e+08 8.934346e+08 7.841892e+08 5.231609e+08 7.160242e+08 7.393848e+08 8.401922e+08 6.032320e+08 3.774948e+08 3.476366e+08 4.744670e+08 7.789278e+08 5.808557e+08 5.290063e+08 7.433097e+08 5.646665e+08 7.573936e+08 9.556160e+08 6.560603e+08 5.337890e+08 2.559276e+08 6.413566e+08 3.772799e+08 1.151535e+09 1.143266e+09 8.619791e+08 6.574674e+08 5.903087e+08 9.246040e+08 7.854476e+08 5.507333e+08 6.246813e+08 4.070605e+08 6.256533e+08 8.099785e+08 5.908425e+08 8.755609e+08 3.897044e+08 4.800089e+08 1.158285e+09 3.023750e+08 6.774943e+08 9.471843e+08 4.880019e+08 6.389079e+08 4.479158e+08 7.217598e+08 6.603028e+08 1.113450e+08 6.466321e+08 5.522113e+08 6.281986e+08 6.988955e+08 4.822940e+08 4.959765e+08 3.752536e+08 7.171345e+08 5.882924e+08 1.235460e+09 5.069160e+08 6.019141e+08 5.353644e+08 4.900103e+08 5.950914e+08 4.178023e+08 5.732126e+08 5.723304e+08 3.687239e+08 1.231026e+09 7.812455e+08 4.903434e+08 1.010051e+09 5.506534e+08 7.085336e+08 7.379070e+08 6.932867e+08 7.681581e+08 6.533059e+08 5.970060e+08 1.121801e+09 3.774127e+08 4.627035e+08 7.306783e+08 6.359734e+08 5.348412e+08 7.974376e+08 8.115711e+08 4.826857e+08 9.935154e+08 7.219482e+08 C6 H6 O8 P2_6.274 4.551836e+07 1.647481e+07 2.374146e+07 1.349373e+07 6.757424e+05 2.598824e+07 1.901358e+07 2.844749e+07 385692.01 1.280544e+07 2.303823e+07 1.992452e+07 431435.08 1.911001e+07 2.292414e+07 1.759239e+07 3.990948e+05 1.592822e+07 1.919668e+07 2.150200e+07 3.248405e+05 2.000414e+07 2.221712e+07 1.985420e+07 47360.590 2.512277e+07 1.378371e+07 1.968540e+07 5.156584e+04 2.204845e+07 1.974044e+07 2.111248e+07 236242.20 2.058122e+07 1.455441e+07 2.180941e+07 3.009639e+05 2.451445e+07 2.054302e+07 2.169216e+07 2.921531e+05 1.449580e+07 1.898023e+07 2.051404e+07 2.774282e+05 2.528811e+07 1.661351e+07 2.077761e+07 2.249289e+07 2.584663e+07 2.814261e+07 2.098002e+07 3.163692e+07 1.448676e+07 3.510668e+07 1.739748e+07 2.358800e+07 2.506679e+07 2.447451e+07 2.127441e+07 3.270338e+07 2.420947e+07 3.108688e+07 1.981131e+07 2.087720e+07 1.418918e+07 1.625649e+07 2.536151e+07 1.112568e+07 2.509492e+07 2.446860e+07 1.161697e+07 2.848798e+07 1.268569e+07 2.016162e+07 1.942124e+07 2.104837e+07 2.169314e+07 2.930727e+07 2.039341e+07 2.667655e+07 2.507983e+07 1.493065e+07 1.488548e+07 1.608847e+07 2.678484e+07 1.072543e+07 1.728877e+07 2.436496e+07 2.148865e+07 1.432163e+07 1.723187e+07 2.334703e+07 1.680915e+07 1.488387e+07 9.486862e+06 2.021904e+07 2.655511e+07 1.667891e+07 2.445230e+07 1.437485e+07 1.499815e+07 2.667995e+07 2.022827e+07 1.237438e+07 2.086866e+07 1.004898e+07 1.801357e+07 1.843038e+07 2.097269e+07 8.604405e+06 2.008869e+07 1.348229e+07 1.472494e+07 1.242064e+07 2.104095e+07 1.580957e+07 2.548416e+07 1.736643e+07 2.196872e+07 1.594081e+07 2.134589e+07 1.148409e+07 1.119813e+07 1.102181e+07 2.076979e+07 1.559850e+07 1.951520e+07 1.997948e+07 3.123738e+07 3.101435e+07 1.417400e+07 1.387164e+07 1.724633e+07 2.397073e+07 1.910875e+07 1.734618e+07 1.617358e+07 1.584409e+07 1.893977e+07 1.990738e+07 1.373715e+07 1.682498e+07 2.411864e+07 2.601921e+07 1.345670e+07 1.127032e+07 1.838346e+07 1.494027e+07 1.311402e+07 9.488835e+06 1.241827e+07 1.865179e+07 2.676328e+07 1.565598e+07 1.617695e+07 1.844399e+07 1.726910e+07 2.216304e+07 1.865657e+07 1.539535e+07 1.700701e+07 1.915652e+07 2.641540e+07 2.062886e+07 2.599472e+07 3.093360e+07 1.843095e+07 2.289832e+07 2.095140e+07 2.309326e+07 2.360358e+07 1.939933e+07 2.952032e+07 2.786181e+07 1.824367e+07 2.004088e+07 2.545850e+07 1.952688e+07 1.613921e+07 1.272358e+07 2.043075e+07 2.451706e+07 1.842731e+07 1.691592e+07 1.298503e+07 2.028783e+07 1.739634e+07 1.498758e+07 2.686478e+07 2.110153e+07 1.192328e+07 4.715953e+06 2.513061e+07 1.384711e+07 1.915008e+07 2.495906e+07 2.552524e+07 1.343676e+07 1.616232e+07 2.819112e+07 2.101576e+07 1.854519e+07 2.157046e+07 2.309013e+07 2.462168e+07 2.414944e+07 2.633268e+07 2.491688e+07 1.579560e+07 1.670162e+07 1.698559e+07 2.408977e+07 1.446442e+07 2.959459e+07 1.599601e+07 2.045165e+07 1.570024e+07 2.249865e+07 1.579428e+07 1.955678e+07 2.116006e+07 1.500283e+07 1.641485e+07 1.832430e+07 1.721032e+07 1.897623e+07 1.104862e+07 2.096044e+07 1.921365e+07 2.747694e+07 1.859364e+07 1.281555e+07 2.026344e+07 1.587487e+07 2.008079e+07 1.321368e+07 1.309605e+07 2.227109e+07 1.598624e+07 2.839487e+07 2.171166e+07 1.199770e+07 3.353546e+07 1.619133e+07 2.270979e+07 2.336651e+07 2.072361e+07 1.715672e+07 2.316664e+07 2.036396e+07 2.568517e+07 1.558158e+07 1.856948e+07 2.709200e+07 2.501636e+07 1.606486e+07 2.296604e+07 2.050721e+07 1.854512e+07 1.891822e+07 2.610269e+07 C9 H21 N8 O10 P3 S2_6.274 6.344775e+06 2.351904e+06 1.701598e+06 1.583615e+06 1.500743e+05 3.074602e+06 2.474839e+06 2.549770e+06 111010.99 1.869841e+06 2.227808e+06 2.501642e+06 126722.37 1.934158e+06 2.822874e+06 1.567531e+06 1.258266e+05 2.178778e+06 1.853811e+06 2.664538e+06 1.112631e+05 2.106651e+06 2.389532e+06 2.554750e+06 17497.414 2.123215e+06 2.257795e+06 1.371245e+06 1.928007e+04 2.684451e+06 2.357833e+06 2.447531e+06 86703.06 2.223187e+06 1.783461e+06 2.197039e+06 1.091349e+05 2.437533e+06 2.380024e+06 2.837829e+06 1.042582e+05 1.660191e+06 2.012391e+06 2.243377e+06 9.884770e+04 2.336727e+06 2.081475e+06 2.360810e+06 2.596851e+06 1.604611e+06 2.841195e+06 4.761165e+06 3.910667e+06 1.982043e+06 3.885960e+06 7.210320e+05 2.177522e+06 1.913855e+06 3.189541e+06 3.548654e+06 5.848149e+06 4.809320e+06 3.308699e+06 1.896578e+06 2.286463e+06 8.335356e+05 2.271096e+06 3.127792e+06 1.563358e+06 3.438136e+06 2.170107e+06 1.327470e+06 3.129861e+06 2.124987e+06 2.697343e+06 1.308067e+06 2.811834e+06 3.368196e+06 5.910977e+06 2.615208e+06 3.085715e+06 4.050859e+06 2.440326e+06 1.118013e+06 2.365004e+06 3.247135e+06 1.075293e+06 1.298417e+06 3.013099e+06 2.805584e+06 2.837355e+06 1.376766e+06 2.746564e+06 1.031298e+06 1.788656e+06 3.325197e+05 1.731418e+06 3.520837e+06 7.333793e+05 2.608722e+06 1.403689e+06 2.662305e+06 2.711980e+06 2.142428e+06 1.270571e+06 1.973265e+06 8.793641e+05 2.352035e+06 3.097611e+06 1.945296e+06 2.503174e+05 2.286234e+06 2.107568e+06 9.748573e+05 6.220602e+05 1.359477e+06 2.347524e+06 3.021377e+06 1.882799e+06 2.458319e+06 1.449066e+06 2.046967e+06 5.732109e+05 5.156319e+05 3.939177e+05 1.468777e+06 2.324321e+06 1.707459e+06 3.240718e+06 6.306604e+06 4.100342e+06 1.284136e+06 2.197952e+06 2.562136e+06 1.861892e+06 1.622615e+06 1.509114e+06 3.299497e+06 3.415808e+06 2.485502e+06 2.910607e+06 1.815387e+06 9.038869e+05 1.990132e+06 2.373286e+06 7.416790e+05 6.572220e+05 1.257748e+06 1.341082e+06 6.344684e+05 7.800861e+05 8.332417e+05 2.012452e+06 4.876909e+06 6.925257e+05 1.234713e+06 1.928025e+06 1.462995e+06 2.476377e+06 1.987204e+06 2.006152e+06 2.781122e+06 5.792709e+06 2.945570e+06 2.380580e+06 3.964666e+06 5.321520e+06 3.058076e+06 3.853698e+06 2.040828e+06 3.815143e+06 2.679781e+06 2.608728e+06 4.921217e+06 3.352747e+06 1.710665e+06 2.811883e+06 2.682273e+06 3.439003e+06 2.214815e+06 4.063940e+05 1.240910e+06 2.129093e+06 3.017218e+06 2.327479e+06 1.806001e+06 2.887061e+06 1.682653e+06 3.059452e+06 4.720880e+06 2.112771e+06 1.275814e+06 2.301986e+05 2.697175e+06 8.621128e+05 3.551675e+06 5.419011e+06 3.680521e+06 2.853809e+06 1.730010e+06 4.133263e+06 3.781305e+06 1.851885e+06 2.492625e+06 7.059055e+05 2.032234e+06 2.782261e+06 1.838048e+06 3.198221e+06 8.520648e+05 1.086955e+06 3.604548e+06 2.749301e+06 1.651887e+06 3.380918e+06 2.536837e+06 2.164678e+06 1.600080e+06 2.767404e+06 1.807433e+06 1.983194e+06 2.493235e+06 1.914181e+06 2.212281e+06 2.895952e+06 1.517367e+06 1.604518e+06 8.093166e+05 3.046298e+06 2.228355e+06 6.549696e+06 1.644075e+06 2.174528e+06 2.940648e+06 1.695801e+06 2.259226e+06 8.022503e+05 1.927109e+06 2.160235e+06 1.531002e+06 5.841457e+06 2.507972e+06 1.231213e+06 4.502518e+06 1.530284e+06 2.449179e+06 2.855960e+06 2.541729e+06 2.670934e+06 3.233060e+06 3.455552e+06 3.148019e+06 1.157356e+06 1.916756e+06 2.755964e+06 2.469636e+06 1.547058e+06 3.036960e+06 3.523818e+06 1.559294e+06 5.214868e+06 2.901744e+06 C21 H9 N3 O4 S2_6.274 2.529191e+07 1.433510e+07 9.212434e+06 1.116098e+07 4.839144e+05 8.976359e+06 1.077451e+07 1.170448e+07 320593.66 9.267540e+06 1.116112e+07 1.385569e+07 346625.76 9.001371e+06 1.139099e+07 1.004474e+07 3.151302e+05 1.114708e+07 8.625145e+06 1.345669e+07 2.807759e+05 1.050437e+07 1.126774e+07 1.117359e+07 66250.929 1.055407e+07 1.145166e+07 7.485787e+06 4.553853e+04 1.274617e+07 1.158838e+07 1.120961e+07 204686.30 1.175794e+07 9.379934e+06 1.102903e+07 2.805547e+05 1.103008e+07 1.251496e+07 1.139916e+07 2.667058e+05 7.267565e+06 1.163674e+07 1.276343e+07 2.857875e+05 1.128902e+07 8.794537e+06 1.179557e+07 1.135575e+07 1.057007e+07 1.481582e+07 1.601800e+07 1.580170e+07 8.323587e+06 1.960127e+07 5.811602e+06 1.124474e+07 8.750879e+06 1.763672e+07 1.345997e+07 2.134198e+07 1.815505e+07 1.651052e+07 9.931003e+06 1.111921e+07 5.854969e+06 1.032482e+07 1.601758e+07 6.840097e+06 1.345551e+07 1.392642e+07 8.703238e+06 1.503430e+07 1.046110e+07 1.145410e+07 8.384491e+06 1.408030e+07 1.550174e+07 2.959384e+07 7.226762e+06 1.553510e+07 1.299160e+07 9.487359e+06 8.418013e+06 8.456248e+06 1.472212e+07 5.623069e+06 6.782969e+06 1.722177e+07 1.104817e+07 8.695119e+06 9.104754e+06 1.334224e+07 7.367615e+06 8.992264e+06 3.416631e+06 9.006413e+06 1.756087e+07 4.639180e+06 1.373002e+07 8.500750e+06 1.322844e+07 1.506671e+07 1.103383e+07 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1.443913e+07 9.013303e+06 1.407267e+07 1.603580e+07 172.51351_6.276 6.305720e+07 2.951347e+07 3.301803e+07 4.009596e+07 3.133524e+05 3.504299e+07 2.565885e+07 3.152113e+07 198695.35 3.175523e+07 4.990855e+07 2.913307e+07 215445.70 2.776879e+07 3.318635e+07 3.516682e+07 2.013872e+05 3.461869e+07 2.773327e+07 3.504573e+07 1.850543e+05 3.333514e+07 3.709736e+07 3.111443e+07 28592.235 3.692175e+07 3.187968e+07 2.902596e+07 3.047856e+04 3.485293e+07 3.851954e+07 2.830128e+07 138416.99 3.465750e+07 2.904998e+07 3.590791e+07 1.768194e+05 3.605494e+07 3.840881e+07 3.522390e+07 1.675963e+05 2.442152e+07 3.147084e+07 3.855726e+07 1.646019e+05 3.332919e+07 3.260871e+07 3.304455e+07 3.557427e+07 3.419792e+07 4.237476e+07 4.857433e+07 5.247219e+07 3.606537e+07 4.776252e+07 2.875637e+07 3.960158e+07 3.064314e+07 3.180172e+07 2.063210e+07 4.214629e+07 4.173525e+07 3.720098e+07 3.268268e+07 3.349539e+07 2.536673e+07 3.234593e+07 3.868904e+07 2.541900e+07 4.035167e+07 3.654470e+07 2.753482e+07 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3.075273e+07 2.469691e+07 2.138819e+07 3.166142e+07 4.296112e+07 4.243547e+07 2.317723e+07 2.889149e+07 2.961624e+07 3.107938e+07 2.700222e+07 3.320619e+07 3.239016e+07 2.833548e+07 3.989642e+07 3.593959e+07 3.511770e+07 4.830076e+07 2.922099e+07 3.644538e+07 3.762519e+07 5.059363e+07 3.490904e+07 3.789241e+07 2.863881e+07 4.079651e+07 2.612459e+07 3.662559e+07 3.860271e+07 3.531839e+07 3.003392e+07 3.691214e+07 4.079297e+07 3.245672e+07 4.535821e+07 3.521484e+07 C6 H14 O15 P2_6.279 4.921228e+07 2.396785e+07 2.077869e+07 1.972117e+07 2.487340e+05 2.586950e+07 2.483671e+07 2.601716e+07 151655.62 2.038498e+07 2.388592e+07 2.751907e+07 173891.34 1.961944e+07 2.173045e+07 2.144487e+07 1.599575e+05 2.061532e+07 2.520604e+07 2.401487e+07 1.362116e+05 2.059996e+07 2.298355e+07 3.172851e+07 20347.184 1.919003e+07 2.156146e+07 2.062047e+07 2.280694e+04 2.404157e+07 2.284600e+07 2.539041e+07 108814.69 2.295672e+07 1.838877e+07 2.281190e+07 1.431180e+05 2.536488e+07 2.617361e+07 2.624913e+07 1.287041e+05 1.579635e+07 2.194384e+07 2.720272e+07 1.205113e+05 2.435648e+07 1.885620e+07 2.456596e+07 2.544829e+07 2.434025e+07 2.981684e+07 3.365407e+07 3.584983e+07 2.246922e+07 4.581991e+07 1.318669e+07 2.552047e+07 2.085157e+07 3.510038e+07 3.400915e+07 4.910460e+07 4.182880e+07 3.145314e+07 2.263560e+07 2.393436e+07 1.407272e+07 2.008124e+07 3.147239e+07 1.931597e+07 2.602739e+07 2.196095e+07 1.524438e+07 3.065047e+07 1.811381e+07 3.179097e+07 1.722520e+07 2.846613e+07 2.764178e+07 3.722173e+07 2.487994e+07 2.834289e+07 3.509302e+07 2.354312e+07 1.577802e+07 2.136245e+07 2.975137e+07 1.547524e+07 1.671473e+07 3.436318e+07 2.522415e+07 2.794932e+07 1.507725e+07 2.367421e+07 1.500755e+07 2.361047e+07 8.645200e+06 1.862546e+07 3.669648e+07 1.172769e+07 2.909200e+07 1.672938e+07 2.548172e+07 2.783750e+07 2.310006e+07 1.561030e+07 2.668175e+07 1.245432e+07 2.053373e+07 3.654485e+07 2.050416e+07 6.112995e+06 2.276391e+07 1.756636e+07 1.444008e+07 1.027685e+07 1.595456e+07 2.009729e+07 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1.925903e+06 113849.93 1.724364e+06 1.672717e+06 2.423858e+06 126410.29 5.104126e+05 1.856083e+06 1.593210e+06 1.264999e+05 1.400986e+06 1.378524e+06 1.891167e+06 1.109782e+05 1.616022e+06 1.927267e+06 1.542756e+06 17176.716 1.486550e+06 1.448413e+06 1.690353e+06 1.758584e+04 1.726616e+06 1.478997e+06 1.661554e+06 77892.48 1.950218e+06 1.264984e+06 1.700689e+06 1.034602e+05 1.645580e+06 1.500716e+06 1.885787e+06 9.258222e+04 1.281507e+06 1.730466e+06 1.977574e+06 8.814701e+04 1.509935e+06 1.451818e+06 1.614932e+06 1.655148e+06 1.443994e+06 2.066681e+06 2.046076e+06 2.197570e+06 1.701765e+06 3.201911e+06 8.902401e+05 1.580498e+06 1.545779e+06 2.036478e+06 2.431909e+06 3.179791e+06 2.276333e+06 2.484252e+06 1.521857e+06 1.551003e+06 1.255597e+06 1.871558e+06 2.006187e+06 1.173866e+06 1.931534e+06 2.018656e+06 1.257634e+06 2.217851e+06 1.655012e+06 2.055369e+06 1.399793e+06 1.696317e+06 2.066539e+06 2.782796e+06 1.384547e+06 2.974674e+06 2.150730e+06 1.469223e+06 1.456913e+06 1.744989e+06 1.808309e+06 1.067857e+06 1.460693e+06 2.343248e+06 2.052296e+06 1.485019e+06 1.035403e+06 1.596944e+06 1.033100e+06 1.176053e+06 6.991804e+05 1.613867e+06 2.432376e+06 1.062925e+06 1.955097e+06 1.249187e+06 1.605478e+06 2.174955e+06 9.301499e+05 1.108001e+06 1.261737e+06 6.588219e+05 1.417664e+06 2.368195e+06 1.516725e+06 5.817403e+05 1.540189e+06 1.039871e+06 1.140509e+06 1.189349e+06 1.120457e+06 1.681879e+06 1.663097e+06 1.647602e+06 1.656210e+06 1.021778e+06 1.511285e+06 7.435557e+05 5.156194e+05 6.511592e+05 1.381187e+06 1.962082e+06 1.920011e+06 1.621473e+06 2.642579e+06 2.431156e+06 1.315451e+06 1.629770e+06 1.033415e+06 1.611807e+06 1.154203e+06 1.197173e+06 1.816900e+06 1.364798e+06 1.585774e+06 1.983105e+06 1.652355e+06 1.187350e+06 8.727638e+05 1.597911e+06 5.738721e+05 6.019558e+05 1.103470e+06 1.513546e+06 7.533429e+05 1.037496e+06 7.790429e+05 1.460571e+06 2.857243e+06 9.319481e+05 1.169683e+06 1.420041e+06 1.466867e+06 1.775699e+06 1.928806e+06 1.348952e+06 1.192186e+06 2.252631e+06 1.736821e+06 1.390429e+06 2.712723e+06 2.496472e+06 2.045796e+06 1.698331e+06 1.560469e+06 2.529548e+06 2.498981e+06 1.372892e+06 2.079880e+06 2.024986e+06 8.256912e+05 1.465382e+06 1.967571e+06 2.407388e+06 1.924753e+06 7.417643e+05 1.286530e+06 1.943744e+06 1.891503e+06 1.537004e+06 1.296135e+06 1.154759e+06 1.814712e+06 2.119687e+06 3.098928e+06 1.787567e+06 3.812290e+05 2.829205e+05 1.758331e+06 1.014568e+06 2.637578e+06 2.559691e+06 2.194940e+06 1.618545e+06 1.634399e+06 1.651353e+06 2.011167e+06 1.428429e+06 1.946892e+06 9.654510e+05 2.233450e+06 2.136905e+06 2.063386e+06 2.288206e+06 1.074947e+06 1.416592e+06 1.938793e+06 1.862586e+06 1.540682e+06 2.935043e+06 1.745206e+06 1.314577e+06 1.434618e+06 2.258172e+06 1.547979e+06 1.513697e+06 1.810391e+06 1.300967e+06 1.875436e+06 2.068870e+06 1.356954e+06 1.116673e+06 7.597747e+05 2.362667e+06 2.094176e+06 2.929956e+06 1.480907e+06 1.292359e+06 1.963931e+06 9.220260e+05 1.571902e+06 1.381935e+06 1.132283e+06 2.053056e+06 1.147527e+06 2.021713e+06 1.609653e+06 1.283579e+06 2.261878e+06 1.708602e+06 1.695817e+06 1.824497e+06 1.809273e+06 1.702805e+06 1.762173e+06 2.034569e+06 2.084787e+06 1.013231e+06 1.303542e+06 1.486326e+06 2.224587e+06 1.699487e+06 1.751409e+06 3.229178e+06 1.578984e+06 2.498778e+06 2.649022e+06 C8 H9 N_6.284 1.460997e+09 1.932485e+08 2.394890e+08 2.190901e+08 3.436620e+05 7.452639e+08 6.344903e+08 9.269925e+08 153446.80 1.517414e+08 1.984708e+08 2.021398e+08 162894.21 5.040270e+08 4.947694e+08 4.512372e+08 1.300587e+05 4.156904e+08 4.000423e+08 4.593292e+08 1.065768e+05 3.515838e+08 5.043370e+08 4.805273e+08 16249.515 4.139919e+08 3.458902e+08 3.757704e+08 6.811582e+04 4.538074e+08 4.640046e+08 4.527733e+08 81372.48 3.854486e+08 3.707739e+08 4.780833e+08 1.011040e+05 4.226765e+08 4.460352e+08 4.833411e+08 9.030334e+04 3.260430e+08 4.113674e+08 4.486814e+08 7.721137e+04 3.942821e+08 4.691835e+08 4.050847e+08 4.067853e+08 4.723756e+08 3.655849e+08 6.088744e+08 6.166033e+08 8.101901e+07 7.575216e+08 5.820061e+08 5.482166e+08 6.022425e+08 1.324481e+08 6.662479e+08 5.757027e+08 6.351481e+08 5.889083e+08 4.822415e+08 4.232222e+08 3.694699e+08 4.503905e+08 2.944498e+08 3.987762e+08 7.557755e+07 5.791556e+08 4.780921e+08 6.526389e+07 2.623444e+08 2.498974e+08 4.909315e+08 5.139300e+08 3.248004e+08 9.103633e+08 3.886252e+08 6.446849e+08 7.246772e+07 3.488090e+08 5.125642e+08 2.599183e+08 8.137950e+07 4.401957e+08 2.128857e+08 4.206361e+08 4.391872e+08 1.082813e+08 6.797459e+08 3.686611e+08 6.393706e+08 2.963191e+08 4.776695e+08 4.623262e+08 4.667757e+08 2.813644e+08 6.136166e+08 4.689220e+08 4.766604e+08 3.567180e+08 6.972186e+07 9.438900e+07 1.096515e+08 4.443456e+08 9.736118e+07 4.059601e+08 3.640541e+08 6.769116e+07 3.676645e+08 4.509774e+08 3.636298e+08 5.045050e+08 8.184151e+08 4.212988e+08 4.144308e+08 4.222827e+08 1.610697e+08 3.215722e+08 4.240158e+08 2.483774e+08 2.655304e+08 3.065325e+08 3.175346e+08 4.564037e+08 3.156317e+08 6.300804e+08 7.818653e+08 5.292872e+08 6.678947e+08 2.967620e+08 3.638563e+08 3.572234e+08 3.490459e+08 4.005542e+08 3.893276e+08 3.155198e+08 4.518674e+08 3.629658e+08 4.573640e+08 4.510574e+08 6.539221e+08 6.581780e+08 3.637165e+08 4.762579e+08 5.645686e+08 6.173372e+08 3.501420e+08 4.543060e+08 4.010878e+07 4.195069e+08 4.300623e+08 8.411440e+07 5.653209e+08 4.717408e+08 5.427568e+08 4.665991e+08 6.032195e+08 3.735033e+08 4.440211e+08 3.624256e+08 2.876927e+08 3.471183e+08 4.547936e+08 4.722641e+08 4.504607e+08 4.183290e+08 4.645766e+08 4.039923e+08 2.821773e+08 4.607020e+08 4.366175e+08 3.836770e+08 4.247298e+08 5.395603e+08 4.180147e+08 5.046250e+08 4.915790e+08 2.346148e+08 3.086275e+08 3.513794e+08 1.875917e+08 2.193294e+08 3.525527e+08 4.572612e+08 4.537370e+08 6.290465e+08 4.008169e+08 3.752592e+08 5.259345e+08 1.458136e+08 3.843846e+08 2.470962e+08 1.411900e+08 6.180870e+08 4.252503e+08 4.829642e+08 3.311045e+08 8.485107e+08 3.992974e+08 3.880466e+08 1.765239e+08 1.628262e+08 7.748589e+08 5.151115e+08 4.256699e+08 5.067534e+08 1.408501e+08 4.005395e+08 6.922102e+07 4.315593e+08 9.165647e+07 3.781389e+08 3.846541e+08 2.909263e+08 6.636861e+07 1.198715e+08 5.019994e+08 7.525360e+08 7.016922e+08 1.029161e+08 3.703207e+08 3.260788e+08 8.095966e+08 4.707764e+08 3.583993e+08 3.301647e+08 6.678342e+08 4.890427e+08 1.088853e+08 3.644249e+08 6.503238e+07 4.092351e+08 3.536244e+08 8.149096e+08 5.925357e+08 3.981591e+08 6.845220e+08 5.265375e+08 4.233310e+08 2.863530e+08 7.535903e+08 5.824741e+08 3.828606e+08 5.638271e+08 3.101303e+08 5.252246e+08 5.503909e+08 5.762662e+08 4.455414e+08 6.721233e+08 6.577353e+07 8.825186e+08 3.447505e+08 6.675968e+08 4.803468e+08 5.599082e+08 4.158452e+08 4.298954e+08 2.024998e+08 PHENYLALANINE 6.334648e+09 4.887820e+08 1.127335e+09 9.727814e+08 1.171128e+06 2.837969e+09 1.555361e+09 1.836003e+09 436784.85 1.688336e+09 1.598376e+09 1.705423e+09 374828.51 1.444366e+09 1.713943e+09 1.856348e+09 4.490479e+05 6.983131e+08 1.792392e+09 1.989538e+09 4.580231e+05 3.092574e+08 2.168200e+09 2.138578e+09 108239.071 1.812655e+09 3.993590e+08 1.513187e+09 6.327820e+04 1.880093e+09 1.778588e+09 1.641260e+09 266287.24 1.455778e+09 1.368145e+09 1.637226e+09 3.271103e+05 1.555890e+09 1.621360e+09 1.716442e+09 2.865256e+05 1.102351e+09 1.592366e+09 1.926476e+09 3.165857e+05 1.686473e+09 1.989560e+09 6.985607e+08 2.040903e+09 1.629116e+09 1.909776e+09 2.210475e+09 2.234635e+09 1.828560e+09 2.841298e+09 4.447000e+09 2.675320e+09 2.946395e+09 6.925675e+08 1.888268e+09 2.095883e+09 3.023660e+09 2.219920e+09 1.599666e+09 1.531735e+09 1.788766e+09 5.370859e+08 1.138612e+09 4.975684e+08 3.670612e+08 2.157511e+09 2.246670e+09 2.440952e+09 1.233441e+09 2.522654e+09 2.182502e+09 2.312350e+09 1.638445e+09 2.947720e+09 1.339583e+09 1.850673e+09 1.646301e+09 3.207347e+08 2.056091e+09 1.291146e+09 1.345579e+09 2.097506e+09 6.535849e+08 2.054795e+09 1.983901e+09 1.798748e+09 1.878531e+09 3.663576e+08 1.739592e+09 9.230244e+08 7.665518e+08 1.673164e+09 1.745574e+09 1.361679e+09 2.038528e+09 1.591186e+09 1.720568e+09 1.578719e+09 3.036113e+08 1.080772e+09 1.382881e+09 1.693816e+09 1.328116e+09 1.643173e+09 1.311681e+09 1.184787e+09 1.641097e+09 2.042180e+09 1.266571e+09 1.342053e+09 2.892554e+09 1.801495e+09 1.550110e+09 1.629263e+09 1.442755e+09 1.207215e+09 1.613897e+09 1.003958e+09 3.648079e+08 1.193724e+09 1.155061e+09 1.404267e+09 2.228400e+09 1.735998e+09 2.031329e+09 2.309365e+09 2.233026e+09 1.514392e+09 6.612061e+08 1.549288e+09 1.620075e+09 2.279407e+09 1.700069e+09 1.337266e+09 2.161013e+09 1.328824e+09 2.047473e+09 1.567776e+09 2.873915e+09 2.275071e+09 1.480880e+09 1.778570e+09 2.234551e+09 1.761375e+09 1.317665e+09 1.144460e+09 1.367558e+09 1.824309e+09 1.580480e+09 2.024124e+09 1.727642e+09 1.882236e+09 1.454622e+09 2.113558e+09 1.644593e+09 1.445091e+09 1.309214e+09 1.686661e+09 1.851560e+09 3.738758e+08 1.635570e+09 1.702855e+09 1.760857e+09 1.520661e+09 1.693184e+09 1.079703e+09 1.495057e+09 1.664247e+09 1.965557e+09 2.371067e+09 1.351324e+09 1.743804e+09 1.480673e+09 2.414701e+09 2.067907e+09 8.154667e+08 1.825731e+09 1.284244e+09 1.402991e+09 1.455354e+09 1.383695e+09 1.596156e+09 3.210309e+09 8.091957e+08 1.479821e+09 1.499842e+09 1.479497e+09 5.583879e+08 1.475997e+09 9.266156e+08 4.275854e+08 2.549587e+09 1.861990e+09 1.838504e+09 1.584320e+09 2.370564e+09 1.780489e+09 1.518358e+09 5.233233e+08 2.237912e+09 1.602595e+09 2.216352e+09 1.432607e+09 2.291628e+09 5.314291e+08 1.507399e+09 1.427497e+09 4.239222e+08 4.320883e+08 2.665748e+09 3.684837e+08 1.404172e+09 9.929497e+08 1.879726e+09 6.434711e+08 1.849614e+09 2.186533e+09 1.530364e+09 1.573086e+09 1.581417e+09 1.268870e+09 1.711836e+09 1.383897e+09 1.562568e+09 2.322630e+09 2.093997e+09 3.843914e+08 3.129268e+08 3.973058e+08 1.275921e+09 1.260224e+09 3.848490e+09 2.205393e+09 1.090094e+09 5.259274e+08 2.385013e+09 1.236971e+09 1.266159e+09 1.947845e+09 1.747591e+09 2.117860e+09 2.467866e+09 1.156947e+09 2.233959e+09 1.875539e+09 1.394597e+09 1.716653e+09 1.831560e+09 2.039099e+09 2.801431e+09 1.445860e+09 2.125382e+08 1.672954e+09 2.136994e+09 1.488100e+09 1.813975e+09 2.621071e+09 C7 H6 O_6.294 7.806057e+06 4.064442e+06 4.190464e+06 4.101811e+06 2.604874e+05 3.554107e+06 4.180259e+06 4.709430e+06 145955.64 3.761219e+06 4.184694e+06 4.023016e+06 152139.03 3.860165e+06 4.810684e+06 4.024794e+06 1.547144e+05 3.715226e+06 3.661259e+06 3.921204e+06 1.410529e+05 3.418790e+06 4.724808e+06 5.189294e+06 29406.346 3.949333e+06 3.525696e+06 3.169828e+06 3.809066e+04 4.807598e+06 4.387923e+06 4.002629e+06 111156.67 3.852312e+06 3.485705e+06 4.489767e+06 1.375764e+05 4.233602e+06 4.420566e+06 4.447030e+06 1.203899e+05 3.191577e+06 4.110837e+06 4.387280e+06 1.088361e+05 4.141285e+06 3.467906e+06 4.455720e+06 3.730866e+06 3.367928e+06 3.924410e+06 6.074962e+06 5.202145e+06 4.065312e+06 6.561630e+06 6.316275e+06 5.600268e+06 5.782510e+06 7.243868e+06 4.468600e+06 5.690810e+06 6.871082e+06 4.880270e+06 4.573123e+06 3.999319e+06 3.582145e+06 4.088995e+06 2.793272e+06 3.381909e+06 3.634465e+06 4.678355e+06 4.615275e+06 3.912212e+06 2.107582e+06 6.437573e+06 5.051331e+06 5.020840e+06 3.240149e+06 7.416295e+06 3.670978e+06 4.798155e+06 3.294265e+06 3.768166e+06 4.662984e+06 2.759836e+06 3.542363e+06 4.545620e+06 4.344542e+06 4.091408e+06 4.281919e+06 4.492243e+06 5.123484e+06 4.105668e+06 4.770749e+06 2.866648e+06 4.852174e+06 4.122884e+06 4.374365e+06 2.659225e+06 4.894915e+06 4.072445e+06 4.614094e+06 3.435796e+06 3.425387e+06 2.918503e+06 3.696341e+06 4.072143e+06 2.873761e+06 3.763646e+06 3.477973e+06 2.930390e+06 2.950380e+06 4.586385e+06 3.512938e+06 3.352693e+06 7.850924e+06 4.018529e+06 3.975225e+06 3.877102e+06 3.854174e+06 3.066238e+06 4.852766e+06 2.502878e+06 2.234247e+06 2.804292e+06 2.955264e+06 3.498678e+06 3.379538e+06 4.616111e+06 5.416941e+06 5.478169e+06 7.604632e+06 2.776873e+06 3.708359e+06 3.646771e+06 3.142038e+06 4.500950e+06 3.598769e+06 2.747674e+06 4.672816e+06 3.334527e+06 4.052887e+06 3.879829e+06 6.780524e+06 4.613586e+06 3.804094e+06 4.835987e+06 5.546984e+06 4.212772e+06 3.390706e+06 3.069625e+06 3.966274e+06 3.650339e+06 3.879112e+06 4.343319e+06 4.054438e+06 4.784979e+06 3.844343e+06 4.620194e+06 3.918732e+06 3.648751e+06 3.514200e+06 3.671592e+06 3.958761e+06 3.362950e+06 5.532812e+06 4.591809e+06 4.426371e+06 3.990480e+06 4.303450e+06 2.971510e+06 2.607422e+06 4.790138e+06 4.067893e+06 4.456142e+06 3.466660e+06 4.393886e+06 3.597888e+06 5.124766e+06 5.506209e+06 1.930055e+06 3.071050e+06 2.660439e+06 3.852141e+06 2.861539e+06 3.187268e+06 3.180407e+06 4.496973e+06 4.502868e+06 4.063708e+06 3.757657e+06 4.183601e+06 1.344488e+06 3.495475e+06 2.219754e+06 4.843538e+06 6.703884e+06 3.795079e+06 4.460031e+06 4.416446e+06 6.567929e+06 3.879452e+06 3.781172e+06 6.038001e+06 4.102519e+06 4.861573e+06 5.247567e+06 2.183257e+06 5.622726e+06 3.593693e+06 3.751474e+06 2.872974e+06 3.905939e+06 3.493324e+06 3.875684e+06 4.189171e+06 2.908885e+06 2.903031e+06 4.075763e+06 4.550241e+06 4.906000e+06 4.504178e+06 3.252739e+06 3.661603e+06 3.114834e+06 3.399003e+06 5.001198e+06 3.197932e+06 2.963556e+06 4.410979e+06 5.067847e+06 3.293594e+06 3.555155e+06 3.370575e+06 4.111760e+06 3.003906e+06 6.128863e+06 5.918082e+06 2.528211e+06 3.615707e+06 5.046464e+06 2.911079e+06 3.977293e+06 4.930682e+06 4.056420e+06 4.090239e+06 5.434844e+06 2.962815e+06 5.067781e+06 4.568574e+06 3.951769e+06 4.714104e+06 5.024096e+06 4.040965e+06 6.636912e+06 2.900413e+06 4.323115e+06 4.837340e+06 4.250601e+06 4.076547e+06 4.948854e+06 5.985229e+06 C8 H6_6.295 9.649123e+08 3.274817e+08 4.226460e+08 3.667058e+08 8.432206e+05 5.466493e+08 5.366838e+08 8.219907e+08 467956.70 3.529135e+08 1.946280e+08 3.669694e+08 502307.36 4.831137e+08 5.011961e+08 4.661789e+08 4.737448e+05 4.361580e+08 4.284581e+08 4.873769e+08 3.898282e+05 3.728755e+08 5.418859e+08 5.131650e+08 68654.467 4.426864e+08 3.706657e+08 3.993390e+08 1.295138e+05 4.843532e+08 4.943908e+08 4.816456e+08 303551.27 4.105803e+08 3.956669e+08 5.061507e+08 3.776438e+05 4.515482e+08 4.755884e+08 5.147743e+08 3.271678e+05 3.478377e+08 4.386884e+08 4.804068e+08 2.820891e+05 4.221608e+08 4.960321e+08 4.321785e+08 4.355807e+08 4.630074e+08 3.924024e+08 6.485835e+08 6.593492e+08 3.890791e+08 7.857250e+08 6.293274e+08 5.923924e+08 6.554447e+08 6.183433e+08 6.595117e+08 6.155641e+08 6.809697e+08 5.991974e+08 5.126708e+08 4.505394e+08 3.962960e+08 4.775975e+08 3.126679e+08 4.233103e+08 3.548428e+08 4.975236e+08 5.100403e+08 3.423371e+08 2.815368e+08 4.709451e+08 5.250189e+08 5.502444e+08 3.478333e+08 9.373117e+08 4.144234e+08 5.807043e+08 3.123123e+08 3.716088e+08 5.317265e+08 2.789832e+08 2.909513e+08 4.717990e+08 3.728530e+08 4.507322e+08 4.716154e+08 3.778197e+08 6.034691e+08 3.933986e+08 5.870873e+08 3.174974e+08 5.100891e+08 4.930117e+08 4.979712e+08 2.998522e+08 6.118154e+08 4.746750e+08 5.133463e+08 3.808491e+08 2.966905e+08 2.208729e+08 2.705335e+08 4.759825e+08 2.349133e+08 4.338482e+08 3.881662e+08 2.514663e+08 3.858341e+08 4.824951e+08 3.865616e+08 4.680359e+08 6.646269e+08 4.536227e+08 4.417717e+08 4.512784e+08 1.985059e+08 3.418797e+08 4.521814e+08 2.646167e+08 2.796711e+08 3.266274e+08 3.369811e+08 4.028588e+08 3.413017e+08 5.985636e+08 7.351925e+08 5.664386e+08 7.082173e+08 3.176357e+08 3.919922e+08 3.488598e+08 3.739854e+08 4.329030e+08 4.169412e+08 3.343960e+08 4.832443e+08 3.866679e+08 4.886384e+08 4.520659e+08 6.978774e+08 5.550340e+08 3.867433e+08 5.069693e+08 6.044885e+08 5.711229e+08 3.719126e+08 4.360495e+08 6.019523e+07 4.475649e+08 4.481901e+08 3.730999e+08 4.967356e+08 5.028988e+08 4.823200e+08 5.009533e+08 5.827278e+08 4.039184e+08 4.771130e+08 3.902267e+08 3.121754e+08 3.702122e+08 4.557901e+08 5.030342e+08 4.819187e+08 4.455794e+08 4.884158e+08 3.678241e+08 3.031896e+08 4.935050e+08 4.640607e+08 4.145703e+08 3.954408e+08 5.709196e+08 4.459661e+08 5.283542e+08 5.218678e+08 2.478946e+08 3.262217e+08 3.700126e+08 2.985467e+08 2.363747e+08 3.762874e+08 3.954477e+08 4.867538e+08 5.431466e+08 4.270709e+08 4.003918e+08 4.753613e+08 1.559142e+08 4.069175e+08 2.620973e+08 5.087605e+08 6.626586e+08 4.505439e+08 5.123396e+08 3.510746e+08 8.052639e+08 4.284972e+08 4.157451e+08 6.299473e+08 3.934641e+08 7.716451e+08 5.492797e+08 3.296726e+08 5.410003e+08 2.980550e+08 4.280526e+08 2.521733e+08 4.584876e+08 2.875332e+08 4.068547e+08 4.130640e+08 3.086941e+08 2.437682e+08 1.479343e+08 5.411776e+08 6.828517e+08 6.527123e+08 2.578380e+08 3.966453e+08 3.491396e+08 7.507058e+08 5.026066e+08 3.761999e+08 3.522021e+08 5.419738e+08 5.232984e+08 1.255894e+08 3.877376e+08 2.952571e+08 4.265961e+08 3.751685e+08 6.304156e+08 6.335093e+08 3.454175e+08 5.408056e+08 5.662227e+08 3.747268e+08 3.148837e+08 6.347292e+08 5.656448e+08 4.120322e+08 5.991609e+08 3.288748e+08 5.650123e+08 5.586381e+08 5.469088e+08 4.714728e+08 6.073710e+08 5.204656e+08 7.419500e+08 3.611623e+08 5.756060e+08 5.126103e+08 5.832947e+08 4.425643e+08 4.503616e+08 5.830219e+08 trans-p-Coumaraldehyde_6.295 3.928732e+09 1.779609e+09 1.440874e+09 1.408225e+09 1.224067e+06 2.158337e+09 1.531297e+09 1.985761e+09 799394.66 1.844311e+09 1.790131e+09 1.903255e+09 806340.66 1.606218e+09 1.845798e+09 1.913035e+09 6.607970e+05 1.139747e+09 1.761310e+09 1.913401e+09 6.140855e+05 1.221189e+09 2.118344e+09 2.111771e+09 125709.786 1.790020e+09 1.207048e+09 1.550092e+09 9.550539e+04 1.951632e+09 1.916416e+09 1.808651e+09 423779.15 1.611749e+09 1.531284e+09 1.846547e+09 7.092065e+05 1.758447e+09 1.842889e+09 1.951547e+09 4.646934e+05 1.251421e+09 1.766500e+09 2.031740e+09 4.614163e+05 1.723139e+09 1.723526e+09 1.611511e+09 1.920812e+09 1.790762e+09 1.770051e+09 2.514862e+09 2.489210e+09 2.048869e+09 2.964526e+09 3.291864e+09 2.587981e+09 2.849712e+09 2.306979e+09 2.066099e+09 2.294428e+09 2.995046e+09 2.361523e+09 1.814781e+09 1.742420e+09 1.729461e+09 1.456330e+09 1.272060e+09 1.377690e+09 1.388041e+09 2.149856e+09 2.166448e+09 1.989675e+09 1.200127e+09 2.561576e+09 2.188662e+09 2.254988e+09 1.578019e+09 3.126096e+09 1.524246e+09 2.039771e+09 1.651808e+09 1.038914e+09 2.152714e+09 1.246554e+09 1.463435e+09 2.052274e+09 7.173067e+08 1.988582e+09 1.953900e+09 1.962784e+09 2.076054e+09 1.460913e+09 1.942095e+09 9.999677e+08 1.335234e+09 1.903824e+09 1.969157e+09 1.349487e+09 2.214669e+09 1.680080e+09 1.805952e+09 1.558111e+09 1.100514e+09 1.215289e+09 1.492196e+09 1.879966e+09 1.388812e+09 1.634216e+09 1.423421e+09 1.282085e+09 1.618298e+09 2.026573e+09 1.432817e+09 1.502990e+09 2.629458e+09 1.765765e+09 1.762415e+09 1.785408e+09 1.621347e+09 1.359768e+09 1.802306e+09 1.096040e+09 6.931698e+08 1.320019e+09 1.311060e+09 1.471065e+09 1.734843e+09 1.940288e+09 2.275403e+09 2.282982e+09 2.516621e+09 1.444691e+09 7.099310e+08 1.706942e+09 1.586301e+09 2.011061e+09 1.676899e+09 1.318677e+09 2.123961e+09 1.486797e+09 2.025601e+09 1.699227e+09 2.839016e+09 2.178539e+09 1.609925e+09 1.999960e+09 2.435730e+09 1.976741e+09 1.480976e+09 1.267925e+09 1.458134e+09 1.770428e+09 1.761285e+09 1.950777e+09 1.795560e+09 2.106440e+09 1.557559e+09 2.078803e+09 1.817704e+09 1.603693e+09 1.470855e+09 1.624974e+09 1.689324e+09 1.031915e+09 1.766133e+09 1.932957e+09 1.932138e+09 1.722660e+09 1.918584e+09 1.208833e+09 1.438250e+09 1.894115e+09 1.939317e+09 1.973062e+09 1.515615e+09 1.915411e+09 1.682822e+09 2.430274e+09 2.067866e+09 9.277449e+08 1.551479e+09 1.297867e+09 1.553372e+09 1.412647e+09 1.544672e+09 1.608364e+09 2.557988e+09 8.751033e+08 1.671673e+09 1.593474e+09 1.655638e+09 6.260590e+08 1.671483e+09 1.054189e+09 1.700966e+09 2.706723e+09 1.898389e+09 1.941349e+09 1.578444e+09 2.660239e+09 1.719600e+09 1.718039e+09 1.872737e+09 1.907472e+09 1.711994e+09 2.209532e+09 1.249440e+09 2.242069e+09 1.189486e+09 1.693150e+09 1.408891e+09 1.507207e+09 1.049267e+09 2.026146e+09 1.764688e+09 1.406002e+09 1.105055e+09 1.975806e+09 1.664835e+09 2.056642e+09 2.451825e+09 1.537801e+09 1.680387e+09 1.541256e+09 1.424779e+09 1.947045e+09 1.524783e+09 1.543818e+09 2.150707e+09 2.054250e+09 1.031211e+09 1.237379e+09 1.152366e+09 1.290221e+09 1.425817e+09 3.199990e+09 2.461578e+09 1.120496e+09 1.185140e+09 2.349940e+09 1.305190e+09 1.254071e+09 1.892142e+09 1.916687e+09 1.901694e+09 2.498986e+09 1.272235e+09 2.200988e+09 2.011503e+09 1.557062e+09 1.844711e+09 2.039109e+09 2.166383e+09 2.638280e+09 1.466644e+09 1.725177e+09 1.900403e+09 2.220912e+09 1.690558e+09 1.921978e+09 2.711903e+09 Indole_6.296 8.480431e+06 4.269645e+06 5.724758e+06 4.816030e+06 2.384780e+05 4.401224e+06 5.060604e+06 6.242395e+06 140186.84 3.925661e+06 4.727989e+06 6.407084e+06 144875.67 4.565310e+06 4.615365e+06 4.829606e+06 1.704673e+05 3.896627e+06 4.536589e+06 5.314165e+06 2.385278e+05 4.420631e+06 6.246141e+06 5.730432e+06 78598.171 4.476348e+06 3.989290e+06 4.607646e+06 2.288975e+04 4.688337e+06 4.745356e+06 4.625109e+06 95402.79 7.189149e+06 4.047038e+06 4.819150e+06 1.312585e+05 4.654564e+06 4.777767e+06 5.943950e+06 1.188915e+05 3.827777e+06 4.974019e+06 5.072421e+06 1.063598e+05 4.460327e+06 6.337418e+06 4.039056e+06 4.710185e+06 5.150951e+06 4.720312e+06 6.731917e+06 6.159632e+06 4.612742e+06 7.680502e+06 7.779949e+06 7.591218e+06 6.940472e+06 7.042252e+06 6.057829e+06 5.638156e+06 8.458945e+06 6.097406e+06 5.416592e+06 4.419533e+06 4.396929e+06 5.098932e+06 3.221980e+06 4.738961e+06 4.144990e+06 4.603886e+06 4.159567e+06 4.719236e+06 3.826091e+06 7.913227e+06 5.535664e+06 6.523703e+06 4.269251e+06 1.031309e+07 4.322557e+06 5.392934e+06 4.176059e+06 3.771217e+06 5.472550e+06 3.080345e+06 4.520859e+06 5.410446e+06 5.513995e+06 5.111460e+06 5.189647e+06 5.186789e+06 5.433664e+06 4.733047e+06 5.745618e+06 3.428931e+06 6.096326e+06 4.975998e+06 5.312365e+06 3.562017e+06 5.500690e+06 7.722451e+06 5.096392e+06 4.021498e+06 3.220570e+06 3.046708e+06 3.618514e+06 4.615842e+06 2.762913e+06 4.751244e+06 3.349141e+06 3.124676e+06 4.012127e+06 5.539695e+06 4.409794e+06 3.240160e+06 5.706800e+06 4.972738e+06 4.753247e+06 4.810611e+06 4.172340e+06 3.472985e+06 4.732844e+06 2.773707e+06 2.751955e+06 3.619013e+06 3.430335e+06 4.126916e+06 4.026785e+06 5.424577e+06 6.460863e+06 5.056559e+06 7.181740e+06 3.717443e+06 4.360896e+06 4.253946e+06 4.706157e+06 5.059856e+06 3.548926e+06 3.654784e+06 5.529679e+06 4.045171e+06 4.946035e+06 4.451144e+06 7.652413e+06 6.406336e+06 4.079131e+06 6.056673e+06 6.244702e+06 4.841670e+06 3.574739e+06 3.758531e+06 3.551336e+06 5.285501e+06 3.940671e+06 5.286379e+06 4.437067e+06 4.470838e+06 4.435251e+06 5.771216e+06 4.323832e+06 3.609921e+06 5.800033e+06 4.484424e+06 4.441880e+06 3.682376e+06 4.840683e+06 4.851058e+06 5.576761e+06 4.965850e+06 4.767346e+06 3.663376e+06 3.055236e+06 5.709749e+06 5.265210e+06 5.270856e+06 4.289997e+06 4.841393e+06 4.658392e+06 5.938478e+06 5.730959e+06 2.249754e+06 3.308490e+06 3.386107e+06 4.763070e+06 3.649214e+06 3.528112e+06 3.710077e+06 5.234657e+06 5.318294e+06 4.298905e+06 3.440730e+06 4.134209e+06 1.635344e+06 3.958448e+06 2.724490e+06 5.882227e+06 7.077545e+06 4.336155e+06 4.651053e+06 5.637546e+06 7.389816e+06 4.732858e+06 4.098639e+06 6.845058e+06 4.541451e+06 4.676000e+06 5.758544e+06 2.785439e+06 5.317919e+06 4.158859e+06 4.490810e+06 2.934892e+06 5.134319e+06 3.678204e+06 4.940964e+06 5.782004e+06 3.552498e+06 3.012982e+06 4.918448e+06 5.921728e+06 5.685743e+06 5.089556e+06 2.853729e+06 4.720699e+06 3.956628e+06 3.926441e+06 5.622989e+06 4.211627e+06 3.872248e+06 4.724032e+06 4.442605e+06 4.155521e+06 3.659753e+06 4.067135e+06 4.646638e+06 3.331171e+06 5.640655e+06 7.185049e+06 2.664487e+06 3.672882e+06 5.968580e+06 3.920817e+06 5.053927e+06 6.373758e+06 3.811992e+06 4.112241e+06 5.433622e+06 2.901076e+06 5.785901e+06 5.383425e+06 4.911485e+06 3.964979e+06 5.137887e+06 4.568779e+06 5.846723e+06 3.835559e+06 4.964916e+06 5.405546e+06 5.761929e+06 4.398949e+06 4.905505e+06 7.536310e+06 C9 H6 O_6.297 1.281890e+07 5.128325e+06 6.791278e+06 5.749687e+06 3.338972e+05 5.210985e+06 6.829481e+06 5.100371e+06 174457.48 6.530392e+06 4.559826e+06 6.935615e+06 154476.89 5.773416e+06 6.867758e+06 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2.041419e+06 2.933371e+06 4.389450e+06 C6 H10_6.33 1.197054e+07 1.245505e+07 9.283995e+06 5.570629e+06 2.787510e+06 1.168101e+07 1.024365e+07 1.472587e+07 2158494.81 1.358646e+07 3.743679e+06 1.143730e+07 700623.62 1.466296e+07 2.323955e+06 1.716149e+07 4.679410e+05 1.247565e+07 2.012941e+06 1.528333e+07 1.295177e+07 2.342916e+06 1.420559e+07 1.310874e+07 45672.127 1.311818e+07 4.380825e+06 1.098447e+07 1.649542e+06 1.149621e+07 1.494096e+07 1.146810e+07 233047.43 3.412068e+06 7.189127e+06 1.146241e+07 1.503134e+06 1.300222e+07 1.343733e+07 1.287546e+07 2.541386e+05 2.778959e+06 1.031817e+07 1.404550e+07 3.664272e+06 1.023423e+07 9.107592e+06 1.041178e+07 5.654403e+06 6.713515e+06 5.558165e+06 4.494496e+06 3.837400e+06 5.119349e+06 9.675493e+06 5.869065e+06 4.124463e+07 1.076248e+07 5.300240e+06 8.549599e+06 6.296281e+06 1.875237e+07 1.218341e+07 9.230285e+06 1.089140e+07 5.314018e+06 4.457647e+06 2.760119e+07 4.635837e+07 7.282336e+06 1.468018e+07 4.149584e+07 9.622727e+06 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4.587042e+06 8.747517e+06 4.425247e+06 4.324217e+06 6.035748e+06 7.063271e+06 1.056428e+07 2.897958e+06 8.708386e+06 2.303122e+07 1.021029e+07 6.598270e+06 1.379746e+07 4.597327e+06 1.277251e+07 6.837863e+06 1.064581e+06 5.626306e+06 7.939216e+06 5.299105e+06 5.990018e+06 5.582242e+06 1.290626e+07 1.140832e+07 3.211042e+06 9.435531e+06 4.048885e+06 7.619531e+06 5.380678e+06 5.907787e+06 7.346488e+06 3.388807e+06 2.724234e+06 3.802312e+06 6.916814e+06 C13 H25 O P S_6.332 1.065007e+07 4.471763e+06 6.527559e+06 4.344435e+06 3.383079e+05 5.094811e+06 5.825429e+06 6.198812e+06 217916.76 6.049125e+06 4.568124e+06 6.728968e+06 210275.63 4.059383e+06 5.005839e+06 5.721805e+06 2.179601e+05 5.039247e+06 5.009723e+06 5.241241e+06 1.664571e+05 4.982878e+06 6.569782e+06 6.536625e+06 22654.861 4.798185e+06 4.342911e+06 4.699865e+06 2.722263e+04 5.209863e+06 7.212222e+06 5.578396e+06 125122.76 4.334008e+06 4.983642e+06 5.437076e+06 1.668893e+05 5.809168e+06 5.481977e+06 6.165523e+06 1.485602e+05 4.501956e+06 4.765759e+06 5.810258e+06 1.355515e+05 5.427470e+06 4.968804e+06 5.743410e+06 3.396234e+06 4.577829e+06 6.739716e+06 6.877300e+06 8.820525e+06 4.669968e+06 1.095158e+07 8.508353e+06 5.045355e+06 5.246090e+06 1.316330e+07 4.468006e+06 5.670829e+06 1.068178e+07 4.480394e+06 6.500798e+06 4.877904e+06 4.029843e+06 4.248585e+06 3.833199e+06 5.906109e+06 4.408074e+06 4.339655e+06 9.138479e+06 3.327761e+06 3.926193e+06 1.185046e+07 3.705735e+06 6.029763e+06 2.836998e+06 1.673835e+07 5.773815e+06 4.399773e+06 4.136401e+06 3.846257e+06 5.515703e+06 3.169924e+06 6.392598e+06 3.256999e+06 5.897148e+06 5.973469e+06 6.134505e+06 5.755591e+06 8.550599e+06 2.242502e+06 9.493099e+06 5.308392e+06 6.155252e+06 8.235469e+06 6.416444e+06 2.459105e+06 6.331232e+06 5.188020e+06 6.670596e+06 7.394235e+06 3.263822e+06 4.514825e+06 3.707852e+06 5.232109e+06 8.575087e+06 3.304553e+06 4.282849e+06 2.898043e+06 3.288397e+06 6.159423e+06 3.485720e+06 2.841417e+06 8.414182e+06 4.405791e+06 6.284565e+06 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4.643300e+05 7.825629e+05 3.231528e+05 2.974552e+05 3.514391e+05 7.188322e+05 2.529916e+05 4.973413e+05 7.534594e+05 2.659231e+05 4.437194e+05 6.133422e+05 8.137777e+05 8.807219e+05 5.850134e+05 7.609002e+05 3.350799e+05 3.516632e+05 3.842489e+05 3.703861e+05 2.790527e+05 2.233361e+05 2.392972e+05 2.966699e+05 2.482121e+05 4.175398e+05 5.552421e+05 2.373315e+05 3.157031e+05 1.047212e+06 1.853413e+05 3.008633e+05 2.465281e+05 1.191206e+06 6.275187e+05 1.304504e+06 6.461837e+05 8.618369e+05 5.459808e+05 5.617974e+05 2.761609e+05 4.109933e+05 3.234443e+05 5.178971e+05 3.592450e+05 8.705944e+05 3.706681e+05 3.660910e+05 5.539032e+05 3.036960e+05 8.411694e+05 8.261642e+05 3.197586e+05 5.098192e+05 3.068940e+05 4.244492e+05 3.223260e+05 6.582249e+05 3.933076e+05 5.558849e+05 1.065026e+06 1.073452e+06 2.679066e+05 6.237158e+05 2.832898e+05 3.229748e+05 2.989463e+05 4.202211e+05 5.908346e+05 2.103723e+05 3.502960e+05 7.687793e+05 4.893248e+05 2.978770e+05 1.163191e+06 4.430995e+05 3.358461e+05 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4.304868e+05 4.856835e+05 2.536725e+06 1.045716e+06 4.279786e+05 1.869406e+05 4.030221e+05 1.432000e+06 4.267820e+05 5.046909e+05 5.489935e+05 5.899924e+05 2.535686e+06 4.851010e+05 2.765448e+05 1.597554e+06 4.329514e+05 6.371200e+05 3.852274e+05 3.888911e+05 7.383187e+05 3.695182e+05 4.488735e+06 6.398791e+05 1.346685e+06 3.309585e+05 1.310919e+06 4.440803e+05 7.264723e+05 3.343229e+05 2.923939e+05 4.154040e+05 3.958774e+05 2.810646e+06 4.408225e+05 3.588442e+05 3.062497e+05 2.580377e+05 3.423340e+05 3.022414e+06 3.113438e+05 1.149938e+06 2.851969e+06 3.437769e+05 3.177961e+06 1.452773e+06 3.238045e+05 3.673646e+05 3.935254e+05 1.889469e+06 3.825858e+05 3.315504e+05 3.262235e+06 3.813436e+05 4.005140e+06 3.666236e+05 4.125538e+06 4.344778e+05 7.901258e+05 3.798262e+05 3.774047e+05 4.699625e+05 6.114076e+05 3.098924e+06 4.038115e+05 8.998532e+05 1.230967e+06 2.398849e+06 5.203154e+05 4.567141e+05 2.169736e+06 7.824729e+05 7.852036e+05 4.596816e+05 1.606876e+06 LEUCINE 3.747205e+09 1.369995e+09 2.159802e+09 3.023974e+09 7.223075e+05 1.457189e+09 2.346822e+09 2.001650e+09 484997.45 2.150401e+09 2.110605e+09 2.346378e+09 579584.79 2.151182e+09 2.421436e+09 2.735667e+09 5.566125e+05 8.346532e+08 5.235056e+08 2.184543e+09 6.905131e+05 2.488948e+09 2.799972e+09 2.701955e+09 209588.706 2.334269e+09 3.150214e+08 2.462954e+09 4.906921e+04 2.318551e+09 2.350461e+09 1.999137e+09 306992.08 1.816364e+09 1.795022e+09 2.237329e+09 3.756002e+05 2.231274e+09 2.473121e+09 2.300153e+09 2.999822e+05 1.526746e+09 1.968879e+09 2.295327e+09 2.630070e+05 1.921009e+09 2.021679e+09 2.169885e+09 1.626030e+09 1.930866e+09 1.979222e+09 3.464018e+09 3.182860e+09 3.032194e+09 5.271637e+09 4.107581e+09 2.220956e+09 2.750289e+09 2.649201e+09 2.412793e+09 2.523982e+09 4.075347e+09 4.127460e+09 1.604125e+09 1.870267e+09 1.998980e+09 2.670478e+09 1.787907e+09 3.721784e+09 2.450717e+09 1.995488e+09 3.303652e+09 2.096536e+09 6.647955e+08 2.756834e+09 2.633772e+09 1.079554e+09 8.411472e+08 4.087068e+09 3.296937e+09 2.181987e+09 4.802401e+08 1.357992e+09 3.381696e+09 1.666592e+09 1.834266e+09 1.682510e+09 4.793361e+09 1.943756e+09 2.044535e+09 2.174810e+09 2.772532e+09 1.322213e+09 3.584031e+09 1.658271e+09 3.602986e+09 3.125888e+09 2.238132e+09 1.941341e+09 2.786310e+09 3.029627e+09 3.621258e+09 2.682595e+09 7.065433e+08 1.718474e+09 1.707730e+09 6.698691e+08 2.838346e+09 2.006875e+09 1.883770e+09 1.329043e+09 1.328582e+09 2.997545e+09 1.464260e+09 1.413468e+09 3.268722e+09 2.186669e+09 2.959677e+09 1.860381e+09 2.247289e+09 1.756678e+09 2.526451e+09 4.178164e+08 1.415783e+09 1.304014e+09 1.934637e+09 1.336053e+09 1.627735e+09 2.149195e+09 2.568524e+09 3.417463e+09 2.140235e+09 1.055913e+09 2.457413e+09 2.808605e+09 1.882025e+09 1.987194e+09 3.028916e+09 3.197619e+08 4.850044e+08 2.091209e+09 2.512934e+09 4.513715e+09 5.547068e+09 2.247312e+09 1.154550e+09 1.648096e+09 3.430115e+09 2.588162e+09 1.547065e+09 1.411962e+09 2.319087e+09 2.972760e+09 1.936875e+09 2.213942e+09 2.055538e+09 8.649966e+08 1.491584e+09 3.020737e+09 1.320175e+09 2.215582e+09 1.370171e+09 5.808072e+08 2.067575e+09 1.418836e+09 2.114829e+09 2.257193e+09 2.173917e+09 2.105844e+09 1.985278e+09 2.302120e+09 1.679432e+09 2.071953e+09 2.402810e+09 1.761164e+09 5.797378e+08 2.470551e+09 2.166973e+09 1.372968e+09 2.400586e+09 1.266889e+09 1.582225e+09 2.276619e+09 1.811975e+09 1.472350e+09 1.882185e+09 1.526774e+09 3.764517e+09 2.397035e+09 1.711144e+09 1.307960e+09 2.436327e+09 6.098147e+08 2.302727e+09 1.066896e+09 2.610398e+09 4.305591e+09 2.191137e+09 2.331798e+09 2.953893e+09 1.295122e+09 3.515739e+08 1.482549e+09 2.867276e+09 2.084548e+09 2.901592e+09 2.743178e+09 7.609182e+08 2.902947e+09 1.564221e+09 6.149360e+08 1.359932e+09 8.166093e+08 1.844446e+09 1.684310e+09 2.628580e+09 1.970740e+09 1.307310e+09 3.891884e+09 2.336573e+09 2.209674e+09 2.935212e+09 2.002038e+09 1.421108e+09 3.619099e+08 1.639490e+09 1.886691e+09 1.754517e+09 2.354144e+09 6.900797e+08 3.263800e+09 1.141269e+09 1.963669e+09 2.318460e+09 2.854839e+09 1.854959e+09 3.636106e+09 2.522255e+09 2.990030e+08 1.663441e+09 3.796266e+09 1.302418e+09 1.436198e+09 2.678117e+09 3.112455e+09 1.770921e+09 1.913081e+09 1.140583e+09 3.469315e+09 2.751342e+09 1.846988e+09 2.966481e+09 7.520437e+08 4.304671e+08 2.511089e+09 2.548193e+09 2.345314e+09 1.762242e+09 3.045838e+09 1.445924e+09 2.548403e+09 4.038114e+09 Piperidine (1)_6.455 7.880382e+08 2.935876e+08 1.785286e+08 4.706861e+08 2.913058e+06 4.218001e+08 3.972098e+08 3.619024e+08 331005.29 3.531742e+08 4.138288e+08 3.781454e+08 245547.46 3.452256e+08 3.627068e+08 4.393387e+08 4.427465e+05 2.865206e+08 1.158888e+08 3.551663e+08 1.018893e+06 4.105231e+08 4.406932e+08 4.467303e+08 587114.290 3.577070e+08 2.318263e+08 3.792675e+08 2.410328e+05 3.938805e+08 3.912612e+08 3.539090e+08 253312.82 2.860620e+08 3.165616e+08 3.903322e+08 1.513334e+05 3.640860e+08 4.193787e+08 4.227656e+08 1.375572e+05 2.680347e+08 3.209897e+08 4.009509e+08 3.293442e+05 3.407451e+08 3.370232e+08 3.770316e+08 2.823611e+08 3.283713e+08 3.837880e+08 6.888763e+08 4.891352e+08 6.224106e+08 5.910926e+08 4.759422e+08 3.543109e+08 7.066851e+08 5.925913e+08 4.140783e+08 4.097217e+08 6.542224e+08 5.932261e+08 3.002196e+08 3.512226e+08 3.524094e+08 4.194679e+08 3.029958e+08 6.856740e+08 3.646850e+08 2.995097e+08 5.499691e+08 3.786683e+08 3.100212e+08 4.356073e+08 4.006175e+08 1.877889e+08 3.793150e+08 6.108857e+08 5.451265e+08 3.092218e+08 3.769595e+08 9.031518e+07 5.141833e+08 2.231852e+08 3.213881e+08 2.939257e+08 4.876934e+08 3.297493e+08 3.178154e+08 2.964112e+08 6.150587e+08 1.901661e+08 5.948969e+08 2.860565e+08 3.863600e+08 4.397983e+08 3.958687e+08 2.907089e+08 4.136845e+08 4.422995e+08 6.149328e+08 4.230669e+08 9.356812e+07 3.004931e+08 2.834705e+08 1.110268e+08 3.381733e+08 2.935728e+08 3.061391e+08 2.366277e+08 2.015423e+08 4.646848e+08 2.615180e+08 2.311414e+08 2.035958e+08 9.530724e+07 5.044961e+08 2.902661e+08 3.883856e+08 3.148288e+08 4.375630e+08 6.134921e+07 1.949007e+08 2.144417e+08 3.536941e+08 2.399740e+08 2.792690e+08 3.592261e+08 3.866019e+08 4.548172e+08 4.085553e+08 1.836492e+08 2.725231e+08 1.771311e+08 3.431206e+08 1.150384e+08 6.382822e+08 3.055247e+08 4.090651e+08 3.944375e+08 4.053108e+08 7.029656e+08 9.041809e+08 4.252052e+08 1.867025e+08 2.888344e+08 5.696144e+08 4.013403e+08 2.611769e+08 2.266664e+08 3.737647e+08 4.797389e+08 3.331616e+08 3.194616e+08 3.588782e+08 2.409345e+08 2.473030e+08 4.260045e+08 2.157178e+08 3.608869e+08 2.336742e+08 3.106397e+08 3.548623e+08 2.229569e+08 3.405311e+08 5.427637e+08 3.952241e+08 3.701780e+08 3.430697e+08 3.712646e+08 2.757854e+08 3.637726e+08 3.688115e+08 3.151808e+08 3.707623e+08 4.394785e+08 3.860795e+08 4.408714e+08 1.055051e+08 2.122527e+08 2.713547e+08 3.686209e+08 2.764368e+08 2.344186e+08 2.601497e+08 2.888248e+08 6.367953e+08 4.979043e+08 3.022276e+08 2.118368e+08 4.317224e+08 1.062479e+08 4.277432e+08 1.843562e+08 4.047474e+08 7.641429e+08 3.384871e+08 3.466342e+08 4.486862e+08 4.442792e+08 2.682855e+08 2.707358e+08 4.972649e+08 3.606409e+08 4.594143e+08 3.983641e+08 1.320359e+08 1.561360e+08 2.489096e+08 1.492370e+08 1.573820e+08 1.078310e+08 2.976487e+08 3.013228e+08 4.600958e+08 3.279614e+08 2.365305e+08 5.869142e+08 3.702970e+08 3.455735e+08 4.126819e+08 3.114837e+08 2.630458e+08 2.825161e+08 2.570241e+08 3.420861e+08 2.313061e+08 3.614998e+08 1.181934e+08 5.707631e+08 1.950029e+08 3.274684e+08 3.671421e+08 2.992485e+08 2.290255e+07 6.863952e+08 5.598030e+08 2.124042e+08 2.994873e+08 5.844242e+08 2.246012e+08 2.084826e+08 4.792766e+08 1.565126e+08 3.218061e+08 2.654764e+08 1.989910e+08 5.131546e+08 4.184256e+08 2.931704e+08 5.606034e+08 4.596595e+08 3.492789e+08 4.506259e+08 3.617716e+08 4.024140e+08 3.198409e+08 4.460664e+08 2.483768e+08 4.095298e+08 4.943171e+08 C9 H11 Cl N2 O3 S_6.456 3.290482e+07 1.975768e+07 7.780825e+06 8.922231e+06 3.121233e+05 6.430859e+06 1.127303e+07 1.671547e+07 170180.77 8.564644e+06 1.189368e+07 7.947464e+06 192878.75 1.617774e+07 8.673129e+06 1.460442e+07 2.126098e+05 7.476516e+06 9.883353e+06 9.332812e+06 1.689524e+05 1.188177e+07 1.386760e+07 1.359791e+07 28704.983 1.094202e+07 8.537799e+06 1.134114e+07 2.066864e+04 1.412455e+07 9.889704e+06 1.129618e+07 128290.86 1.006730e+07 1.001467e+07 1.385004e+07 1.526944e+05 1.037423e+07 1.155302e+07 1.076655e+07 1.261738e+05 9.448906e+06 1.392934e+07 9.865850e+06 1.089601e+05 1.262422e+07 1.114124e+07 1.089534e+07 9.339095e+06 1.055137e+07 1.274529e+07 2.164161e+07 1.932028e+07 1.556183e+07 1.765796e+07 1.514133e+07 8.418791e+06 8.308349e+06 2.290946e+07 1.249577e+07 1.271590e+07 2.233660e+07 2.157186e+07 8.339815e+06 8.938400e+06 8.895386e+06 1.397902e+07 1.294467e+07 1.323492e+07 1.010087e+07 1.181050e+07 1.094580e+07 1.341379e+07 2.973092e+06 1.049802e+07 1.134212e+07 8.546715e+06 7.414364e+06 3.456600e+07 9.877302e+06 1.415062e+07 1.381283e+07 8.572391e+06 1.859825e+07 7.734006e+06 6.234238e+06 1.083625e+07 1.206044e+07 1.149278e+07 5.291586e+06 1.161771e+07 1.286894e+07 5.237623e+06 1.488027e+07 7.263403e+06 1.036756e+07 1.409680e+07 1.318364e+07 9.122068e+06 1.500591e+07 1.637384e+07 1.993483e+07 1.442768e+07 1.427239e+07 1.018785e+07 4.752149e+06 1.313735e+07 1.064495e+07 1.047765e+07 9.987840e+06 4.194580e+06 3.936651e+06 9.399717e+06 6.620189e+06 1.041853e+07 2.261549e+07 1.241547e+07 1.493046e+07 1.055201e+07 1.461495e+07 7.051092e+06 1.233153e+07 5.445771e+06 7.450080e+06 6.488519e+06 1.129730e+07 8.251446e+06 6.960281e+06 1.642269e+07 7.244033e+06 9.898020e+06 1.369120e+07 5.527510e+06 1.246197e+07 9.079267e+06 6.745387e+06 1.014081e+07 1.257919e+07 8.448928e+06 1.213165e+07 1.215492e+07 7.662739e+06 1.910297e+07 1.792136e+07 2.208181e+07 6.820945e+06 9.492874e+06 1.809285e+07 1.477400e+07 1.122683e+07 8.939566e+06 1.452042e+07 1.650374e+07 1.190675e+07 1.249981e+07 1.794287e+07 1.020580e+07 6.693627e+06 1.183607e+07 7.458887e+06 1.184729e+07 1.129360e+07 7.605591e+06 1.156479e+07 9.535803e+06 1.478642e+07 1.768730e+07 1.066700e+07 1.341543e+07 1.473584e+07 1.151048e+07 6.039339e+06 1.044866e+07 1.007286e+07 7.833287e+06 1.779969e+07 1.197935e+07 1.540746e+07 1.174262e+07 6.557799e+06 6.912507e+06 8.906831e+06 1.232473e+07 9.963036e+06 4.008962e+06 9.274994e+06 1.125098e+07 2.054186e+07 1.235470e+07 8.717028e+06 7.849813e+06 2.102687e+07 9.087810e+06 8.860376e+06 5.454029e+06 1.619411e+07 2.564461e+07 8.550446e+06 1.280766e+07 9.508589e+06 1.762739e+07 6.940597e+06 1.001825e+07 8.089138e+06 2.004072e+07 1.440136e+07 1.349763e+07 5.863905e+06 1.739227e+07 5.701006e+06 1.444342e+07 6.492475e+06 1.262233e+07 9.171498e+06 7.855578e+06 1.547433e+07 8.432604e+06 8.373692e+06 1.752916e+07 8.125179e+06 1.099971e+07 1.423757e+07 3.222363e+06 5.912797e+06 9.549607e+06 8.462611e+06 8.666538e+06 5.897679e+06 1.205807e+07 1.519718e+07 1.174580e+07 5.345731e+06 1.067683e+07 1.317602e+07 9.000122e+06 1.205438e+07 2.944106e+07 1.543737e+07 7.138480e+06 1.080951e+07 1.419820e+07 4.360608e+06 6.950091e+06 1.507196e+07 3.695408e+07 7.802553e+06 1.312879e+07 5.345844e+06 1.259535e+07 1.558141e+07 7.900175e+06 1.375703e+07 1.634716e+07 1.312141e+07 1.592338e+07 1.375145e+07 1.637566e+07 9.036790e+06 1.229774e+07 1.182754e+07 9.918924e+06 1.979759e+07 O-ACETYLCARNITINE 1.145156e+09 4.432962e+08 1.121600e+08 1.677693e+08 4.113208e+05 4.710636e+08 5.781713e+08 3.992515e+08 195556.32 4.007161e+08 1.312824e+08 4.128766e+08 224327.69 3.760742e+08 3.211425e+08 3.560108e+08 2.339610e+05 3.645734e+08 2.851052e+08 3.076426e+08 1.930335e+05 3.629768e+08 4.084647e+08 4.095076e+08 34453.548 3.501100e+08 3.229589e+08 4.006153e+08 2.732582e+04 4.359421e+08 1.282627e+08 2.919075e+08 164068.61 3.749469e+08 3.415228e+08 3.939381e+08 1.610474e+05 3.900161e+08 3.900837e+08 3.785404e+08 1.394992e+05 2.793764e+08 3.094141e+08 3.920513e+08 1.313732e+05 3.716323e+08 3.354191e+08 3.479957e+08 2.916531e+08 3.269209e+08 3.991054e+08 3.278878e+08 4.025760e+08 5.262801e+08 3.398223e+08 4.486529e+08 5.791205e+08 2.725625e+08 3.762744e+08 4.892844e+08 7.111072e+08 4.111355e+08 6.169364e+07 3.680468e+08 5.568189e+08 5.428536e+08 3.339240e+08 3.836829e+08 3.084894e+08 3.753588e+08 4.002026e+08 1.269070e+08 3.869688e+08 1.207437e+08 2.871040e+08 4.002179e+08 4.316531e+08 6.180101e+08 4.247411e+08 2.729286e+08 3.452879e+08 2.856823e+08 2.945914e+08 3.480642e+08 2.042717e+08 1.129873e+08 2.053684e+08 3.441643e+08 2.821348e+08 1.577420e+08 3.595760e+08 2.793049e+08 5.445751e+08 2.610885e+08 2.787141e+08 3.604443e+08 2.767347e+08 3.475964e+08 2.974823e+08 1.634981e+08 2.763947e+08 3.672172e+08 2.965682e+08 3.117862e+08 1.364787e+08 6.258103e+08 4.355902e+08 1.326991e+08 2.691039e+08 4.156871e+08 2.629125e+08 2.884971e+08 4.138687e+08 2.146925e+08 3.506847e+08 2.916957e+08 3.814402e+08 4.089147e+08 4.003384e+08 2.888229e+08 1.881278e+08 4.739567e+08 2.272687e+08 3.692151e+08 3.721265e+08 2.106533e+08 3.199334e+08 3.259845e+08 3.484656e+08 2.701901e+08 4.545842e+08 1.800196e+08 3.182581e+08 2.468197e+08 3.230223e+08 2.506949e+08 3.473277e+08 2.026116e+08 1.590576e+08 3.113632e+08 2.791722e+08 5.013314e+08 3.128602e+08 3.687719e+08 5.422490e+08 4.429386e+08 4.288520e+08 4.105153e+08 4.617382e+08 1.755887e+08 2.993124e+08 3.344597e+08 1.387751e+08 3.964913e+08 3.074846e+08 1.373979e+08 6.891079e+08 2.614954e+08 4.050135e+08 4.902590e+08 2.897015e+08 3.585634e+08 2.877688e+08 4.414404e+08 3.047346e+08 4.948487e+08 4.078547e+08 3.484146e+08 2.963661e+08 4.049998e+08 3.908114e+08 5.146722e+08 2.891189e+08 3.809606e+08 2.697135e+08 4.368319e+08 2.230780e+08 4.421468e+08 2.523209e+08 2.482390e+08 3.146655e+08 3.158166e+08 1.791625e+08 1.899842e+08 1.657821e+08 2.192717e+08 4.974247e+08 2.408547e+08 2.984276e+08 4.456222e+08 5.152736e+08 3.646383e+08 1.846074e+08 3.154213e+08 2.070414e+08 2.482382e+08 3.191648e+08 4.577041e+08 1.164490e+08 5.528821e+08 4.489023e+08 2.745100e+08 3.376472e+08 3.643582e+08 1.504212e+08 2.425346e+08 4.194440e+08 1.074532e+08 3.864728e+08 4.759640e+08 4.185838e+08 1.048368e+08 4.307044e+08 4.680438e+08 3.200726e+08 3.535422e+08 1.515336e+08 2.636764e+08 3.058471e+08 2.003949e+08 4.157719e+08 1.763015e+08 3.481788e+08 3.071584e+08 1.735997e+08 4.244288e+08 3.612570e+08 2.036096e+08 3.716468e+08 5.139937e+08 4.199823e+08 9.840610e+07 3.044239e+08 2.425822e+08 7.638441e+08 4.855629e+08 4.343168e+08 3.115106e+08 5.635150e+08 4.819248e+08 2.594704e+08 6.084047e+08 2.520591e+08 2.453107e+08 1.076578e+08 4.378732e+08 3.392152e+08 5.633583e+08 4.350033e+08 2.022339e+08 3.629160e+08 5.091700e+08 8.506010e+07 4.779072e+08 4.765635e+08 5.640274e+08 1.158400e+08 4.579719e+08 3.584155e+08 3.441220e+08 2.811722e+08 1.764855e+08 C8 H16 N2 O2_6.46 8.269642e+06 3.135936e+06 2.357477e+06 2.892404e+06 3.195043e+05 3.198519e+06 3.643326e+06 3.770994e+06 180892.18 3.309851e+06 2.404289e+06 3.584975e+06 263476.68 2.554801e+06 2.758297e+06 3.134724e+06 2.232283e+05 3.102438e+06 2.827244e+06 2.432582e+06 2.294874e+05 3.318312e+06 3.801082e+06 3.121915e+06 156227.017 3.185628e+06 2.383156e+06 3.488600e+06 1.521899e+05 3.553925e+06 3.290152e+06 2.383594e+06 132759.71 2.743588e+06 2.777883e+06 3.011137e+06 1.367647e+05 3.668548e+06 3.550832e+06 2.379584e+06 1.193208e+05 2.571481e+06 3.420066e+06 3.565933e+06 1.142816e+05 3.524537e+06 2.801012e+06 2.703233e+06 2.604052e+06 2.680797e+06 2.821435e+06 4.321256e+06 7.054486e+06 4.637954e+06 4.949846e+06 5.049899e+06 3.117836e+06 3.301387e+06 5.434826e+06 2.833161e+06 3.154701e+06 5.688156e+06 5.569686e+06 1.928004e+06 4.985400e+06 3.268564e+06 2.983598e+06 2.415575e+06 3.732024e+06 3.183667e+06 2.470391e+06 3.250887e+06 3.386219e+06 3.327704e+06 3.835230e+06 3.136010e+06 3.645728e+06 2.881427e+06 7.295241e+06 4.253445e+06 2.706979e+06 2.303543e+06 2.053070e+06 3.921840e+06 1.504549e+06 3.128971e+06 2.765202e+06 4.178163e+06 3.101325e+06 1.411047e+06 3.046032e+06 4.803620e+06 1.622548e+06 5.501084e+06 1.807519e+06 2.488451e+06 4.091038e+06 3.175337e+06 2.414549e+06 3.530125e+06 3.071662e+06 4.931886e+06 3.831977e+06 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1.812468e+06 2.466153e+06 1.713047e+06 2.083775e+06 1.867047e+06 2.144603e+06 2.120166e+06 5.573117e+06 4.716312e+06 2.595611e+06 1.707291e+06 2.547539e+06 8.141039e+05 4.030695e+06 1.962202e+06 4.362552e+06 6.515266e+06 2.545420e+06 2.586205e+06 3.825043e+06 4.649050e+06 2.442912e+06 2.442751e+06 4.347542e+06 3.096909e+06 3.319786e+06 3.608538e+06 1.022649e+06 4.063497e+06 2.202435e+06 4.140547e+06 1.617515e+06 3.341058e+06 2.778952e+06 2.997717e+06 2.973764e+06 2.959183e+06 2.060665e+06 8.627717e+06 2.242270e+06 2.916522e+06 2.977817e+06 2.361443e+06 2.306056e+06 1.840445e+06 2.521253e+06 3.070037e+06 1.845431e+06 3.139957e+06 4.378881e+06 3.600827e+06 1.674443e+06 2.994689e+06 2.661768e+06 3.294453e+06 2.512556e+06 5.931454e+06 4.308893e+06 1.758821e+06 4.622948e+06 5.169237e+06 1.876345e+06 2.515908e+06 4.399294e+06 3.321985e+06 3.187042e+06 4.154093e+06 2.329569e+06 4.228771e+06 3.965388e+06 2.981042e+06 4.780633e+06 3.837379e+06 2.713350e+06 3.067175e+06 1.890724e+06 3.732398e+06 4.540590e+06 3.096071e+06 2.065881e+06 4.182074e+06 4.690286e+06 158.01781_6.466 1.012136e+07 9.477065e+06 3.480615e+07 3.133372e+07 7.172891e+05 3.919169e+07 1.784756e+07 3.767158e+07 447252.14 3.213122e+07 2.749667e+07 1.723580e+07 469296.97 2.803355e+07 3.130320e+07 3.291650e+07 4.296890e+05 2.266924e+07 3.235742e+07 2.798065e+07 3.584544e+05 1.828738e+07 3.432696e+07 3.081833e+07 60378.421 2.753732e+07 2.211172e+07 3.512173e+07 3.926008e+04 2.528616e+07 3.194899e+07 2.692123e+07 209628.38 2.082771e+07 2.613822e+07 2.674843e+07 2.421200e+05 3.763271e+07 2.671212e+07 3.411458e+07 2.413608e+05 1.742463e+07 2.867821e+07 3.066115e+07 2.444689e+05 2.801594e+07 2.536539e+07 2.942873e+07 1.756359e+07 2.106800e+06 1.649689e+07 2.495314e+06 1.644978e+07 9.536835e+07 1.834259e+07 8.960196e+07 9.168603e+07 6.542499e+07 6.028804e+06 7.973319e+07 3.428537e+07 5.989106e+06 2.374362e+06 1.326186e+06 8.057904e+07 1.815610e+06 1.503428e+07 7.328182e+06 3.654477e+07 2.144003e+07 1.218146e+07 3.248397e+06 2.335108e+06 3.491789e+06 1.495844e+07 7.947802e+07 3.940279e+07 1.276277e+08 1.223104e+07 3.542123e+06 1.229636e+07 2.124715e+06 1.476488e+06 1.774410e+06 2.000253e+07 2.350711e+07 1.049413e+07 1.190493e+07 9.804839e+06 5.424843e+05 8.697791e+06 1.138464e+07 1.731197e+08 1.234192e+06 3.709501e+06 4.769513e+06 4.588009e+06 1.068989e+07 1.157175e+07 3.133376e+06 2.067140e+07 5.008950e+06 2.967333e+06 2.536856e+07 8.809776e+06 1.614401e+06 6.863920e+06 1.457402e+06 2.073173e+06 3.584170e+06 1.356260e+07 5.459331e+07 5.414647e+07 3.168699e+07 9.695751e+06 9.642095e+06 2.087943e+06 4.955279e+06 5.213937e+07 2.853443e+06 6.157661e+06 2.546544e+06 6.306459e+07 6.151524e+07 8.588094e+07 3.764559e+06 1.247791e+08 2.733972e+06 8.651800e+06 6.130235e+07 5.650558e+06 4.376721e+07 1.026783e+08 2.987516e+07 3.765175e+06 3.990921e+06 7.583593e+07 1.435729e+07 7.430088e+07 3.706732e+07 3.103844e+06 1.574781e+08 4.954520e+06 5.356855e+07 6.002731e+06 5.665476e+07 3.299657e+07 2.775430e+07 7.246659e+07 4.177316e+07 8.668835e+07 4.089337e+06 4.877635e+06 1.370126e+07 3.916568e+07 2.059339e+06 1.334522e+08 4.481760e+07 8.797455e+06 1.006373e+08 4.117963e+07 1.132815e+07 3.566488e+07 6.002069e+07 1.883518e+07 8.909244e+06 5.749289e+06 3.375814e+07 7.499558e+06 1.120685e+07 5.948460e+07 1.727677e+08 4.120779e+07 2.820450e+07 4.182199e+06 4.655127e+06 5.410448e+07 1.488632e+06 2.156055e+07 1.749478e+07 5.209154e+07 1.401274e+07 3.435872e+06 1.777866e+07 2.150629e+06 2.264049e+06 1.309978e+08 2.001758e+06 8.294302e+05 7.227581e+07 2.939934e+07 2.903184e+07 2.010917e+06 1.596686e+07 3.202902e+07 3.423887e+06 1.051892e+06 8.668879e+06 2.007265e+07 6.108483e+07 7.749447e+06 1.558181e+07 4.703674e+07 1.965178e+07 1.895207e+07 1.532756e+07 4.055587e+06 2.204052e+07 4.972933e+05 1.416973e+08 2.410818e+07 5.987829e+07 1.232800e+07 2.698081e+07 4.987318e+06 4.428776e+07 1.096825e+07 5.070622e+05 1.340344e+07 2.419932e+06 9.846166e+07 8.821531e+06 1.325970e+07 9.581971e+06 1.719961e+06 1.389134e+06 7.994502e+07 1.929107e+07 4.439303e+07 1.401298e+07 3.702921e+06 8.686241e+07 4.737591e+07 4.525410e+06 3.892244e+05 1.643838e+07 4.870885e+07 1.597435e+07 2.859862e+07 1.019870e+08 3.065484e+06 1.697073e+08 5.787722e+06 1.057860e+08 6.827418e+06 3.147543e+07 1.781640e+07 4.284203e+06 2.798169e+07 8.953508e+06 1.037504e+08 1.131125e+06 2.253808e+07 3.109450e+07 5.825765e+07 2.316181e+07 6.126463e+05 5.126460e+07 1.505520e+07 3.245286e+07 9.361016e+06 5.663538e+07 C9 H N4 P_6.469 7.503825e+05 2.008881e+06 2.195457e+06 2.646563e+06 7.011364e+05 1.935219e+06 2.706767e+06 2.064980e+06 1406058.15 2.066672e+06 2.062417e+06 2.810123e+06 601040.60 1.361853e+06 2.166272e+06 3.075173e+06 5.002265e+05 1.486585e+06 2.222784e+06 2.125046e+06 1.455294e+06 2.217491e+06 2.583235e+06 2.139438e+06 66346.576 2.076560e+06 2.327132e+06 1.845691e+06 4.413089e+04 2.739387e+06 2.269504e+06 2.041297e+06 307543.87 1.749354e+06 2.047037e+06 2.760115e+06 5.557835e+05 2.328250e+06 2.190236e+06 2.480252e+06 2.399326e+05 1.416252e+06 2.410896e+06 2.852378e+06 3.132710e+05 1.881565e+06 2.108930e+06 2.165118e+06 5.194776e+05 6.692478e+05 6.726244e+05 5.053700e+05 1.083260e+06 5.383094e+06 1.752592e+06 5.235287e+06 5.661426e+06 3.786435e+06 9.183751e+05 6.572722e+06 2.165541e+06 5.163567e+05 8.144716e+05 4.200302e+05 5.153063e+06 4.208995e+05 6.424921e+05 4.314889e+05 3.138425e+06 1.295466e+06 2.549061e+06 5.932283e+05 4.539608e+05 4.748850e+05 9.799793e+05 6.750437e+06 3.334180e+06 7.800615e+06 7.529364e+05 4.756587e+05 9.584795e+05 5.348609e+05 3.360408e+05 6.562724e+05 7.317452e+05 9.458973e+05 1.116912e+06 1.093181e+06 5.443685e+05 4.283601e+05 5.512067e+05 8.876252e+05 1.442584e+07 1.369004e+06 3.439581e+05 6.022288e+05 4.415417e+05 6.012907e+05 4.858069e+05 6.896810e+05 8.010459e+05 5.619452e+05 1.021342e+06 1.949436e+06 5.572176e+05 4.090066e+05 6.467919e+05 4.858085e+05 4.258655e+05 4.672746e+05 8.366774e+05 3.849253e+06 4.724737e+06 2.789498e+06 5.790292e+05 8.162426e+05 4.861152e+05 4.368805e+05 4.183532e+06 4.212152e+05 5.530240e+05 4.440304e+05 4.594757e+06 5.399899e+06 6.731609e+06 4.237851e+05 9.935295e+06 4.603101e+05 6.558182e+05 4.300455e+06 5.014100e+05 2.973576e+06 6.790801e+06 2.067580e+06 7.914413e+05 4.669434e+05 5.125672e+06 1.148982e+06 4.941422e+06 3.040910e+06 3.885967e+05 1.217119e+07 8.130322e+05 4.719553e+06 6.956601e+05 4.991745e+06 2.684860e+06 2.385183e+06 5.067557e+06 3.414672e+06 8.281624e+06 6.803829e+05 1.016802e+06 1.029094e+06 3.511619e+06 1.038372e+06 6.016690e+06 3.562370e+06 4.871123e+05 9.060851e+06 4.159456e+06 7.820519e+05 1.117982e+06 4.736341e+06 1.840088e+06 2.329070e+06 4.285227e+05 2.407318e+06 5.240556e+05 4.290811e+05 6.620404e+06 9.528319e+06 2.878774e+06 2.495729e+06 5.301985e+05 7.378761e+05 4.341888e+06 4.304832e+05 5.762449e+05 1.424959e+06 3.177677e+06 7.233116e+05 1.103813e+06 2.587451e+06 7.010696e+05 1.011602e+06 9.578670e+06 4.956506e+05 1.007220e+06 5.907512e+06 2.072203e+06 1.921912e+06 2.294018e+05 1.177117e+06 2.930699e+06 7.889954e+05 7.756029e+05 4.015324e+05 1.698762e+06 4.998341e+06 7.677804e+05 9.079273e+05 2.933617e+06 9.501758e+05 1.120804e+06 1.225671e+06 4.720060e+05 1.601563e+06 8.535209e+05 8.380235e+06 1.865503e+06 2.972791e+06 4.954185e+05 1.798325e+06 3.779728e+05 2.979290e+06 6.982532e+05 3.225425e+05 6.447527e+05 6.391073e+05 6.909194e+06 1.738563e+06 1.082996e+06 3.706147e+05 3.754026e+05 1.203015e+06 5.499550e+06 1.775542e+06 3.119283e+06 6.403905e+06 4.992148e+05 5.917778e+06 3.017126e+06 9.033065e+05 4.350454e+05 1.347627e+06 3.238601e+06 6.978479e+05 8.627826e+05 1.035959e+07 5.483922e+05 1.015223e+07 3.662171e+05 8.133764e+06 6.641344e+05 2.144316e+06 1.392266e+06 4.237618e+05 2.560269e+06 2.323823e+06 7.894728e+06 4.595727e+05 3.182511e+06 2.975918e+06 4.681349e+06 1.881644e+06 1.165988e+06 4.676606e+06 1.271074e+06 2.275425e+06 4.347095e+05 3.986850e+06 C3 H11 P3_6.479 1.576523e+06 8.367527e+05 9.301524e+05 7.807772e+05 8.861787e+05 7.686501e+05 8.416693e+05 9.745087e+05 625450.14 7.939766e+05 9.326586e+05 1.221067e+06 606934.82 6.367229e+05 8.564909e+05 6.673045e+05 6.776820e+05 6.829290e+05 8.846184e+05 9.440799e+05 4.903860e+05 8.458886e+05 1.203536e+06 1.010104e+06 85438.554 8.099415e+05 8.553298e+05 1.225469e+06 6.722173e+04 6.720676e+05 9.596809e+05 9.932617e+05 362888.66 7.136839e+05 9.856273e+05 7.914638e+05 4.000385e+05 9.669448e+05 1.222490e+06 9.472786e+05 3.585424e+05 7.682285e+05 8.731649e+05 1.259992e+06 3.391662e+05 6.400146e+05 8.350540e+05 1.026373e+06 5.059204e+05 7.066776e+05 5.402217e+05 7.592771e+05 7.792967e+05 4.972703e+06 8.065529e+05 3.667713e+06 4.018878e+06 2.258621e+06 8.042704e+05 2.978622e+06 1.617840e+06 8.460996e+05 8.500429e+05 5.939252e+05 3.652610e+06 5.757562e+05 1.314822e+06 1.001747e+06 1.431268e+06 5.768601e+05 6.942858e+05 7.541012e+05 5.749021e+05 5.969513e+05 6.651479e+05 3.425028e+06 2.000370e+06 5.796077e+06 8.804752e+05 7.215088e+05 1.181445e+06 8.221335e+05 6.134519e+05 7.863131e+05 4.890884e+05 5.877314e+05 5.070403e+05 9.520281e+05 7.724887e+05 8.325159e+05 8.220011e+05 1.151059e+06 5.700960e+06 9.544807e+05 9.079165e+05 1.095064e+06 6.626058e+05 6.299000e+05 6.182303e+05 7.556892e+05 8.164380e+05 1.124233e+06 6.488212e+05 9.898667e+05 1.059752e+06 6.027166e+05 1.372778e+06 6.943684e+05 5.766650e+05 6.918790e+05 5.089113e+05 2.174955e+06 2.349349e+06 1.310239e+06 8.678801e+05 1.132591e+06 6.117619e+05 7.817957e+05 1.953622e+06 6.679070e+05 7.664272e+05 6.577302e+05 2.452247e+06 2.974706e+06 4.014563e+06 7.504958e+05 4.731368e+06 6.083894e+05 8.636259e+05 2.140317e+06 6.627922e+05 1.749466e+06 3.882290e+06 8.254419e+05 8.605214e+05 5.957619e+05 2.869098e+06 5.318016e+05 2.721960e+06 6.480477e+05 5.763093e+05 5.150727e+06 8.994127e+05 2.140601e+06 9.230274e+05 3.162180e+06 1.660687e+06 7.682109e+05 2.560199e+06 1.643319e+06 3.354224e+06 1.024692e+06 9.753811e+05 6.103686e+05 1.420563e+06 6.650988e+05 7.088406e+06 1.681071e+06 6.148194e+05 4.069405e+06 2.485627e+06 5.387991e+05 5.655793e+05 2.453693e+06 6.122416e+05 9.570974e+05 8.289108e+05 1.058453e+06 5.908431e+05 9.490617e+05 2.007162e+06 5.925147e+06 1.774330e+06 1.119583e+06 5.124069e+05 1.056807e+06 2.360088e+06 7.244646e+05 6.379770e+05 6.414133e+05 2.009943e+06 5.032402e+05 6.084867e+05 1.007441e+06 4.570214e+05 5.891647e+05 5.770529e+06 6.223530e+05 8.863169e+05 3.067807e+06 1.299357e+06 7.871508e+05 4.807972e+05 6.775339e+05 1.549114e+06 7.866381e+05 8.149294e+05 5.593727e+05 7.628563e+05 2.766917e+06 7.577125e+05 5.022386e+05 1.602905e+06 7.866117e+05 9.978591e+05 1.254218e+06 6.781000e+05 9.332975e+05 6.761792e+05 4.254839e+06 7.058115e+05 1.624824e+06 5.808873e+05 6.113622e+05 4.664467e+05 1.180397e+06 5.265452e+05 4.771139e+05 1.898004e+06 6.168733e+05 3.295700e+06 8.142075e+05 5.867696e+05 4.957010e+05 4.718926e+05 6.243448e+05 3.415560e+06 5.269130e+05 1.363691e+06 3.192324e+06 6.287393e+05 3.417951e+06 1.793884e+06 5.804701e+05 5.994578e+05 6.662360e+05 1.487119e+06 6.536188e+05 5.873838e+05 3.530091e+06 7.114416e+05 6.834452e+06 9.033907e+05 4.012285e+06 7.075703e+05 8.830957e+05 6.360234e+05 8.345089e+05 8.479476e+05 1.049282e+06 3.835177e+06 6.739318e+05 1.062528e+06 1.100805e+06 2.648241e+06 1.012107e+06 8.035424e+05 1.953377e+06 8.057801e+05 9.683868e+05 1.554653e+06 1.644646e+06 C13 H9 N4 O4 P_6.483 4.965920e+06 2.378186e+07 2.201408e+07 2.240963e+07 5.147641e+05 2.340495e+07 1.981214e+07 3.063861e+07 363866.17 2.224555e+07 2.195528e+07 2.097599e+07 357936.37 2.202535e+07 2.167048e+07 2.448351e+07 3.426501e+05 2.140055e+07 1.972432e+07 2.350034e+07 2.388361e+05 1.708048e+07 4.434353e+07 1.543746e+07 46294.471 1.582835e+07 1.990001e+07 2.866237e+07 6.074222e+04 2.583416e+07 2.397824e+07 1.363558e+07 213673.34 2.130292e+07 1.870800e+07 2.944950e+07 2.492913e+05 3.334237e+07 1.817510e+07 2.246606e+07 2.532937e+05 1.854255e+07 1.745697e+07 2.784988e+07 2.172582e+05 2.500368e+07 2.159491e+07 2.326230e+07 1.587732e+07 1.234102e+06 1.596603e+07 2.737365e+06 1.606566e+07 7.074980e+07 1.040990e+07 4.819984e+07 6.261103e+07 3.439315e+07 5.376457e+06 6.271054e+07 1.827696e+07 4.467788e+06 1.197009e+06 1.342687e+06 5.754285e+07 1.315186e+06 8.641027e+06 6.752282e+06 2.188481e+07 1.806225e+07 9.595649e+06 2.240521e+06 1.739183e+06 2.557741e+06 1.349925e+07 5.230190e+07 2.943030e+07 8.800879e+07 6.927251e+06 3.403737e+06 8.620693e+06 1.325857e+06 1.234555e+06 1.359180e+06 1.038780e+07 1.226275e+07 1.416137e+07 6.820118e+06 7.238240e+06 4.067642e+05 9.178372e+06 9.120476e+06 1.636836e+08 8.185215e+05 3.063581e+06 3.124625e+06 5.310120e+06 1.134316e+07 5.638228e+06 2.115294e+06 1.567979e+07 5.787813e+06 2.427130e+06 2.876499e+07 9.730798e+06 1.639802e+06 6.050084e+06 1.389616e+06 1.668916e+06 3.543754e+06 9.779611e+06 3.879147e+07 3.672720e+07 3.410371e+07 7.038452e+06 6.602270e+06 1.488298e+06 5.279197e+06 2.662874e+07 2.526192e+06 5.281265e+06 2.722809e+06 4.260224e+07 5.304427e+07 6.366994e+07 4.097760e+06 6.629966e+07 2.052203e+06 5.544716e+06 3.861823e+07 4.231802e+06 2.284240e+07 8.326431e+07 2.964377e+07 2.515654e+06 1.295977e+06 4.516751e+07 1.158514e+07 3.898842e+07 2.539501e+07 3.222594e+06 6.526495e+07 3.479258e+06 5.646258e+07 3.863844e+06 5.902691e+07 3.036156e+07 2.920929e+07 4.567871e+07 4.521933e+07 6.073969e+07 4.275670e+06 2.517328e+06 1.265048e+07 2.060961e+07 1.625044e+06 1.146075e+08 3.243149e+07 8.448516e+06 7.661101e+07 1.897288e+07 1.343135e+07 1.951461e+07 3.548021e+07 1.999236e+07 6.921691e+06 5.409664e+06 3.402834e+07 7.028051e+06 8.141665e+06 4.823860e+07 8.241232e+07 4.542829e+07 2.355228e+07 6.439233e+06 3.833078e+06 5.354301e+07 1.539249e+06 1.461222e+07 9.825856e+06 4.239304e+07 8.739110e+06 2.547929e+06 9.173978e+06 1.489833e+06 2.201326e+06 4.382650e+07 1.570033e+06 5.619445e+05 5.096814e+07 3.114264e+07 1.477977e+07 1.195921e+06 1.799647e+07 3.608793e+07 2.064355e+06 8.325117e+05 8.792416e+06 2.038096e+07 2.669229e+07 6.497480e+06 9.291378e+06 2.941626e+07 1.557590e+07 1.224880e+07 9.722171e+06 3.569351e+06 2.229702e+07 3.401564e+05 2.547240e+07 1.776819e+07 4.371371e+07 1.238386e+07 2.727208e+07 5.836047e+06 2.718726e+07 1.024848e+07 5.197412e+05 1.042598e+07 1.680900e+06 7.078331e+07 5.475119e+06 1.128812e+07 7.253679e+06 1.139742e+06 1.106215e+06 6.790208e+07 1.121908e+07 2.843300e+07 4.266558e+07 2.833669e+06 6.669095e+07 4.604550e+07 2.574032e+06 3.383834e+05 1.758601e+07 2.580907e+07 1.659964e+07 2.167329e+07 4.631538e+07 2.212029e+06 1.310625e+08 4.519990e+06 2.956948e+07 4.861207e+06 2.624875e+07 1.468115e+07 4.511646e+06 1.616516e+07 9.275796e+06 5.356417e+07 1.136327e+06 2.664902e+07 2.556230e+07 4.498162e+07 1.597005e+07 4.648959e+05 4.216052e+07 1.140666e+07 3.254083e+07 8.982056e+06 3.312172e+07 C21 H11 N O5_6.483 9.495846e+05 2.635210e+06 5.094191e+06 7.213093e+06 5.193774e+05 5.279283e+06 5.281321e+06 4.793034e+06 365787.48 5.117108e+06 4.684796e+06 5.410720e+06 349094.43 4.878800e+06 4.805103e+06 5.850721e+06 3.653626e+05 4.224343e+06 5.040015e+06 4.921543e+06 2.996578e+05 5.336388e+06 5.156370e+06 5.033300e+06 95584.289 5.298064e+06 3.877516e+06 5.708301e+06 4.198908e+04 5.368218e+06 5.459626e+06 5.271613e+06 216362.87 3.855889e+06 5.262108e+06 3.976698e+06 2.625794e+05 5.466489e+06 5.690426e+06 6.050918e+06 3.389236e+05 4.014419e+06 5.506924e+06 4.826673e+06 2.400176e+05 4.574259e+06 4.731810e+06 5.476469e+06 2.992424e+06 3.974553e+05 3.064055e+06 5.073766e+05 2.450972e+06 1.934563e+07 2.920933e+06 1.721758e+07 1.385053e+07 1.020594e+07 7.585277e+05 1.253327e+07 6.468584e+06 5.846729e+05 1.274611e+06 3.940998e+05 1.595600e+07 5.897024e+05 1.987542e+06 1.146271e+06 6.176266e+06 3.885601e+06 3.222722e+06 4.505580e+05 4.189162e+05 3.874471e+05 3.262157e+06 1.531158e+07 6.560662e+06 2.213021e+07 1.655939e+06 4.811936e+05 1.977180e+06 3.700968e+05 3.452071e+05 4.236546e+05 3.311233e+06 2.867748e+06 2.735381e+06 2.091040e+06 1.393351e+06 3.593204e+05 1.841251e+06 9.303459e+05 2.824288e+07 5.609235e+05 3.489884e+05 4.492578e+05 4.429737e+05 1.349114e+06 1.268283e+06 4.182964e+05 3.165306e+06 1.341024e+06 4.305519e+05 5.957051e+06 1.979042e+06 5.073830e+05 1.117938e+06 1.009687e+06 7.993299e+05 4.232323e+05 2.867663e+06 1.126529e+07 9.880045e+06 6.331769e+06 1.433199e+06 1.540682e+06 4.026321e+05 5.559158e+05 9.128579e+06 4.319560e+05 5.192562e+05 7.440889e+05 1.058748e+07 1.213486e+07 1.620442e+07 4.327829e+05 1.566856e+07 4.191033e+05 1.227758e+06 9.376705e+06 7.175148e+05 9.714228e+06 1.920764e+07 4.687599e+06 6.172796e+05 3.390204e+05 1.380885e+07 2.838773e+06 1.189006e+07 5.683651e+06 3.927850e+05 2.105148e+07 4.959706e+05 1.062992e+07 6.621663e+05 1.145085e+07 6.560621e+06 5.893321e+06 1.110562e+07 6.968594e+06 1.691715e+07 9.700870e+05 3.905866e+05 2.817412e+06 6.491138e+06 3.871190e+05 3.314670e+07 1.112427e+07 1.716554e+06 1.787835e+07 9.956496e+06 2.321433e+06 4.435122e+06 1.098377e+07 4.105860e+06 1.401351e+06 5.468857e+05 6.064692e+06 1.040280e+06 2.073496e+06 9.795848e+06 2.328986e+07 7.502414e+06 5.983477e+06 9.990869e+05 4.260305e+05 1.025681e+07 4.362418e+05 3.142401e+06 3.088947e+06 5.442288e+06 2.617645e+06 5.219370e+05 2.806164e+06 2.953351e+05 3.725016e+05 2.111472e+07 4.543412e+05 5.834711e+05 1.290476e+07 5.926162e+06 3.215649e+06 6.771514e+05 3.205050e+06 4.648196e+06 4.621996e+05 5.722159e+05 2.142630e+06 4.166017e+06 1.253906e+07 7.004563e+05 3.552454e+06 9.301361e+06 3.576217e+06 3.060624e+06 2.479873e+06 4.268048e+05 4.491617e+06 4.437242e+05 2.259713e+07 5.404239e+06 7.152372e+06 2.424064e+06 4.822517e+06 5.358450e+05 5.645360e+06 1.783113e+06 4.891752e+05 1.646660e+06 4.103756e+05 7.771382e+06 1.698235e+06 3.186041e+06 1.865238e+06 3.075155e+05 8.235522e+05 1.590028e+07 3.450627e+06 7.404426e+06 1.760638e+07 4.148753e+05 8.449303e+06 9.827731e+06 4.777462e+05 3.831256e+05 3.856055e+06 8.755095e+06 3.091441e+06 3.062198e+06 1.626104e+07 4.613328e+05 2.466205e+07 1.004822e+06 1.369589e+07 4.286192e+05 5.449734e+06 4.030304e+06 3.932018e+05 4.843225e+06 1.604191e+06 1.424844e+07 6.171886e+05 7.198968e+06 5.586058e+06 8.919254e+06 4.627229e+06 8.623182e+05 1.118313e+07 2.022774e+06 5.202986e+06 1.743131e+06 7.521097e+06 C7 H16 N4 O P2 S2_6.484 2.443693e+06 8.946498e+06 8.809764e+06 9.259367e+06 6.703552e+05 9.732997e+06 1.165033e+07 1.034828e+07 422646.79 1.061408e+07 8.173715e+06 9.785788e+06 401565.33 7.902584e+06 8.570215e+06 1.342685e+07 3.945118e+05 8.870080e+06 8.672945e+06 8.296021e+06 3.184624e+05 9.348656e+06 1.155162e+07 9.553385e+06 58839.712 1.077955e+07 7.481799e+06 9.708118e+06 4.458168e+04 1.024121e+07 1.063397e+07 9.294534e+06 217155.10 7.751619e+06 9.968432e+06 1.076574e+07 2.503699e+05 8.740839e+06 1.045979e+07 1.127858e+07 2.351993e+05 7.653232e+06 9.921254e+06 1.113546e+07 2.345857e+05 7.985120e+06 8.035316e+06 1.106975e+07 5.684917e+06 4.512615e+05 6.894750e+06 5.117070e+05 5.935273e+06 3.552903e+07 5.139651e+06 2.975798e+07 4.464937e+07 1.988143e+07 2.067809e+06 3.548934e+07 1.062015e+07 1.711121e+06 5.084368e+05 3.787404e+05 2.693327e+07 5.236417e+05 4.672963e+06 2.755447e+06 9.976954e+06 7.249075e+06 5.486542e+06 9.089496e+05 5.594578e+05 1.069004e+06 5.250720e+06 1.698762e+07 1.145949e+07 1.631862e+07 3.700936e+06 1.186224e+06 4.159523e+06 5.307951e+05 3.313640e+05 4.618475e+05 6.043826e+06 5.402988e+06 5.372353e+06 3.071639e+06 3.916573e+06 1.424249e+06 3.494921e+06 3.144976e+06 5.715915e+07 1.430426e+06 1.044612e+06 1.092080e+06 1.704905e+06 3.064210e+06 2.557078e+06 4.695050e+05 4.888768e+06 2.855082e+06 6.374855e+05 1.045112e+07 3.215794e+06 3.835417e+05 2.943540e+06 3.881487e+05 5.307850e+05 1.163109e+06 5.184800e+06 1.725601e+07 2.047537e+07 1.043367e+07 2.946351e+06 3.249236e+06 7.365394e+05 1.667042e+06 1.745354e+07 6.735842e+05 1.808655e+06 4.502329e+05 1.649115e+07 2.251870e+07 3.177866e+07 1.042555e+06 4.178798e+07 5.442953e+05 2.159560e+06 1.934930e+07 2.198550e+06 1.535874e+07 3.476793e+07 1.014898e+07 5.930575e+05 1.466337e+06 2.664242e+07 5.199713e+06 9.304151e+06 9.251666e+06 1.116284e+06 3.439266e+07 9.626545e+05 2.255356e+07 2.035327e+06 2.090110e+07 1.270238e+07 1.006904e+07 1.258857e+07 1.415660e+07 2.534361e+07 2.070632e+06 2.029118e+06 4.440135e+06 1.169202e+07 4.532898e+05 6.274426e+07 1.425833e+07 4.009490e+06 1.909747e+07 1.835557e+07 4.519751e+06 7.899462e+06 2.038511e+07 7.604403e+06 3.447256e+06 1.837282e+06 1.118219e+07 3.048934e+06 2.605206e+06 1.742456e+07 3.275022e+07 1.495024e+07 9.200299e+06 2.632286e+06 1.578691e+06 1.918709e+07 4.222342e+05 6.250855e+06 6.594108e+06 1.387423e+07 5.723506e+06 3.561369e+05 4.113842e+06 4.443531e+05 6.700916e+05 4.194115e+07 4.427783e+05 5.994644e+05 2.272960e+07 1.256994e+07 5.999169e+06 1.392925e+06 8.336906e+06 1.316392e+07 5.337228e+05 5.592752e+05 3.524366e+06 7.707930e+06 2.449383e+07 2.461776e+06 5.186287e+06 1.420024e+07 5.176696e+06 5.590089e+06 3.814324e+06 1.163012e+06 9.381898e+06 7.747243e+05 4.240985e+07 8.351808e+06 1.496552e+07 3.704151e+06 9.953737e+06 1.631929e+06 1.139231e+07 3.804542e+06 3.200095e+05 3.438763e+06 4.236491e+05 1.190477e+07 2.854671e+06 5.146785e+06 3.097461e+06 3.196962e+05 4.235522e+05 2.809402e+07 6.144970e+06 1.011221e+07 3.587354e+07 1.191774e+06 2.555580e+07 1.498161e+07 1.181088e+06 4.060604e+05 6.630931e+06 1.616620e+07 4.587622e+06 7.532159e+06 2.955169e+07 6.529841e+05 5.312769e+07 2.004735e+06 2.942775e+07 1.652901e+06 9.523225e+06 6.687203e+06 1.709158e+06 7.191535e+06 2.445323e+06 3.210266e+07 4.309255e+05 1.090958e+07 9.503532e+06 1.922184e+07 7.094032e+06 5.506506e+05 1.723688e+07 4.768316e+06 9.629217e+06 3.326868e+06 1.458034e+07 149.01257_6.487 2.157908e+06 7.051729e+06 7.881580e+06 9.240606e+06 4.654371e+05 9.067844e+06 8.526649e+06 9.498301e+06 362064.87 9.610337e+06 7.769219e+06 6.405667e+06 383588.47 1.049498e+07 7.434001e+06 8.819699e+06 3.981180e+05 7.467614e+06 7.342974e+06 8.227395e+06 2.719518e+05 7.816055e+06 1.176267e+07 9.343412e+06 47560.510 9.119324e+06 5.975535e+06 7.870008e+06 4.067190e+04 8.168483e+06 8.254680e+06 8.323968e+06 186965.46 8.865109e+06 8.907413e+06 7.862249e+06 2.126047e+05 8.840634e+06 9.011479e+06 1.019479e+07 2.019756e+05 5.946224e+06 8.880578e+06 1.040432e+07 2.048750e+05 7.352055e+06 5.969733e+06 1.015024e+07 5.394850e+06 4.440383e+05 4.938352e+06 5.038665e+05 6.022879e+06 3.016236e+07 5.492287e+06 2.888668e+07 2.490883e+07 1.442608e+07 2.109435e+06 3.007346e+07 9.695739e+06 1.367906e+06 5.171971e+05 3.226026e+05 2.558064e+07 5.319873e+05 3.454664e+06 2.195342e+06 9.306518e+06 6.649141e+06 4.942729e+06 8.080672e+05 6.545823e+05 1.042316e+06 4.841126e+06 2.663882e+07 1.127350e+07 3.539638e+07 4.463581e+06 1.153756e+06 3.565490e+06 5.978129e+05 2.821152e+05 4.707120e+05 3.970929e+06 4.061713e+06 4.208292e+06 3.396966e+06 2.625194e+06 4.609324e+05 3.362393e+06 2.293987e+06 6.591192e+07 1.270184e+06 1.030452e+06 1.216392e+06 1.471968e+06 2.830608e+06 2.639956e+06 4.699393e+05 5.130597e+06 3.911044e+06 6.890005e+05 9.561614e+06 2.889267e+06 3.242023e+05 2.621723e+06 3.545528e+05 5.392505e+05 1.389204e+06 4.066932e+06 1.664419e+07 1.749567e+07 1.020309e+07 2.494749e+06 2.384630e+06 5.981717e+05 1.670545e+06 1.553085e+07 6.562480e+05 2.001428e+06 4.457984e+05 1.601617e+07 1.111411e+07 2.496510e+07 1.013840e+06 2.080709e+07 5.663144e+05 2.381891e+06 1.597537e+07 2.195852e+06 8.925905e+06 3.555601e+07 8.035349e+06 6.819557e+05 1.561191e+06 1.849169e+07 4.062432e+06 1.884692e+07 9.054988e+06 1.019561e+06 4.414073e+07 1.111843e+06 1.736794e+07 1.939265e+06 2.094252e+07 1.200028e+07 1.059306e+07 1.632285e+07 1.058022e+07 2.492964e+07 1.873399e+06 1.318577e+06 4.741589e+06 8.205649e+06 3.784373e+05 5.792400e+07 1.019174e+07 3.621171e+06 2.941331e+07 1.267715e+07 5.310868e+06 7.280979e+06 2.207827e+07 7.017694e+06 2.915021e+06 1.769447e+06 8.778101e+06 2.712209e+06 2.552501e+06 2.365800e+07 4.059762e+07 1.360468e+07 8.665646e+06 2.318006e+06 1.462802e+06 1.793748e+07 3.607147e+05 6.345584e+06 5.463291e+06 1.382548e+07 3.818412e+06 3.529867e+05 4.647881e+06 4.171618e+05 7.085605e+05 3.143269e+07 3.999920e+05 5.097922e+05 2.166611e+07 8.592908e+06 5.919334e+06 1.049334e+06 3.956210e+06 1.053844e+07 4.718937e+05 4.856737e+05 4.707703e+06 7.837093e+06 1.882935e+07 2.268970e+06 5.458328e+06 9.503170e+06 5.374290e+06 5.598355e+06 3.576287e+06 1.186239e+06 7.642931e+06 1.062602e+06 3.544020e+07 8.110895e+06 1.685946e+07 3.259309e+06 9.161571e+06 1.304448e+06 1.010999e+07 4.040037e+06 2.756930e+05 4.008769e+06 3.456404e+05 2.092756e+07 2.347640e+06 7.299899e+06 3.065022e+06 2.606385e+05 3.867042e+05 2.797247e+07 4.626134e+06 1.002102e+07 2.738231e+07 1.029611e+06 2.685002e+07 1.222534e+07 1.204480e+06 3.652853e+05 7.031079e+06 1.094167e+07 3.528853e+06 4.831332e+06 2.098189e+07 5.608852e+05 4.804969e+07 1.832216e+06 2.820745e+07 1.859790e+06 9.381570e+06 6.437097e+06 1.696732e+06 7.653968e+06 2.530852e+06 2.336122e+07 3.886258e+05 9.544330e+06 8.364679e+06 1.710553e+07 7.355438e+06 4.561132e+05 1.337504e+07 5.923984e+06 8.636175e+06 3.338878e+06 9.840565e+06 KYNURENINE 2.524309e+07 1.317652e+07 1.466410e+07 1.510542e+07 1.967592e+05 1.561902e+07 1.595552e+07 1.650831e+07 168281.63 1.528128e+07 1.483483e+07 1.650927e+07 180868.07 1.433321e+07 1.468149e+07 1.520486e+07 1.885071e+05 1.333849e+07 1.297117e+07 1.517866e+07 1.390706e+05 1.635757e+07 1.683177e+07 1.678591e+07 19603.280 1.319572e+07 1.290598e+07 1.665457e+07 1.927296e+04 1.554868e+07 1.712716e+07 1.440133e+07 108782.80 1.210357e+07 1.519599e+07 1.414825e+07 1.311090e+05 1.636356e+07 1.677025e+07 1.761078e+07 1.220611e+05 1.117249e+07 1.425260e+07 1.692951e+07 1.133481e+05 1.459117e+07 1.372464e+07 1.607338e+07 1.465240e+07 1.771245e+07 1.700965e+07 2.966206e+07 2.461617e+07 2.201804e+07 2.415594e+07 2.536853e+07 1.993085e+07 2.716731e+07 2.834059e+07 1.919101e+07 8.110639e+06 2.135670e+07 3.050724e+07 1.132788e+07 1.741342e+07 6.669211e+06 2.209564e+07 1.059845e+07 1.371654e+07 2.037538e+07 1.639718e+07 1.259982e+07 2.257907e+07 9.025081e+06 1.576716e+07 1.498356e+07 1.201543e+07 1.556409e+07 1.766900e+07 1.029986e+07 1.854180e+07 2.016635e+07 9.212750e+06 1.590359e+07 1.383797e+07 1.716204e+07 1.197354e+07 1.196964e+07 1.815921e+07 9.514045e+06 1.715954e+07 1.050206e+07 1.318708e+07 1.175197e+07 1.341941e+07 1.220105e+07 1.929836e+07 1.937712e+07 9.450469e+06 8.871613e+06 1.279300e+07 2.396556e+07 1.434596e+07 1.147440e+07 8.956057e+06 8.780479e+06 1.020284e+07 8.252697e+06 2.080423e+07 1.738505e+07 6.888423e+06 1.729848e+07 2.181266e+07 1.463497e+07 9.288131e+06 6.210520e+06 1.916952e+07 1.045858e+07 1.266983e+07 1.569827e+07 7.109006e+06 7.297265e+06 5.814595e+06 1.043874e+07 1.194456e+07 8.289641e+06 1.005094e+07 1.143810e+07 1.777082e+07 2.054239e+07 2.642123e+07 1.686932e+07 1.076651e+07 1.443655e+07 1.638746e+07 6.227463e+06 1.258516e+07 1.506758e+07 1.147729e+07 1.476899e+07 1.297277e+07 1.509292e+07 9.002651e+06 1.163564e+07 1.439911e+07 1.532935e+07 1.429652e+07 1.507147e+07 9.389764e+06 1.106391e+07 9.616089e+06 1.123694e+07 4.446638e+06 1.682939e+07 7.913655e+06 1.485538e+07 2.046673e+07 1.240200e+07 1.411369e+07 2.002657e+07 1.572487e+07 1.942705e+07 1.389908e+07 1.778583e+07 1.983397e+07 1.765313e+07 1.687591e+07 2.634566e+07 1.326799e+07 1.285310e+07 2.842955e+07 2.491907e+07 2.458268e+07 1.955844e+07 2.233774e+07 1.679107e+07 1.840536e+07 1.620241e+07 1.710160e+07 1.461593e+07 5.779634e+06 1.394209e+07 1.139497e+07 1.530376e+07 1.347212e+07 8.704085e+06 2.160630e+07 2.753200e+07 1.982167e+07 2.039214e+07 1.405483e+07 1.844534e+07 7.008815e+06 1.403317e+07 9.044901e+06 1.715078e+07 1.753729e+07 1.974764e+07 1.029294e+07 1.532255e+07 1.992833e+07 1.526431e+07 1.594119e+07 1.180477e+07 1.034263e+07 1.117011e+07 1.502296e+07 1.366695e+07 1.515693e+07 1.304609e+07 1.318783e+07 2.334680e+07 2.120234e+07 1.572927e+07 1.504195e+07 1.366084e+07 1.209019e+07 1.224953e+07 9.952645e+06 1.816469e+07 1.356430e+07 1.514444e+07 1.483943e+07 1.306766e+07 1.813752e+07 9.205118e+06 1.076776e+07 6.793610e+06 1.753222e+07 1.318998e+07 1.672081e+07 1.361835e+07 1.868632e+07 1.393144e+07 8.807222e+06 8.638155e+06 1.540497e+07 1.727410e+07 1.636398e+07 1.940822e+07 3.384320e+07 1.816014e+07 1.702522e+07 2.639829e+07 1.556237e+07 1.931619e+07 2.013958e+07 1.443941e+07 2.188748e+07 1.333085e+07 2.355088e+07 1.317390e+07 1.218003e+07 3.305711e+07 2.406326e+07 1.093134e+07 1.099438e+07 1.672816e+07 2.166701e+07 1.623254e+07 1.299955e+07 2.660244e+07 C4 H4 O2_6.491 2.576639e+06 3.080413e+06 2.596624e+06 3.029152e+06 4.845700e+05 2.543605e+06 3.304971e+06 3.421435e+06 338624.35 3.191857e+06 2.711564e+06 3.015395e+06 354185.07 2.813729e+06 2.821511e+06 3.151850e+06 4.025916e+05 2.459281e+06 3.046192e+06 2.937076e+06 3.209815e+05 2.889216e+06 3.219243e+06 3.524538e+06 56905.321 2.756009e+06 2.216607e+06 3.296633e+06 1.106304e+05 3.204179e+06 3.332477e+06 2.994570e+06 206224.64 2.256007e+06 2.419566e+06 2.878867e+06 2.437950e+05 2.467898e+06 4.922008e+06 3.066634e+06 1.877839e+05 2.058613e+06 2.861963e+06 3.330078e+06 2.038229e+05 2.537771e+06 2.662023e+06 3.273555e+06 1.712777e+06 8.741784e+05 2.135680e+06 6.636090e+05 2.224263e+06 8.788968e+06 2.120497e+06 9.152018e+06 6.929156e+06 5.002059e+06 1.348778e+06 6.829534e+06 4.473379e+06 1.403461e+06 5.110063e+05 1.097160e+06 5.972808e+06 1.546608e+06 1.779570e+06 1.074809e+06 2.670106e+06 2.553353e+06 1.744174e+06 8.549173e+05 1.213638e+06 1.080394e+06 1.911154e+06 7.232934e+06 4.136373e+06 1.131693e+07 1.636364e+06 6.497100e+05 1.559607e+06 6.141720e+05 7.101965e+05 1.180454e+06 2.040906e+06 1.867898e+06 1.631034e+06 1.729103e+06 1.407094e+06 4.370175e+05 1.722929e+06 1.369421e+06 1.712235e+07 5.302811e+05 7.753895e+05 1.022706e+06 9.256822e+05 1.229340e+06 1.533977e+06 6.820319e+05 1.838407e+06 1.247868e+06 7.898991e+05 2.386945e+06 1.175753e+06 1.060027e+06 1.438993e+06 5.073448e+05 6.027563e+05 1.208426e+06 1.565270e+06 5.883504e+06 5.713487e+06 4.210445e+06 1.583491e+06 1.203839e+06 1.339717e+06 1.094030e+06 4.563351e+06 6.260082e+05 5.182118e+05 1.191814e+06 4.295305e+06 5.335526e+06 6.941237e+06 4.051685e+05 8.774698e+06 9.448425e+05 1.220514e+06 5.126601e+06 1.418447e+06 2.913885e+06 6.334536e+06 3.285830e+06 7.857181e+05 1.745260e+06 6.535956e+06 1.410235e+06 5.629287e+06 3.550833e+06 8.048835e+05 1.269921e+07 1.001307e+06 4.380472e+06 1.355752e+06 5.957796e+06 3.352504e+06 2.842102e+06 4.852458e+06 3.183222e+06 7.577646e+06 1.208308e+06 8.116895e+05 1.922669e+06 3.374408e+06 7.134487e+05 1.514265e+07 5.215618e+06 1.932897e+06 8.004136e+06 5.028323e+06 1.783998e+06 2.408098e+06 5.510137e+06 1.861011e+06 1.806654e+06 1.034921e+06 2.723975e+06 1.169769e+06 1.273986e+06 4.673569e+06 1.303243e+07 3.070632e+06 3.304141e+06 1.211230e+06 1.476080e+06 5.748869e+06 9.024654e+05 1.976543e+06 1.997583e+06 3.848510e+06 1.675496e+06 4.750729e+05 1.626362e+06 4.592481e+05 5.778052e+05 6.446303e+06 5.852269e+05 6.290829e+05 5.259798e+06 3.079938e+06 2.497809e+06 9.795915e+05 1.665857e+06 2.126281e+06 1.104809e+06 6.406318e+05 1.821552e+06 2.942054e+06 5.999685e+06 1.008909e+06 2.061462e+06 3.002018e+06 2.271185e+06 1.700782e+06 1.711009e+06 1.459497e+06 2.251418e+06 1.362386e+06 9.860866e+06 2.585958e+06 3.681466e+06 2.328271e+06 3.250227e+06 8.716546e+05 3.831416e+06 1.022245e+06 5.685287e+05 1.497351e+06 4.224742e+05 6.010330e+06 1.283222e+06 2.273349e+06 1.339237e+06 8.085074e+05 1.205040e+06 5.883773e+06 1.741388e+06 3.645899e+06 6.193820e+06 1.484105e+06 7.303352e+06 4.213922e+06 9.406613e+05 1.429121e+06 3.271525e+06 5.333441e+06 1.762256e+06 2.685566e+06 7.997659e+06 7.197430e+05 1.557984e+07 9.837880e+05 6.874171e+06 1.671641e+06 3.254266e+06 2.622915e+06 1.726843e+06 3.683529e+06 1.324508e+06 6.838211e+06 1.040757e+06 2.910345e+06 3.413132e+06 3.918634e+06 3.088701e+06 8.376928e+05 6.286906e+06 1.795525e+06 2.365931e+06 1.251260e+06 4.842838e+06 C6 H8 O4_6.492 1.281043e+06 2.435931e+06 2.758586e+06 2.974218e+06 1.098953e+06 3.343867e+06 3.553321e+06 3.287063e+06 792567.77 2.510078e+06 3.042548e+06 3.429898e+06 804251.89 2.312607e+06 2.839888e+06 3.288430e+06 8.569354e+05 2.933044e+06 2.502677e+06 2.644955e+06 6.479863e+05 3.018055e+06 3.474004e+06 3.298913e+06 94987.937 3.090041e+06 2.247699e+06 3.202306e+06 8.378468e+04 3.083454e+06 3.477392e+06 2.610855e+06 435992.10 2.258162e+06 2.998528e+06 2.906752e+06 4.893139e+05 3.494665e+06 2.772662e+06 3.997535e+06 4.570318e+05 2.201615e+06 2.710770e+06 3.194984e+06 4.476805e+05 2.816354e+06 2.691442e+06 3.230978e+06 1.481995e+06 1.089180e+06 1.487533e+06 9.615576e+05 1.064412e+06 1.094147e+07 1.054997e+06 1.038001e+07 8.074735e+06 6.637984e+06 8.522719e+05 8.943212e+06 3.993624e+06 9.209497e+05 1.086081e+06 8.702511e+05 9.897897e+06 7.779730e+05 1.246337e+06 8.115248e+05 3.300884e+06 2.056003e+06 1.133943e+06 9.870228e+05 9.815398e+05 8.519156e+05 1.242490e+06 9.186461e+06 3.838067e+06 1.437596e+07 1.122437e+06 9.945552e+05 7.765904e+05 8.610348e+05 6.461011e+05 9.970167e+05 1.392738e+06 1.273370e+06 7.803005e+05 9.244556e+05 6.438504e+05 7.133177e+05 1.004645e+06 1.470438e+06 1.340932e+07 1.238400e+06 9.185357e+05 9.813621e+05 9.117299e+05 8.108479e+05 9.694610e+05 1.181528e+06 1.687440e+06 9.763753e+05 9.827975e+05 2.740033e+06 7.102560e+05 7.177873e+05 1.061327e+06 1.063848e+06 7.385877e+05 1.282914e+06 8.520207e+05 8.091214e+06 6.314418e+06 3.468790e+06 9.391844e+05 1.247874e+06 9.731222e+05 1.366366e+06 6.993896e+06 1.006764e+06 1.085504e+06 9.492311e+05 6.451845e+06 6.243627e+06 8.435087e+06 1.274896e+06 1.386729e+07 7.679103e+05 1.320016e+06 5.492556e+06 8.647817e+05 4.436081e+06 1.069897e+07 3.516206e+06 1.089723e+06 8.023225e+05 9.711800e+06 1.346919e+06 6.867993e+06 3.467890e+06 8.307558e+05 1.449337e+07 1.577090e+06 6.146187e+06 1.012127e+06 8.548522e+06 3.398644e+06 3.401903e+06 5.983525e+06 3.431199e+06 8.635681e+06 8.291579e+05 8.055855e+05 7.548929e+05 4.521853e+06 8.619001e+05 2.284811e+07 4.924573e+06 1.118262e+06 1.181930e+07 6.247770e+06 8.548025e+05 2.660952e+06 6.677967e+06 1.807557e+06 9.033221e+05 1.037602e+06 3.568464e+06 7.567228e+05 8.256503e+05 5.370211e+06 1.486460e+07 4.166125e+06 3.628531e+06 9.084866e+05 1.501962e+06 6.677011e+06 8.226361e+05 2.049336e+06 1.536723e+06 5.696691e+06 1.139605e+06 1.050158e+06 1.308555e+06 6.062109e+05 7.168346e+05 1.271867e+07 8.332034e+05 1.118281e+06 6.688953e+06 3.129303e+06 1.648746e+06 5.743570e+05 9.073542e+05 3.521798e+06 1.030738e+06 1.142890e+06 7.039669e+05 2.324834e+06 6.931898e+06 1.001871e+06 1.552910e+06 3.858699e+06 1.068845e+06 1.326427e+06 1.018448e+06 1.095552e+06 2.649044e+06 8.952419e+05 1.026993e+07 2.149294e+06 3.949771e+06 8.738638e+05 2.816573e+06 6.223369e+05 3.518250e+06 6.963095e+05 8.205105e+05 9.734759e+05 8.107991e+05 8.963472e+06 9.469240e+05 1.201499e+06 6.532684e+05 6.239180e+05 8.215508e+05 8.454770e+06 1.913502e+06 3.847280e+06 9.059259e+06 8.310321e+05 9.253164e+06 4.710135e+06 9.400581e+05 7.598520e+05 1.870481e+06 5.792399e+06 9.409174e+05 2.144136e+06 9.370539e+06 9.537534e+05 1.947571e+07 6.274424e+05 1.095213e+07 1.341933e+06 2.921931e+06 1.873741e+06 1.065856e+06 2.431810e+06 1.030461e+06 9.976789e+06 8.245902e+05 3.495689e+06 3.323775e+06 5.769042e+06 2.235675e+06 1.004856e+06 5.971555e+06 1.137808e+06 3.426075e+06 1.076474e+06 5.715031e+06 169.5257_6.497 1.464250e+06 4.359236e+06 5.195033e+06 6.325841e+06 4.022334e+05 7.344443e+06 7.859875e+06 7.940993e+06 334117.35 4.282749e+06 5.838372e+06 4.393818e+06 362791.00 5.265578e+06 6.584821e+06 7.463641e+06 3.588313e+05 5.590955e+06 4.775906e+06 4.864894e+06 2.758886e+05 8.892356e+06 5.202004e+06 7.326939e+06 34560.588 5.974023e+06 3.316697e+06 6.704109e+06 3.572903e+04 6.346774e+06 7.555104e+06 5.755041e+06 170972.88 5.070098e+06 5.393738e+06 7.212245e+06 2.232351e+05 6.358719e+06 6.456048e+06 7.480480e+06 2.474638e+05 3.512628e+06 4.127086e+06 8.108541e+06 2.309354e+05 5.296953e+06 6.302316e+06 6.104504e+06 4.828872e+06 4.118669e+05 3.278298e+06 5.075376e+05 3.994907e+06 1.683337e+07 4.044310e+06 1.539680e+07 1.922183e+07 1.115321e+07 1.649118e+06 1.846598e+07 6.947216e+06 1.245407e+06 4.653966e+05 3.352841e+05 2.144851e+07 3.705414e+05 3.407086e+06 2.032780e+06 6.039051e+06 5.155237e+06 2.617980e+06 4.160015e+05 3.719348e+05 4.941305e+05 3.361410e+06 1.772678e+07 9.473927e+06 2.553872e+07 2.473591e+06 9.617685e+05 2.322277e+06 3.580581e+05 3.097292e+05 4.221365e+05 3.837421e+06 4.113413e+06 3.410804e+06 2.265345e+06 2.005987e+06 3.310170e+05 2.230457e+06 1.721389e+06 3.412740e+07 1.063499e+06 8.752954e+05 4.066290e+05 8.438725e+05 1.994549e+06 1.394045e+06 4.295714e+05 4.461403e+06 1.862828e+06 3.891010e+05 5.521554e+06 2.451152e+06 2.800363e+05 1.265214e+06 3.076710e+05 3.329515e+05 6.623107e+05 2.871081e+06 1.209736e+07 1.180094e+07 7.543389e+06 1.818069e+06 1.571035e+06 3.657306e+05 1.021431e+06 9.543828e+06 3.697806e+05 1.573649e+06 4.595340e+05 1.426017e+07 1.288820e+07 2.622794e+07 6.910104e+05 2.607897e+07 3.387916e+05 1.502115e+06 1.356496e+07 1.493830e+06 7.614420e+06 2.221250e+07 5.432731e+06 5.172834e+05 4.818374e+05 1.191427e+07 3.326258e+06 1.533261e+07 6.126948e+06 5.141730e+05 2.071217e+07 7.041568e+05 1.022903e+07 1.135556e+06 1.405283e+07 1.294872e+07 5.338004e+06 1.059255e+07 8.708722e+06 2.177377e+07 1.695746e+06 8.405557e+05 2.936697e+06 6.797592e+06 5.560514e+05 3.299208e+07 7.135951e+06 2.166775e+06 2.007868e+07 9.839901e+06 2.872537e+06 4.396862e+06 1.411988e+07 4.409852e+06 1.862419e+06 7.735794e+05 8.576440e+06 2.159214e+06 2.424977e+06 9.798189e+06 2.392785e+07 9.781284e+06 7.146918e+06 2.159328e+06 9.566105e+05 8.050540e+06 4.146955e+05 3.967704e+06 3.336936e+06 9.400369e+06 2.963061e+06 3.217743e+05 3.015905e+06 2.590494e+05 4.986138e+05 1.789655e+07 3.808090e+05 8.255554e+05 1.505410e+07 7.609821e+06 4.652476e+06 1.555277e+06 4.071115e+06 9.419480e+06 4.631295e+05 5.249273e+05 1.760822e+06 3.793520e+06 1.255850e+07 1.164512e+06 3.225663e+06 8.611819e+06 3.855916e+06 3.259816e+06 2.913480e+06 8.132915e+05 4.690903e+06 4.051398e+05 2.143378e+07 5.099713e+06 8.703084e+06 2.524988e+06 3.823150e+06 6.668203e+05 6.209997e+06 2.695128e+06 6.443922e+05 2.140423e+06 3.718106e+05 1.493691e+07 2.038634e+06 3.154142e+06 2.595766e+06 2.781282e+05 9.386364e+05 2.081165e+07 5.822832e+06 8.017544e+06 1.521247e+07 3.766749e+05 2.328087e+07 7.473679e+06 9.370485e+05 5.332987e+05 5.635395e+06 9.183759e+06 3.073145e+06 4.217126e+06 2.067808e+07 5.670063e+05 3.993162e+07 1.525904e+06 1.671336e+07 1.196625e+06 5.168138e+06 3.663356e+06 9.935831e+05 5.535096e+06 1.943309e+06 1.911188e+07 3.343640e+05 7.206976e+06 9.034495e+06 8.457678e+06 5.815555e+06 9.195096e+05 1.335829e+07 3.440979e+06 6.752016e+06 2.272756e+06 1.062014e+07 C12 H22 Cl N O5 S2_6.497 7.029614e+05 1.089623e+06 1.240014e+06 1.039185e+06 6.446893e+05 1.170313e+06 9.599069e+05 1.283828e+06 490715.05 1.157653e+06 8.729860e+05 1.316443e+06 457471.52 1.099771e+06 1.013051e+06 1.314083e+06 4.751572e+05 9.029343e+05 1.142298e+06 1.013562e+06 3.851396e+05 1.393533e+06 9.315012e+05 1.238432e+06 71977.293 1.208177e+06 6.785365e+05 1.216852e+06 5.026518e+04 1.208991e+06 1.736087e+06 8.987395e+05 275001.57 7.522290e+05 9.135583e+05 1.164145e+06 3.094085e+05 8.496194e+05 1.676558e+06 1.275004e+06 4.036955e+05 9.027221e+05 1.178813e+06 1.133119e+06 3.436473e+05 9.348578e+05 8.356351e+05 1.389027e+06 6.056638e+05 5.203447e+05 6.006850e+05 5.915572e+05 6.024996e+05 4.105144e+06 5.659426e+05 6.206007e+06 5.207128e+06 2.028297e+06 5.762784e+05 3.623977e+06 1.174959e+06 7.558872e+05 6.026677e+05 4.550890e+05 3.308413e+06 6.210120e+05 4.538251e+05 5.251635e+05 1.239883e+06 4.761840e+05 5.226536e+05 5.762915e+05 6.834799e+05 7.885981e+05 5.114841e+05 3.934801e+06 1.660775e+06 5.049103e+06 6.225256e+05 6.036989e+05 4.394041e+05 4.794945e+05 3.993868e+05 5.524731e+05 6.795450e+05 5.478602e+05 5.412915e+05 5.163414e+05 3.936046e+05 4.593713e+05 6.039682e+05 6.927603e+05 7.201431e+06 7.366957e+05 4.717457e+05 5.488415e+05 5.182029e+05 5.242035e+05 4.451524e+05 5.473224e+05 5.758402e+05 8.925512e+05 6.538369e+05 1.094470e+06 4.651698e+05 4.368689e+05 6.682040e+05 4.358039e+05 4.618041e+05 5.035738e+05 3.695444e+05 2.555570e+06 2.771614e+06 1.583095e+06 7.904109e+05 7.213417e+05 5.166475e+05 1.142335e+06 2.172848e+06 5.216272e+05 7.390699e+05 5.713519e+05 3.201712e+06 2.234039e+06 3.931883e+06 4.983153e+05 5.556929e+06 6.936431e+05 4.967007e+05 2.878775e+06 5.409609e+05 1.948630e+06 5.521255e+06 7.543049e+05 6.126053e+05 4.371840e+05 4.123414e+06 4.417655e+05 2.440415e+06 1.073394e+06 4.960597e+05 5.723418e+06 6.488358e+05 2.427197e+06 6.046377e+05 2.855355e+06 1.417652e+06 1.102919e+06 3.141531e+06 1.692060e+06 5.308345e+06 4.942972e+05 5.022622e+05 4.730903e+05 1.655151e+06 5.203164e+05 7.829763e+06 2.254541e+06 5.213693e+05 4.862277e+06 2.385484e+06 4.215725e+05 1.063847e+06 3.680305e+06 5.413224e+05 9.175552e+05 7.821404e+05 1.464245e+06 4.810128e+05 5.119943e+05 2.737075e+06 6.744246e+06 1.853481e+06 9.463386e+05 6.036241e+05 5.598443e+05 1.962280e+06 5.016891e+05 5.468647e+05 5.437222e+05 1.712664e+06 5.873478e+05 4.293880e+05 4.550377e+05 3.797462e+05 4.585930e+05 5.140306e+06 7.466326e+05 6.758161e+05 3.024518e+06 1.072157e+06 6.534444e+05 3.698581e+05 5.206311e+05 1.518467e+06 6.068113e+05 7.930111e+05 4.275847e+05 6.085493e+05 2.500107e+06 5.807039e+05 4.089418e+05 1.871123e+06 6.040032e+05 7.360600e+05 5.031078e+05 5.108391e+05 1.017691e+06 5.697558e+05 5.394151e+06 1.011265e+06 1.937248e+06 4.863381e+05 8.867514e+05 5.666215e+05 1.150122e+06 5.505532e+05 4.183784e+05 5.395314e+05 5.234446e+05 5.204058e+06 5.524622e+05 4.593897e+05 4.772067e+05 3.952308e+05 4.808490e+05 4.628942e+06 9.037370e+05 1.133192e+06 3.655402e+06 5.319417e+05 4.812434e+06 2.008696e+06 4.380236e+05 4.665325e+05 8.013571e+05 1.882043e+06 5.077591e+05 7.073930e+05 3.790786e+06 5.616914e+05 8.437230e+06 3.994895e+05 5.012526e+06 5.188369e+05 1.852903e+06 5.499601e+05 7.325851e+05 9.503474e+05 5.725644e+05 4.049747e+06 4.875762e+05 1.809887e+06 1.193642e+06 2.799348e+06 8.803840e+05 6.069063e+05 2.557362e+06 5.648937e+05 9.200030e+05 1.109733e+06 2.018399e+06 N2-Acetyl-L-aminoadipate_6.499 7.789921e+05 9.589712e+05 1.002783e+06 1.189119e+06 6.841341e+05 9.007686e+05 1.015655e+06 1.150193e+06 441434.40 1.119967e+06 1.165341e+06 1.092514e+06 492510.06 8.863802e+05 9.910614e+05 1.275323e+06 5.736951e+05 9.182975e+05 9.152611e+05 1.032954e+06 5.127121e+05 8.569386e+05 1.110957e+06 1.403495e+06 88498.851 8.570322e+05 1.010550e+06 6.687982e+05 6.540235e+04 6.048472e+05 1.262596e+06 1.083144e+06 368500.10 7.859588e+05 9.432123e+05 1.009723e+06 4.425389e+05 1.146715e+06 9.727719e+05 1.292706e+06 3.881813e+05 8.911165e+05 9.717382e+05 1.381720e+06 3.674843e+05 8.829908e+05 8.465584e+05 1.153238e+06 5.545146e+05 5.394304e+05 5.937870e+05 8.320508e+05 8.121492e+05 4.923383e+06 6.623136e+05 3.786882e+06 3.672207e+06 2.850291e+06 8.140786e+05 3.644654e+06 1.699451e+06 7.760399e+05 6.774340e+05 6.625239e+05 3.443216e+06 6.276502e+05 6.033413e+05 7.134407e+05 1.311955e+06 5.851092e+05 4.908465e+05 7.733048e+05 6.450048e+05 6.393289e+05 6.730945e+05 3.369847e+06 1.617142e+06 6.631585e+06 7.054656e+05 8.010454e+05 3.942705e+05 6.044335e+05 5.807386e+05 6.414154e+05 4.983591e+05 6.272593e+05 5.513306e+05 5.483217e+05 5.114027e+05 6.056802e+05 8.103073e+05 6.216512e+05 6.265872e+06 6.661471e+05 5.346413e+05 7.047395e+05 7.243674e+05 6.755009e+05 5.747559e+05 5.859333e+05 6.578691e+05 7.799265e+05 6.649922e+05 1.023749e+06 6.522808e+05 5.862210e+05 8.982176e+05 6.726956e+05 5.750048e+05 6.760266e+05 4.960443e+05 2.625705e+06 2.089386e+06 1.563514e+06 4.171132e+05 7.085530e+05 6.530282e+05 7.219409e+05 2.197560e+06 7.273408e+05 8.209779e+05 7.022743e+05 2.800641e+06 2.533171e+06 3.195712e+06 7.261931e+05 4.502695e+06 8.998812e+05 4.799852e+05 2.145029e+06 6.672071e+05 1.946418e+06 4.389830e+06 9.130450e+05 6.300402e+05 5.747948e+05 4.372384e+06 7.198635e+05 3.066671e+06 1.475185e+06 6.157135e+05 5.701426e+06 7.002578e+05 2.179153e+06 5.797220e+05 2.861955e+06 1.262978e+06 1.237793e+06 2.515313e+06 2.059552e+06 4.323723e+06 6.594484e+05 6.499514e+05 6.387798e+05 1.459538e+06 4.630193e+05 9.531233e+06 1.504865e+06 6.525707e+05 3.881406e+06 2.228114e+06 5.822156e+05 8.993693e+05 2.734016e+06 6.335769e+05 5.470663e+05 8.400909e+05 1.146537e+06 6.362756e+05 7.432990e+05 2.226705e+06 7.293942e+06 1.318734e+06 1.105316e+06 7.369180e+05 5.166576e+05 2.539381e+06 7.487042e+05 5.651538e+05 5.792523e+05 1.443382e+06 5.613061e+05 5.339405e+05 5.340557e+05 4.894102e+05 6.216257e+05 4.873134e+06 7.002770e+05 6.103483e+05 2.807276e+06 9.984872e+05 5.512157e+05 5.092339e+05 7.543831e+05 1.022653e+06 5.473185e+05 8.722915e+05 5.482818e+05 6.781708e+05 2.792000e+06 5.492163e+05 7.206790e+05 1.792208e+06 5.840509e+05 7.428933e+05 5.609368e+05 6.380558e+05 7.853232e+05 7.227714e+05 4.957310e+06 9.830812e+05 1.702747e+06 5.969381e+05 8.358541e+05 5.278894e+05 1.457558e+06 5.698417e+05 5.091845e+05 6.213816e+05 6.499641e+05 3.346935e+06 5.157566e+05 5.799287e+05 5.300828e+05 5.052542e+05 4.462292e+05 3.322620e+06 9.203715e+05 1.511485e+06 3.592318e+06 6.700439e+05 3.948113e+06 1.957407e+06 5.832985e+05 5.912109e+05 7.401881e+05 1.828177e+06 6.868686e+05 8.368042e+05 3.536418e+06 7.333112e+05 7.690610e+06 4.913425e+05 3.268799e+06 5.421872e+05 1.850402e+06 6.089823e+05 6.384381e+05 1.014723e+06 6.331965e+05 4.053432e+06 6.532981e+05 1.235907e+06 1.131787e+06 2.104838e+06 9.632766e+05 5.633443e+05 3.299189e+06 6.663349e+05 6.663498e+05 6.079693e+05 2.959560e+06 C9 H9 N9 O4 S_6.502 1.505981e+06 4.811799e+06 5.759335e+06 7.043335e+06 4.808334e+05 8.247800e+06 8.966665e+06 6.222564e+06 429191.29 5.144993e+06 6.876280e+06 5.053177e+06 441840.72 5.920328e+06 7.420189e+06 8.537533e+06 4.276318e+05 6.235137e+06 5.337951e+06 5.343362e+06 3.222455e+05 6.439729e+06 8.014462e+06 8.395772e+06 36851.522 5.956407e+06 4.572645e+06 6.856599e+06 3.995325e+04 6.656670e+06 8.129083e+06 6.262003e+06 206948.81 5.521452e+06 5.825370e+06 7.606810e+06 2.493427e+05 6.621540e+06 7.205585e+06 7.126852e+06 2.501991e+05 4.852102e+06 6.575538e+06 7.786971e+06 2.418912e+05 5.504973e+06 6.485429e+06 6.859908e+06 4.859466e+06 4.847999e+05 3.479259e+06 5.223425e+05 3.698973e+06 1.562112e+07 4.504056e+06 1.620750e+07 1.997789e+07 1.240430e+07 1.744240e+06 2.071700e+07 7.539388e+06 1.239885e+06 1.438903e+06 3.635290e+05 1.238991e+07 3.974307e+05 3.791463e+06 2.203699e+06 6.560332e+06 4.848939e+06 3.648478e+06 4.558265e+05 4.131957e+05 5.131469e+05 3.467964e+06 1.807973e+07 1.056749e+07 2.744831e+07 2.755441e+06 9.478660e+05 2.785770e+06 4.277481e+05 3.371686e+05 5.025386e+05 4.247756e+06 3.909503e+06 3.408950e+06 2.538150e+06 2.113475e+06 3.572274e+05 2.418346e+06 2.062530e+06 3.621863e+07 1.349368e+06 8.348668e+05 4.861152e+05 8.094866e+05 1.864614e+06 2.004571e+06 5.139179e+05 4.968772e+06 1.889355e+06 4.147180e+05 5.979103e+06 2.224723e+06 3.226011e+05 1.377258e+06 3.467372e+05 3.601973e+05 7.156829e+05 3.098336e+06 1.225309e+07 1.191455e+07 9.038363e+06 2.099079e+06 1.814883e+06 3.994338e+05 1.109448e+06 1.036580e+07 3.950128e+05 1.470010e+06 4.592570e+05 1.350814e+07 1.365211e+07 2.463958e+07 6.423105e+05 2.680651e+07 3.787330e+05 1.724645e+06 1.452806e+07 1.498701e+06 9.249475e+06 2.237103e+07 5.815341e+06 5.851548e+05 5.382754e+05 1.259595e+07 3.319427e+06 1.531274e+07 7.347994e+06 5.270004e+05 3.041580e+07 7.872005e+05 1.025122e+07 1.265710e+06 1.525869e+07 1.209119e+07 5.781739e+06 1.244135e+07 9.281689e+06 2.484776e+07 1.811697e+06 8.812450e+05 3.270783e+06 7.268739e+06 7.084170e+05 3.570840e+07 8.561490e+06 2.193029e+06 2.267581e+07 1.071408e+07 3.289741e+06 4.863363e+06 1.437889e+07 4.713762e+06 2.080163e+06 7.814175e+05 8.099174e+06 2.027425e+06 2.479125e+06 1.469476e+07 2.680121e+07 9.600906e+06 7.128228e+06 2.179228e+06 1.120426e+06 7.810172e+06 4.387009e+05 4.490278e+06 3.730176e+06 9.118347e+06 3.206548e+06 3.841069e+05 3.608370e+06 2.889386e+05 5.410773e+05 2.116526e+07 4.243883e+05 1.059781e+06 1.388299e+07 8.113868e+06 5.878483e+06 1.674469e+06 4.178158e+06 8.427873e+06 5.475178e+05 4.825276e+05 1.770384e+06 4.027508e+06 1.483793e+07 1.597084e+06 3.432391e+06 9.076427e+06 4.477508e+06 3.721978e+06 3.256107e+06 8.250787e+05 5.377344e+06 4.441034e+05 2.431046e+07 5.470496e+06 8.717313e+06 2.612562e+06 4.102661e+06 6.994319e+05 6.919458e+06 2.672629e+06 6.447803e+05 2.383599e+06 3.994853e+05 1.787111e+07 2.374110e+06 3.225969e+06 2.494753e+06 3.073864e+05 1.171916e+06 1.989411e+07 5.483544e+06 8.965820e+06 1.763910e+07 4.099945e+05 2.231522e+07 1.015863e+07 1.016154e+06 5.847687e+05 5.826997e+06 1.044330e+07 3.337768e+06 4.955287e+06 2.382877e+07 5.710594e+05 4.777618e+07 1.446740e+06 1.922732e+07 1.344443e+06 6.588865e+06 3.847854e+06 1.377536e+06 6.188568e+06 2.212496e+06 2.188437e+07 3.839750e+05 8.591680e+06 1.082601e+07 9.699512e+06 6.808619e+06 1.165733e+06 1.338338e+07 4.176291e+06 6.736873e+06 2.418223e+06 1.186713e+07 261.1575_6.516 1.333382e+06 7.359008e+05 9.910217e+05 1.175663e+06 3.122731e+05 1.005993e+06 1.251724e+06 1.477497e+06 178349.93 1.016621e+06 1.188689e+06 1.291190e+06 198868.75 8.223179e+05 1.004281e+06 1.023624e+06 2.565339e+05 8.397758e+05 1.024633e+06 9.198816e+05 1.805017e+05 1.095062e+06 1.263394e+06 1.504948e+06 18983.091 9.667313e+05 1.006253e+06 1.073936e+06 3.779528e+04 9.749512e+05 1.277259e+06 9.669429e+05 121133.91 9.639389e+05 1.084491e+06 9.777392e+05 1.276597e+05 1.137348e+06 1.335922e+06 1.251235e+06 1.107216e+05 7.031443e+05 1.046366e+06 1.341158e+06 1.019748e+05 1.064176e+06 1.075837e+06 1.021499e+06 8.186694e+05 1.777535e+05 3.459675e+05 6.124025e+05 1.064096e+06 1.484940e+06 1.237469e+06 2.989672e+06 1.285135e+06 2.332496e+06 2.632120e+06 1.979907e+06 2.827838e+06 1.628186e+06 1.584427e+06 3.713704e+05 1.424605e+06 6.772960e+05 7.614076e+05 2.530680e+05 1.822528e+06 9.353450e+05 1.116522e+06 8.562481e+05 2.147704e+05 8.406417e+05 6.985239e+05 1.956245e+06 1.014401e+06 1.609676e+06 3.994388e+06 1.260944e+06 4.648767e+05 1.846066e+06 1.383052e+05 6.770286e+05 6.783519e+05 8.103072e+05 9.101053e+05 7.455255e+05 4.385390e+05 7.310535e+05 1.143625e+06 1.103030e+06 2.379680e+06 1.764648e+05 2.954227e+05 6.237946e+05 5.842748e+05 1.072378e+06 6.628189e+05 7.081718e+05 6.519260e+05 1.578073e+06 5.102124e+05 5.041604e+05 3.336962e+05 2.809209e+05 9.068818e+05 6.372193e+05 8.107974e+05 3.154215e+05 8.701635e+05 9.568786e+05 2.010039e+06 6.487543e+05 4.669211e+05 4.874672e+05 3.189086e+05 8.319726e+05 1.075489e+06 2.877343e+05 4.641428e+05 1.625439e+05 4.452519e+05 1.351598e+06 1.493784e+06 3.349317e+05 1.148058e+06 3.691948e+05 6.932367e+05 1.458964e+06 5.368205e+05 1.566849e+06 9.805181e+05 3.092069e+06 5.433507e+05 5.867358e+05 1.067693e+06 1.175605e+06 2.267141e+06 2.277379e+06 3.199913e+05 2.292400e+06 7.822096e+05 1.254575e+06 2.049131e+05 7.911708e+05 9.670062e+05 1.882656e+06 1.220114e+06 7.921166e+05 1.347089e+06 7.776109e+05 5.043846e+05 7.795948e+05 1.656538e+06 1.904403e+05 2.099561e+06 9.664179e+05 1.028789e+06 1.794824e+06 9.132388e+05 9.421122e+05 4.630068e+05 1.249208e+06 1.174668e+06 9.103644e+05 5.278290e+05 2.013873e+06 6.561019e+05 4.125840e+05 1.200200e+06 2.110785e+06 7.621260e+05 1.539701e+06 5.234323e+05 1.312978e+06 1.009211e+06 6.917191e+05 1.127871e+06 1.791262e+06 5.631110e+05 1.505137e+06 6.713989e+05 1.804322e+06 5.938309e+05 1.335789e+05 1.457208e+06 1.626360e+06 1.157705e+06 1.702078e+06 1.004292e+06 8.128332e+05 3.441833e+05 1.659010e+06 8.601163e+05 8.302035e+05 1.567501e+06 2.117916e+06 1.698300e+06 2.785572e+06 1.836349e+06 8.503951e+05 1.333302e+06 8.125185e+05 5.350720e+05 1.785501e+06 2.682973e+05 3.947130e+05 6.176753e+05 2.906360e+06 9.392182e+05 4.352370e+05 6.611480e+05 1.032049e+06 7.377333e+05 1.522877e+06 8.845337e+05 6.322693e+05 2.733647e+06 6.296221e+05 1.088964e+06 7.338725e+05 1.078200e+06 1.533168e+06 8.488020e+05 5.587102e+05 2.116080e+06 3.772235e+05 1.130779e+06 1.962246e+06 3.839296e+05 1.184659e+06 6.200090e+05 1.144803e+06 4.466007e+05 1.249405e+06 1.596544e+06 1.133009e+06 4.464044e+05 9.253673e+05 1.244419e+06 1.732886e+06 2.733395e+05 3.078712e+06 1.027321e+06 4.500502e+05 8.204580e+05 6.536570e+05 8.174830e+05 8.756491e+05 1.339845e+06 5.335676e+05 1.470436e+06 8.354345e+05 1.731507e+06 9.477411e+05 3.342671e+05 1.971505e+06 1.157641e+06 5.744504e+05 1.241070e+06 2.262219e+06 C8 H5 O4 P_6.549 1.666462e+06 1.838974e+06 1.160398e+06 1.315483e+06 2.153540e+06 1.934878e+06 1.337369e+06 8.164847e+05 1883616.05 2.022985e+06 2.002766e+06 1.623430e+06 533395.49 1.020878e+06 1.232597e+06 2.545996e+06 4.521352e+05 9.140453e+05 1.127380e+06 1.510910e+06 6.609268e+05 1.506691e+06 1.779879e+06 1.941318e+06 48019.746 1.267664e+06 1.361255e+06 1.377465e+06 4.536216e+04 1.520949e+06 1.722723e+06 1.592112e+06 495592.11 1.160215e+06 1.445785e+06 1.352066e+06 5.036052e+05 1.906272e+06 1.517773e+06 1.668289e+06 6.057676e+05 9.384823e+05 2.084630e+06 1.871400e+06 2.308456e+05 1.062841e+06 9.382663e+05 1.930311e+06 4.983190e+05 3.907738e+05 3.404411e+05 3.808250e+05 1.072213e+06 5.828358e+06 7.219556e+05 4.325359e+06 3.363742e+06 2.693846e+06 1.116211e+06 3.818922e+06 2.329167e+06 3.486205e+05 5.785323e+05 4.222873e+05 4.337616e+06 4.384506e+05 5.443187e+05 2.610692e+05 1.811514e+06 2.359240e+06 4.635510e+05 2.981254e+05 5.754273e+05 2.457520e+05 6.897190e+05 3.886429e+06 2.114365e+06 6.740913e+06 4.465453e+05 4.237920e+05 6.848264e+05 3.174729e+05 1.975263e+05 4.374452e+05 3.076441e+05 8.564951e+05 7.033250e+05 8.704214e+05 9.034435e+05 3.686795e+05 3.488551e+05 5.362571e+05 1.402320e+07 6.730970e+05 5.342926e+05 3.238359e+05 2.719610e+05 4.518520e+05 8.276936e+05 3.760127e+05 1.469697e+06 3.911463e+05 6.623385e+05 1.624526e+06 2.414929e+05 2.370633e+05 5.208750e+05 4.838314e+05 2.257916e+05 2.295489e+05 5.042767e+05 2.243663e+06 5.121348e+06 1.715297e+06 3.137069e+05 4.154493e+05 2.452709e+05 2.917610e+05 3.477971e+06 2.731774e+05 4.289373e+05 2.991794e+05 3.753563e+06 2.673343e+06 3.671106e+06 2.325543e+05 9.785369e+06 7.736217e+05 3.418518e+05 2.526080e+06 3.025852e+05 2.607301e+06 5.713391e+06 1.685200e+06 1.083909e+06 8.921766e+05 3.064271e+06 5.639646e+05 3.667815e+06 1.546542e+06 2.640700e+05 1.122859e+07 4.829364e+05 3.207784e+06 7.011479e+05 4.337212e+06 1.692766e+06 1.941534e+06 3.150861e+06 2.773537e+06 5.392054e+06 4.815773e+05 4.962286e+05 8.861483e+05 2.506855e+06 9.848117e+05 5.441794e+06 1.619331e+06 3.360955e+05 4.351949e+06 3.411261e+06 9.359787e+05 4.540776e+05 3.155521e+06 1.112924e+06 1.236600e+06 3.554438e+05 1.474886e+06 3.042870e+05 1.068653e+06 5.441764e+06 8.239118e+06 2.458799e+06 1.475904e+06 2.917250e+05 4.346269e+05 3.120538e+06 3.791470e+05 7.839197e+05 7.346537e+05 2.398695e+06 4.191872e+05 2.545907e+05 1.430203e+06 3.259952e+05 5.206026e+05 6.282306e+06 2.781400e+05 6.569050e+05 2.671824e+06 2.180228e+06 9.129312e+05 3.080450e+05 7.450234e+05 1.879595e+06 3.380172e+05 4.111014e+05 2.486037e+05 1.286169e+06 1.964130e+06 1.413898e+06 3.869110e+05 2.057170e+06 8.058989e+05 6.950871e+05 7.242955e+05 9.552297e+05 1.103067e+06 5.211754e+05 7.739457e+06 1.685641e+06 1.719320e+06 5.072830e+05 1.501695e+06 6.416627e+05 1.818353e+06 4.560744e+05 2.054639e+05 3.266177e+05 5.265023e+05 4.699187e+06 4.072000e+05 1.087120e+06 6.172348e+05 2.105357e+05 5.911375e+05 4.283546e+06 9.975460e+05 1.408779e+06 4.348650e+06 2.665857e+05 3.387724e+06 2.153739e+06 5.507404e+05 2.607171e+05 1.435486e+06 2.665742e+06 6.104915e+05 8.286003e+05 7.043272e+06 3.766425e+05 9.944253e+06 7.217384e+05 8.828315e+06 1.209248e+06 1.088594e+06 9.384937e+05 2.953982e+05 1.491419e+06 3.700373e+05 6.783172e+06 2.915143e+05 1.801526e+06 1.837403e+06 3.226413e+06 9.328151e+05 5.878000e+05 2.808365e+06 5.654481e+05 1.486815e+06 3.703927e+05 2.896626e+06 C4 H6 N O3 P_6.552 1.722747e+06 1.957754e+06 2.262974e+06 1.627897e+06 3.797101e+05 2.689459e+06 3.666912e+06 3.519037e+06 210855.28 1.783636e+06 2.396350e+06 3.100304e+06 231621.16 1.725173e+06 2.506838e+06 3.146835e+06 2.531319e+05 1.623580e+06 2.393785e+06 2.699180e+06 2.061700e+05 2.015948e+06 2.715380e+06 3.363095e+06 24894.166 2.072240e+06 2.224737e+06 2.869240e+06 2.567791e+04 2.188750e+06 2.903226e+06 2.565957e+06 133096.25 1.565666e+06 2.868819e+06 3.116519e+06 1.509395e+05 1.990063e+06 2.554884e+06 3.301039e+06 1.422520e+05 1.567775e+06 2.623995e+06 3.538899e+06 1.367799e+05 1.480767e+06 1.857126e+06 3.102170e+06 1.277212e+06 1.182100e+06 5.938348e+05 1.280858e+06 1.504214e+06 1.319207e+06 2.602417e+06 1.801841e+06 2.085891e+06 1.861138e+06 1.738492e+06 1.456024e+06 1.816238e+06 3.668843e+06 1.145488e+06 1.919417e+06 1.258480e+06 3.832178e+05 1.457478e+06 1.169842e+06 1.343078e+06 1.484209e+06 2.816029e+06 1.454543e+06 1.235195e+06 1.133298e+06 2.080634e+06 1.885586e+06 1.393853e+06 6.631213e+05 2.080323e+06 1.246745e+06 1.371199e+06 1.781842e+06 7.208537e+05 8.013742e+05 7.600674e+05 9.316844e+05 1.032693e+06 1.137190e+06 8.518593e+05 1.896092e+06 9.255200e+05 7.922617e+05 8.364016e+05 1.050632e+06 2.277767e+06 1.009760e+06 1.684286e+06 1.794106e+06 1.815862e+06 9.342095e+05 9.306332e+05 1.915616e+06 7.098581e+05 1.704846e+06 1.008570e+06 7.310911e+05 1.483593e+06 1.302927e+06 2.022798e+06 1.118804e+06 4.729713e+05 1.039268e+06 1.173935e+06 5.191042e+05 1.762353e+06 6.852813e+05 9.878073e+05 1.820958e+06 1.162288e+06 1.460385e+06 1.129375e+06 1.504105e+06 6.567520e+05 8.906481e+05 8.833761e+05 8.991978e+05 9.468784e+05 4.579263e+05 2.048889e+06 1.549123e+06 1.605049e+06 1.572114e+06 5.574618e+05 1.310405e+06 1.324035e+06 9.766380e+05 6.293817e+05 1.633821e+06 7.557593e+05 1.367876e+06 1.594192e+06 1.036932e+06 7.507636e+05 2.710873e+06 2.158863e+06 1.590475e+06 1.386486e+06 2.676070e+06 1.503039e+06 5.242441e+05 5.622818e+05 1.704283e+06 1.295781e+06 4.510340e+06 9.275707e+05 1.379206e+06 9.304532e+05 5.831336e+05 8.827889e+05 1.941236e+06 5.129768e+05 3.372570e+06 1.385734e+06 8.856631e+05 7.484360e+05 1.177657e+06 1.029998e+06 1.407159e+06 1.258695e+06 9.129665e+05 1.046398e+06 6.529981e+05 1.149343e+06 8.864864e+05 1.474393e+06 1.151504e+06 1.204112e+06 1.148425e+06 1.357636e+06 1.064801e+06 8.234481e+05 6.996029e+05 8.628464e+05 2.649579e+06 3.079955e+05 7.909139e+05 4.972573e+05 6.828027e+05 7.128621e+05 1.022009e+06 1.056868e+06 6.205453e+05 2.807115e+05 1.263433e+06 7.227377e+05 2.328572e+06 4.261303e+06 9.537994e+05 1.397659e+06 6.179525e+05 2.832798e+06 1.219609e+06 6.321490e+05 1.340437e+06 1.572929e+06 2.213902e+06 2.446782e+06 8.559515e+05 7.077750e+05 9.706536e+05 7.010126e+05 5.996819e+05 1.514421e+06 1.017423e+06 3.781717e+05 2.571806e+06 5.514159e+05 4.615031e+05 2.296831e+06 1.782028e+06 8.191438e+05 1.394166e+06 1.211987e+06 7.701366e+05 8.074901e+05 7.640135e+05 5.059508e+05 5.276605e+05 1.263675e+06 1.230285e+06 1.748026e+06 5.282029e+05 5.737008e+05 1.188872e+06 5.936328e+05 9.147960e+05 1.265508e+06 2.045592e+06 7.127995e+05 1.744786e+06 2.149891e+06 1.111339e+06 7.553837e+05 1.459508e+06 1.366351e+06 7.115555e+05 1.302635e+06 7.912398e+05 9.948912e+05 1.070380e+06 1.939533e+06 1.041739e+06 1.550168e+06 1.081109e+06 1.054159e+06 9.377523e+05 7.775130e+05 1.166552e+06 7.961605e+05 9.248975e+05 1.350639e+06 1.416476e+06 C11 H3 N8 O P_6.556 1.736123e+06 1.973511e+06 2.281788e+06 1.641834e+06 3.822509e+05 2.713699e+06 3.707599e+06 3.564937e+06 213203.19 1.807636e+06 2.434285e+06 3.076647e+06 235078.49 1.754456e+06 2.540660e+06 3.165582e+06 2.538823e+05 1.630283e+06 2.410791e+06 2.639231e+06 1.893646e+05 1.965115e+06 3.074366e+06 3.222432e+06 24683.392 2.005856e+06 2.341403e+06 2.975453e+06 2.212996e+04 2.150942e+06 2.889425e+06 2.579764e+06 133803.18 1.578423e+06 2.912282e+06 3.172688e+06 1.525228e+05 1.942205e+06 2.617789e+06 3.339866e+06 1.434498e+05 1.583406e+06 2.627624e+06 3.508098e+06 1.348683e+05 1.461396e+06 2.094260e+06 3.011794e+06 1.250584e+06 1.201150e+06 5.808758e+05 1.341637e+06 1.521431e+06 1.339491e+06 2.624370e+06 1.750056e+06 2.020641e+06 1.828692e+06 1.769575e+06 1.478643e+06 1.819794e+06 3.711271e+06 1.159071e+06 1.952935e+06 1.277072e+06 3.760260e+05 1.435591e+06 1.185768e+06 1.327781e+06 1.439193e+06 2.847730e+06 1.425693e+06 1.201912e+06 1.094838e+06 2.033336e+06 1.837049e+06 1.376295e+06 6.442368e+05 2.103715e+06 1.266045e+06 1.390238e+06 1.780113e+06 7.335892e+05 8.087396e+05 7.459020e+05 9.285629e+05 1.014443e+06 1.154469e+06 8.245357e+05 1.830505e+06 9.264908e+05 8.034359e+05 8.143294e+05 1.066606e+06 2.362545e+06 1.005403e+06 1.705697e+06 1.806384e+06 1.805938e+06 9.480542e+05 9.404937e+05 1.888439e+06 6.876178e+05 1.728868e+06 1.025461e+06 7.283520e+05 1.498734e+06 1.283086e+06 1.967053e+06 1.116814e+06 4.716686e+05 1.004132e+06 1.140975e+06 5.233433e+05 1.792183e+06 6.923353e+05 9.532579e+05 1.845702e+06 1.165596e+06 1.485253e+06 1.136314e+06 1.508738e+06 6.552077e+05 8.789462e+05 8.838097e+05 9.144710e+05 9.583386e+05 4.451491e+05 2.083849e+06 1.575470e+06 1.557916e+06 1.599952e+06 5.464083e+05 1.300111e+06 1.345688e+06 9.666870e+05 6.140193e+05 1.583410e+06 7.326326e+05 1.320116e+06 1.600389e+06 1.006884e+06 7.615826e+05 2.630314e+06 2.182127e+06 1.589171e+06 1.393999e+06 2.676398e+06 1.527127e+06 5.333040e+05 5.716891e+05 1.689099e+06 1.253295e+06 4.564585e+06 9.002314e+05 1.395657e+06 9.439850e+05 5.905121e+05 8.520853e+05 1.973381e+06 5.178735e+05 3.426910e+06 1.356598e+06 8.655189e+05 7.615399e+05 1.194107e+06 1.047750e+06 1.405221e+06 1.269760e+06 9.292596e+05 1.062750e+06 6.350856e+05 1.166738e+06 8.589197e+05 1.435467e+06 1.170174e+06 1.208581e+06 1.166583e+06 1.357775e+06 1.062603e+06 8.349774e+05 6.815508e+05 8.638397e+05 2.687534e+06 2.977053e+05 8.012828e+05 5.029365e+05 6.640646e+05 7.220192e+05 1.029691e+06 1.046335e+06 6.301130e+05 2.851344e+05 1.286172e+06 7.331419e+05 2.363471e+06 4.090330e+06 8.470084e+05 1.380770e+06 6.159871e+05 2.880448e+06 1.182519e+06 6.436033e+05 1.362814e+06 1.588319e+06 2.241437e+06 2.380730e+06 8.644758e+05 6.830900e+05 9.797935e+05 7.125392e+05 5.795855e+05 1.466623e+06 1.010493e+06 3.674575e+05 2.760513e+06 5.429218e+05 4.625394e+05 2.319595e+06 1.721272e+06 8.310594e+05 1.417239e+06 1.181627e+06 7.651337e+05 7.797440e+05 7.765341e+05 5.121470e+05 5.274337e+05 1.255297e+06 1.243149e+06 1.686872e+06 5.253376e+05 5.799190e+05 1.096655e+06 5.791979e+05 9.314548e+05 1.184057e+06 2.037176e+06 5.273484e+05 1.762457e+06 2.076025e+06 1.124988e+06 7.326945e+05 1.475469e+06 1.387997e+06 6.947567e+05 1.271967e+06 7.948458e+05 9.871248e+05 1.084275e+06 1.972679e+06 1.035722e+06 1.573060e+06 1.094586e+06 1.065351e+06 9.397896e+05 7.865222e+05 1.186052e+06 8.022471e+05 9.400934e+05 1.335749e+06 1.426135e+06 ALLANTOIN 1.754257e+06 1.675387e+06 2.333058e+06 1.934339e+06 2.882292e+05 2.143108e+06 2.939258e+06 3.004501e+06 169466.05 1.722103e+06 2.331459e+06 2.909402e+06 185565.83 1.503553e+06 2.390371e+06 2.562950e+06 2.101460e+05 1.463132e+06 2.065832e+06 2.707959e+06 1.640558e+05 1.614266e+06 2.772559e+06 2.984821e+06 22284.037 1.652155e+06 2.170412e+06 2.770132e+06 2.160104e+04 1.505403e+06 2.688947e+06 2.491781e+06 127307.66 1.320992e+06 2.518908e+06 2.707149e+06 1.398769e+05 1.826785e+06 2.633388e+06 2.946270e+06 1.343597e+05 1.239385e+06 2.265465e+06 2.974634e+06 1.338991e+05 1.554899e+06 2.090497e+06 2.495265e+06 1.136154e+06 9.548999e+05 5.796417e+05 1.105601e+06 1.096852e+06 1.271356e+06 2.220363e+06 1.902101e+06 1.793240e+06 1.698861e+06 1.532743e+06 1.638621e+06 1.879729e+06 3.730015e+06 1.553197e+06 1.509712e+06 9.076775e+05 4.184642e+05 1.261640e+06 9.006203e+05 1.108074e+06 1.008764e+06 2.253396e+06 1.141176e+06 1.292795e+06 9.072505e+05 2.036727e+06 1.851000e+06 1.671654e+06 6.752325e+05 2.130570e+06 9.486583e+05 1.652340e+06 1.730760e+06 5.859524e+05 8.318178e+05 5.954543e+05 7.786777e+05 1.063148e+06 7.502188e+05 6.429948e+05 1.863048e+06 9.430684e+05 6.637131e+05 1.200911e+06 9.546939e+05 2.034411e+06 8.780815e+05 1.310988e+06 1.555051e+06 1.316250e+06 7.783227e+05 1.022150e+06 1.590413e+06 5.551875e+05 1.377871e+06 6.784115e+05 7.068052e+05 1.366215e+06 1.247023e+06 1.541922e+06 9.824186e+05 4.725156e+05 9.421648e+05 1.059084e+06 6.217868e+05 1.536065e+06 6.074515e+05 6.534356e+05 1.724962e+06 1.215580e+06 1.241229e+06 5.508980e+05 1.345003e+06 6.609227e+05 1.004321e+06 7.427979e+05 6.026341e+05 7.064111e+05 5.076323e+05 2.058515e+06 1.568766e+06 1.199336e+06 1.211007e+06 6.247952e+05 1.249637e+06 9.778499e+05 9.494204e+05 5.934474e+05 1.221386e+06 7.914429e+05 1.335714e+06 1.271678e+06 1.155910e+06 8.452983e+05 2.384313e+06 1.918036e+06 1.609525e+06 9.709029e+05 2.257724e+06 1.321801e+06 4.597654e+05 6.180124e+05 1.206348e+06 1.046534e+06 3.878890e+06 8.441646e+05 1.268845e+06 8.205508e+05 7.991323e+05 7.030009e+05 1.819599e+06 4.800148e+05 3.154924e+06 1.255535e+06 8.622247e+05 6.004389e+05 9.426663e+05 7.563117e+05 1.170491e+06 7.910812e+05 6.555966e+05 1.013295e+06 6.460520e+05 9.107456e+05 6.476170e+05 1.042255e+06 9.955766e+05 1.051818e+06 7.726375e+05 1.184086e+06 9.571035e+05 7.653855e+05 6.722648e+05 6.669144e+05 2.478416e+06 2.502394e+05 5.666890e+05 6.620846e+05 4.275365e+05 7.756744e+05 7.813323e+05 9.751980e+05 4.834172e+05 5.697592e+05 1.327652e+06 5.846976e+05 2.116488e+06 4.230979e+06 9.764244e+05 1.215489e+06 5.523711e+05 2.669995e+06 9.358758e+05 7.628050e+05 1.558159e+06 1.627155e+06 2.005364e+06 2.681220e+06 9.319693e+05 4.925101e+05 8.816549e+05 6.111863e+05 5.276250e+05 1.114654e+06 7.708484e+05 5.373685e+05 2.170466e+06 4.721987e+05 3.207828e+05 2.168338e+06 1.384783e+06 8.391020e+05 1.285583e+06 9.980016e+05 6.046505e+05 7.809652e+05 7.040023e+05 4.561684e+05 6.357322e+05 1.096104e+06 1.247573e+06 1.827426e+06 4.362090e+05 5.713656e+05 9.212982e+05 5.514714e+05 5.690518e+05 1.168978e+06 1.539029e+06 6.513467e+05 1.259482e+06 1.839731e+06 1.251837e+06 8.469450e+05 1.803033e+06 1.444720e+06 7.068235e+05 1.255836e+06 6.237738e+05 1.006112e+06 1.074113e+06 2.035747e+06 9.210855e+05 1.279251e+06 7.891031e+05 1.064892e+06 6.171242e+05 4.971791e+05 1.204609e+06 6.684692e+05 6.726645e+05 1.072771e+06 1.246876e+06 C5 H2 N3 O5 P_6.575 7.108879e+06 1.497736e+06 5.513049e+06 3.320033e+06 7.382684e+05 1.087337e+07 8.871523e+05 3.567266e+06 391877.65 5.874678e+06 1.019595e+07 3.606187e+06 1948614.25 5.353224e+06 3.036266e+06 4.509731e+06 6.253565e+06 2.301508e+06 6.591395e+06 4.314845e+06 3.965189e+05 6.093679e+06 2.585526e+06 4.128133e+06 327868.432 7.706362e+06 2.031663e+06 8.274465e+06 2.373770e+05 5.119752e+06 6.121019e+06 2.920698e+06 198577.80 2.627350e+06 4.940654e+06 5.865906e+06 1.013679e+06 3.804587e+06 7.477580e+06 4.466263e+06 2.394059e+05 5.325445e+06 3.921296e+06 7.489428e+06 1.262164e+06 3.841297e+05 2.485625e+07 6.259172e+06 2.141433e+07 2.380302e+06 1.889239e+07 3.436182e+06 1.016421e+06 2.411147e+06 4.211822e+06 4.097750e+05 1.925986e+07 3.840925e+06 3.197859e+06 5.723382e+06 2.379973e+06 1.480560e+06 2.409521e+07 1.461106e+07 5.481391e+05 1.657709e+06 4.080625e+06 1.662461e+06 1.212202e+06 2.250296e+06 4.315804e+06 5.434178e+05 2.590919e+06 2.057130e+07 1.442991e+06 2.114189e+06 2.391741e+07 2.330698e+06 2.173479e+06 2.335122e+06 3.398521e+06 5.576567e+06 1.324319e+07 2.564009e+07 1.790123e+06 1.630912e+06 1.832634e+07 6.615337e+06 5.646195e+06 9.663234e+05 1.408225e+06 4.762569e+05 6.489822e+05 1.938761e+06 4.871867e+06 4.038287e+06 3.678388e+06 6.096008e+05 2.422762e+07 4.565848e+05 2.863713e+06 1.254076e+07 1.803223e+05 1.659460e+06 2.135853e+06 3.435241e+05 2.396741e+06 7.927893e+05 2.321208e+06 1.397143e+05 6.996454e+05 1.981704e+06 2.381152e+06 1.012431e+06 2.377200e+06 3.141761e+07 2.140305e+06 3.291474e+05 2.212744e+05 1.300263e+07 3.647163e+06 3.422100e+05 1.955790e+05 9.962963e+06 2.354794e+06 2.590360e+06 2.319487e+07 5.784154e+06 1.638040e+06 2.079964e+06 2.099808e+06 4.991474e+06 1.799646e+07 6.410240e+05 8.482920e+06 2.975673e+06 1.470559e+06 1.176251e+07 4.671982e+05 4.306224e+06 4.029941e+06 2.460541e+06 1.794201e+06 1.443690e+06 2.369451e+07 3.757977e+06 4.973416e+06 2.929654e+06 6.318508e+05 2.162443e+06 1.161251e+06 2.658958e+06 1.711862e+07 4.447780e+06 3.606027e+05 3.109589e+06 1.581668e+07 1.882057e+07 2.083979e+06 5.804600e+05 1.834356e+06 1.508747e+06 2.303902e+05 3.123947e+05 3.728786e+06 1.469886e+06 1.498915e+06 2.604409e+05 2.423986e+06 2.915312e+06 1.947078e+07 1.846771e+07 1.802057e+06 9.827076e+05 3.323667e+06 2.968581e+06 6.177881e+05 1.746638e+07 2.184031e+06 1.278213e+06 9.889773e+06 8.411919e+06 7.680943e+06 1.939766e+07 7.195934e+06 4.866579e+06 8.831046e+06 1.003757e+07 6.076050e+06 1.341286e+07 8.947511e+06 9.483468e+06 5.755252e+06 5.295881e+06 1.901682e+07 4.546921e+06 1.189604e+07 5.131615e+06 2.100370e+06 9.764937e+06 1.681949e+07 1.256607e+07 2.301452e+05 4.722240e+06 6.451845e+06 1.863609e+07 5.780656e+06 8.173719e+06 6.516687e+06 1.056611e+07 8.001067e+06 7.339617e+06 5.650868e+06 4.878849e+06 1.321298e+07 7.477347e+06 1.309093e+07 3.123834e+06 5.567143e+06 5.441547e+06 9.136963e+06 1.937387e+06 2.704379e+06 7.589004e+06 6.450428e+06 8.445393e+06 5.854096e+06 8.147859e+06 9.178529e+06 1.491451e+07 7.396854e+06 8.969571e+06 1.445160e+06 6.025261e+06 3.596849e+06 7.633554e+06 9.258398e+06 6.118935e+06 1.087516e+07 1.055400e+06 1.591097e+06 2.268937e+06 1.634253e+06 2.493948e+07 1.971680e+06 2.123918e+07 1.072166e+07 2.795800e+05 2.388288e+07 2.406980e+07 1.865461e+06 1.187530e+06 1.604416e+07 4.267884e+06 2.605155e+06 3.245486e+06 1.946531e+06 1.524969e+07 2.387625e+07 2.982163e+06 2.466342e+06 2.449077e+07 C5 H4 O P2 S_6.609 2.464487e+08 2.720289e+08 3.617183e+08 2.615413e+08 3.360853e+06 2.604249e+08 5.161817e+08 3.530147e+08 3541427.76 5.774685e+07 3.652258e+08 2.388161e+08 6878026.92 3.866655e+08 1.503184e+08 2.031810e+08 2.630815e+07 6.083422e+08 3.193642e+08 2.119303e+08 4.172479e+06 2.705982e+08 2.631816e+08 3.095226e+08 3950000.350 4.572020e+08 2.264409e+08 3.346728e+08 3.036614e+06 3.487336e+08 2.071841e+08 4.127492e+07 2710311.95 5.715942e+08 2.354114e+08 4.461252e+08 6.804929e+06 3.854502e+08 1.664002e+08 4.311505e+08 7.989752e+06 1.794601e+08 2.180133e+08 3.075282e+08 3.112839e+07 3.612934e+08 3.356246e+08 2.919809e+08 8.591340e+08 2.451058e+08 8.293100e+08 2.264561e+08 6.224077e+08 1.298991e+08 2.614289e+08 2.251521e+08 7.903042e+08 5.034296e+07 1.287789e+08 1.367607e+07 2.674435e+08 1.128431e+07 2.470778e+08 5.553391e+08 7.474286e+08 7.856785e+08 2.370664e+08 4.113283e+08 8.907721e+08 7.356431e+08 2.592641e+08 9.758707e+07 5.948595e+08 7.982656e+08 9.694402e+07 6.360979e+08 2.055467e+08 5.483425e+06 8.805630e+08 6.603171e+08 2.597036e+08 2.199549e+08 5.240464e+08 4.916599e+08 1.095534e+08 2.671755e+08 5.855802e+08 2.952961e+08 6.900238e+08 3.849531e+08 2.130075e+08 3.269775e+08 6.289783e+08 3.296087e+08 6.238803e+08 1.887128e+08 6.674152e+08 7.842309e+08 1.727017e+07 3.959382e+08 4.344421e+08 1.522445e+08 7.754449e+08 2.457915e+07 2.025610e+08 7.534913e+08 6.402031e+08 6.018685e+08 5.665938e+08 7.610504e+08 4.000614e+07 3.645943e+08 2.729529e+08 5.973556e+08 2.275925e+08 4.810554e+08 2.526468e+07 4.751482e+08 3.215383e+08 3.008018e+08 1.740030e+08 6.795341e+08 4.593162e+08 4.101240e+07 8.036993e+08 5.808838e+08 3.419485e+08 2.458637e+08 1.341394e+08 2.891432e+08 2.227945e+08 1.322118e+08 7.279581e+06 5.915946e+07 3.344585e+08 2.355799e+08 5.987589e+08 5.734182e+08 9.350634e+07 6.958197e+08 5.653186e+08 5.364175e+08 1.338726e+08 6.669276e+08 4.161836e+08 1.508746e+08 1.980875e+08 7.842154e+08 4.093274e+08 1.490339e+08 3.638385e+08 6.521816e+08 4.208295e+08 4.222180e+08 3.264070e+07 4.860549e+08 4.659263e+08 3.461818e+08 2.879844e+08 3.774560e+08 1.044885e+08 2.310639e+08 3.679944e+08 1.134803e+08 1.052321e+08 7.858468e+07 2.392108e+08 2.383590e+08 8.314902e+08 6.115519e+08 3.690591e+08 4.964958e+08 4.911314e+08 6.887509e+08 6.488703e+08 2.460437e+08 3.343073e+08 1.037889e+07 2.550897e+08 2.783093e+08 2.185403e+08 3.250314e+08 3.650381e+08 2.551263e+08 2.410474e+08 3.763723e+08 2.980078e+08 2.985348e+08 3.226039e+08 3.827446e+08 2.883850e+08 3.836159e+08 2.375420e+08 3.947146e+08 3.338918e+08 5.551495e+08 5.182076e+08 2.085457e+08 1.991127e+08 3.787339e+08 3.020491e+08 2.616006e+08 1.148467e+08 1.986120e+08 2.624594e+08 3.487914e+08 2.969439e+08 3.014250e+08 2.739661e+08 3.109122e+08 2.268435e+08 1.997582e+08 2.591577e+08 2.766970e+08 2.450007e+08 3.345644e+08 6.594073e+08 3.178926e+08 2.868835e+08 2.432823e+08 3.911409e+08 1.800531e+08 1.918134e+08 1.759894e+08 4.235684e+08 4.030426e+08 2.345437e+08 1.178918e+07 3.108692e+08 3.264239e+08 1.881253e+08 3.716820e+08 1.815821e+08 2.627340e+08 2.281371e+08 3.091116e+08 3.419784e+08 2.361101e+08 3.625116e+08 3.394388e+08 2.051299e+08 1.797797e+08 7.465906e+08 1.985943e+08 2.653328e+07 3.146231e+07 1.223449e+08 1.172080e+08 1.134826e+08 1.934652e+08 1.064440e+07 2.042844e+07 4.265618e+08 4.981665e+08 4.529217e+08 5.904667e+08 2.839743e+08 2.499099e+08 2.905184e+08 3.569510e+08 7.151696e+08 2.723392e+08 C16 H16 N2 O5 S_6.614 9.583063e+05 8.849414e+05 6.506374e+05 6.984697e+05 3.720865e+05 8.684760e+05 9.063325e+05 8.758972e+05 319098.45 8.230729e+05 7.819097e+05 9.868584e+05 311118.53 6.714941e+05 7.402584e+05 8.200268e+05 3.375604e+05 7.732116e+05 8.089320e+05 7.865986e+05 3.024699e+05 7.550822e+05 9.236374e+05 8.316729e+05 50225.217 7.305347e+05 7.664256e+05 9.239282e+05 3.391862e+04 7.992868e+05 9.169674e+05 6.954843e+05 234407.78 7.307186e+05 7.799506e+05 8.350229e+05 2.484886e+05 9.023896e+05 7.993268e+05 9.336793e+05 2.438793e+05 5.667703e+05 8.468338e+05 9.181256e+05 2.243704e+05 8.110301e+05 6.387572e+05 9.084457e+05 1.876029e+05 2.082837e+05 1.891271e+05 2.568681e+05 2.487563e+05 2.492385e+05 2.455273e+05 2.338580e+05 2.205858e+05 2.306364e+05 2.133331e+05 1.849053e+05 2.233668e+05 2.582050e+05 2.783033e+05 2.304479e+05 2.140809e+05 1.936434e+05 2.505917e+05 1.706088e+05 2.028472e+05 1.890082e+05 1.776615e+05 6.302392e+07 1.985235e+08 2.288519e+05 1.939889e+05 2.159688e+05 2.468411e+05 2.001896e+05 2.335381e+05 2.722074e+05 2.096891e+05 1.998438e+05 1.889681e+05 2.201938e+05 1.737401e+05 1.979100e+05 1.919141e+05 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1.487400e+06 7.311974e+06 1.406405e+06 5.062062e+06 1.953057e+06 3.207636e+06 2.562968e+06 1.811934e+06 2.381737e+06 2.469501e+06 1.803241e+06 2.550670e+06 1.440947e+06 1.887402e+06 2.464020e+06 1.672151e+06 1.602300e+06 2.883464e+06 1.212172e+06 3.192049e+06 3.061218e+06 3.262549e+06 1.691497e+06 1.455013e+06 1.210395e+06 1.156483e+06 2.030544e+06 3.849482e+06 1.859001e+06 2.135335e+06 3.563288e+06 2.790045e+06 2.479715e+06 4.625691e+06 4.699750e+06 2.468044e+06 2.948326e+06 6.712475e+06 1.359035e+06 2.613381e+06 2.656625e+06 2.077394e+06 3.219506e+06 1.420497e+06 4.451859e+06 3.661656e+06 1.996516e+06 3.114365e+06 3.420567e+06 3.301432e+06 1.241960e+06 3.453626e+06 1.051092e+07 C17 H15 N7 O S_6.632 8.413228e+05 6.727926e+05 4.869887e+05 5.884725e+05 1.678646e+05 7.769567e+05 7.483185e+05 6.590825e+05 152173.03 6.602502e+05 6.704397e+05 7.307988e+05 151049.13 5.990484e+05 5.669955e+05 6.854431e+05 1.478172e+05 6.094138e+05 6.713467e+05 6.151989e+05 1.272902e+05 6.110720e+05 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2.025996e+08 4.946994e+05 1.682999e+08 3.079881e+08 2.080087e+08 408779.82 1.891604e+08 1.847047e+08 1.660364e+08 435298.51 1.980796e+08 2.192940e+08 1.891406e+08 4.155200e+05 1.838902e+08 1.926405e+08 1.797756e+08 1.051768e+06 2.079570e+08 2.335794e+08 2.149192e+08 601686.147 1.992226e+08 1.638971e+08 2.135285e+08 2.455811e+05 2.005983e+08 2.144332e+08 1.927986e+08 399014.35 1.634879e+08 2.096141e+08 2.004869e+08 4.865458e+05 2.057506e+08 2.160004e+08 2.182222e+08 2.666442e+05 1.591161e+08 1.885415e+08 2.288767e+08 3.386081e+05 1.905249e+08 1.869363e+08 2.062819e+08 1.405944e+08 1.840899e+08 1.682116e+08 2.857274e+08 2.850594e+08 2.701573e+08 2.345744e+08 3.355708e+08 1.930598e+08 1.653644e+08 2.941587e+08 1.678611e+08 2.327505e+08 4.289777e+08 3.444391e+08 1.978630e+08 1.707988e+08 1.655143e+08 2.355381e+08 3.100832e+08 1.562545e+08 1.445259e+08 2.476800e+08 2.699935e+08 1.433105e+08 1.783883e+08 3.123542e+08 2.088635e+08 2.133591e+08 1.275554e+08 2.485357e+08 2.817863e+08 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1.383351e+08 1.884695e+08 1.082556e+08 1.861256e+08 1.975574e+08 1.736418e+08 2.160787e+08 2.343596e+08 1.453631e+08 2.076863e+08 2.114491e+08 1.685977e+08 2.009296e+08 2.444026e+08 1.404628e+08 2.542304e+08 1.717535e+08 1.658316e+08 3.568130e+08 2.322391e+08 2.470556e+08 2.790972e+08 1.703174e+08 1.058213e+08 1.457001e+08 1.717151e+08 1.688613e+08 1.275917e+08 1.204549e+08 3.628880e+07 2.895458e+08 1.763598e+08 1.515604e+08 2.130806e+08 1.913897e+08 9.062512e+07 2.770756e+08 9.884847e+07 1.986576e+08 5.045413e+08 2.173045e+08 2.075082e+08 2.089639e+08 4.179707e+08 1.950131e+08 1.509275e+08 3.181480e+08 2.142668e+08 2.470097e+08 2.214886e+08 6.903660e+07 2.429588e+08 9.426501e+07 2.390389e+08 1.222306e+08 2.103405e+08 1.825332e+08 1.341020e+08 2.297991e+08 2.066592e+08 1.345802e+08 3.129922e+08 1.606131e+08 1.889398e+08 2.610514e+08 1.774379e+08 1.325500e+08 1.955845e+08 2.482233e+08 2.095367e+08 1.920392e+08 1.685118e+08 2.707023e+08 2.498941e+08 1.194448e+08 1.612724e+08 1.595410e+08 2.984978e+08 1.865729e+08 3.614319e+08 2.954188e+08 1.103325e+08 1.285904e+08 3.533673e+08 1.081629e+08 1.473178e+08 2.433759e+08 3.029145e+08 1.709413e+08 2.983673e+08 1.054091e+08 2.923654e+08 7.294736e+07 2.018051e+08 2.506382e+08 2.218346e+08 1.462313e+08 2.660825e+08 1.782900e+08 1.416022e+08 2.221041e+08 2.531139e+08 1.417999e+08 2.756015e+08 1.992852e+08 C15 H23 P S2_6.663 2.137418e+05 2.064384e+05 3.371190e+05 2.300108e+05 1.949551e+05 2.775836e+05 3.578825e+05 3.927666e+05 159117.18 2.971356e+05 2.003008e+05 4.046566e+05 171457.49 3.130046e+05 2.027735e+05 3.037000e+05 1.706191e+05 1.660208e+05 3.234062e+05 2.065026e+05 1.289603e+05 3.731945e+05 3.775828e+05 2.524740e+05 23125.322 3.268824e+05 2.010943e+05 3.833389e+05 1.511000e+04 2.427479e+05 3.855211e+05 2.875833e+05 110184.82 2.240428e+05 2.725168e+05 2.964319e+05 1.143912e+05 2.671299e+05 3.071403e+05 3.837848e+05 1.040038e+05 2.536418e+05 2.533035e+05 3.195974e+05 1.050754e+05 2.704385e+05 3.028416e+05 2.933385e+05 8.358759e+04 1.075160e+05 8.899416e+04 1.199517e+05 1.056669e+05 1.146435e+05 1.173900e+05 1.165406e+05 9.828128e+04 1.065031e+05 1.077092e+05 9.387903e+04 9.503107e+04 1.308171e+05 1.442290e+05 9.317946e+04 9.731175e+04 8.642846e+04 1.154724e+05 7.587492e+04 9.717692e+04 7.539688e+04 9.062254e+04 1.186215e+05 9.182515e+04 8.857176e+04 8.161468e+04 8.915420e+04 1.079021e+05 7.801730e+04 1.505996e+05 1.188590e+05 1.105649e+05 9.776369e+04 8.416405e+04 1.293464e+05 7.258913e+04 8.651200e+04 8.004166e+04 1.385405e+05 1.049596e+05 9.744133e+04 8.278267e+04 1.341038e+05 7.271475e+04 1.311128e+05 8.015676e+04 1.238038e+05 1.117258e+05 1.052429e+05 8.468640e+04 1.144438e+05 1.188879e+05 1.106301e+05 9.802549e+04 1.029414e+05 8.597697e+04 9.423623e+04 1.118496e+05 9.466350e+04 8.444781e+04 8.444084e+04 9.321972e+04 6.104495e+04 1.030708e+05 9.053856e+04 9.315051e+04 1.416394e+05 8.012806e+04 1.235974e+05 7.918444e+04 1.076440e+05 9.571197e+04 1.064998e+05 7.159382e+04 6.479386e+04 7.677834e+04 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7.963354e+04 1.749795e+06 1.750166e+06 6.000941e+05 2.333263e+06 1.171648e+06 1.803048e+06 1.680901e+06 7.945688e+05 8.999608e+05 1.733646e+06 1.423729e+06 8.570109e+05 1.491480e+06 9.695535e+05 6.849869e+05 9.461142e+05 1.760848e+06 1.754515e+06 2.039943e+06 5.246009e+05 1.045964e+06 9.582727e+05 8.032231e+05 1.656280e+06 1.433903e+06 1.118779e+06 2.791323e+06 1.214493e+06 6.768999e+05 1.715683e+06 1.495652e+06 7.057423e+05 9.259370e+05 2.667932e+06 1.558236e+06 2.283806e+06 1.110325e+05 1.091462e+05 9.819950e+04 9.903525e+04 1.279571e+05 1.202280e+05 8.366245e+04 9.320611e+04 6.527970e+04 1.280379e+05 1.260426e+05 1.424584e+05 9.276788e+04 1.134405e+05 1.028855e+05 1.320756e+05 1.122638e+05 1.004995e+05 9.210971e+04 1.194897e+05 9.464303e+04 1.019791e+05 1.264146e+05 C11 H19 N O6_6.716 2.667929e+06 7.520899e+05 5.905096e+05 6.057121e+05 2.063615e+05 6.576180e+05 7.648389e+05 7.574805e+05 162636.06 7.115453e+05 6.279008e+05 6.895036e+05 160798.45 6.492389e+05 6.870115e+05 6.186462e+05 1.485081e+05 8.353345e+05 4.626424e+05 6.184753e+05 1.155698e+05 6.616249e+05 7.898186e+05 8.463813e+05 22869.430 7.238497e+05 5.333632e+05 6.162265e+05 1.493201e+04 8.209646e+05 6.490768e+05 5.861084e+05 110009.29 5.655046e+05 7.803456e+05 5.969352e+05 1.080914e+05 6.712976e+05 9.161567e+05 8.333106e+05 9.022972e+04 4.377390e+05 6.262467e+05 8.618592e+05 9.695877e+04 4.879819e+05 6.184644e+05 7.698165e+05 5.033958e+05 6.759841e+05 5.329445e+05 6.790217e+05 1.150886e+06 9.296981e+05 1.058125e+06 6.458175e+05 1.405684e+06 1.518426e+06 9.162770e+05 1.394653e+06 9.621431e+05 1.402892e+06 9.198846e+05 1.107750e+06 7.402736e+05 4.908148e+05 9.591000e+05 8.757716e+05 6.307437e+05 9.435912e+05 1.011336e+06 7.685353e+05 7.950890e+05 5.474358e+05 8.102604e+05 1.264188e+06 6.589943e+05 7.344997e+05 1.689068e+06 1.020850e+06 1.180703e+06 7.371467e+05 4.112167e+05 5.648039e+05 5.036712e+05 7.336275e+05 2.476346e+05 7.323875e+05 6.649076e+05 5.596106e+05 7.943252e+05 6.142243e+05 6.016117e+05 7.819595e+05 4.449706e+05 9.063787e+05 7.779424e+05 6.877334e+05 4.965333e+05 7.633494e+05 3.864436e+05 6.939592e+05 7.853129e+05 5.413068e+05 4.187306e+05 5.121335e+05 6.013006e+05 7.699271e+05 9.371890e+05 9.598789e+05 6.116277e+05 6.979646e+05 7.209694e+05 6.204107e+05 5.770360e+05 1.225509e+06 5.729262e+05 5.489851e+05 9.156831e+05 5.749492e+05 2.790502e+05 3.304299e+05 2.741723e+05 7.967758e+05 7.511339e+05 5.750500e+05 7.557813e+05 3.213088e+05 8.055616e+05 1.284781e+06 1.177400e+06 8.994030e+05 7.012871e+05 4.352657e+05 5.837748e+05 4.964976e+05 8.024199e+05 1.042062e+06 4.446009e+05 6.634382e+05 3.072946e+05 1.325248e+06 9.839576e+05 9.259593e+05 5.767646e+05 6.471051e+05 4.461202e+05 1.465833e+06 1.472040e+06 2.315128e+05 2.068894e+05 6.298705e+05 6.407120e+05 6.851067e+05 5.530526e+05 9.650657e+05 1.471246e+06 3.917337e+05 5.170458e+05 6.859075e+05 6.902999e+05 1.111141e+06 3.472865e+05 6.626748e+05 4.261952e+05 7.220587e+05 1.370483e+06 9.783308e+05 6.480174e+05 6.598937e+05 1.222627e+06 8.203549e+05 6.820245e+05 8.980682e+05 5.282403e+05 5.813475e+05 6.159962e+05 6.769228e+05 9.795539e+05 6.582991e+05 3.354984e+05 5.828471e+05 5.090101e+05 4.273242e+05 3.233321e+05 2.017323e+05 5.676160e+05 5.154259e+05 4.949680e+05 1.458077e+06 6.610525e+05 7.964083e+05 2.306061e+05 4.572892e+05 2.790186e+05 7.082775e+05 1.017860e+06 9.674665e+05 5.166555e+05 1.175919e+06 2.070069e+06 5.825442e+05 4.800305e+05 6.939497e+05 4.279141e+05 4.474056e+05 4.795590e+05 7.469884e+05 7.178190e+05 2.097657e+05 6.793234e+05 7.131220e+05 7.756842e+05 6.384435e+05 6.284694e+05 7.809847e+05 5.657260e+05 8.190337e+05 5.314014e+05 3.594037e+05 1.449671e+06 6.059333e+05 6.217302e+05 7.235050e+05 6.978898e+05 6.227515e+05 4.565907e+05 6.377935e+05 1.008376e+06 7.882199e+05 1.079198e+06 3.628660e+05 1.170123e+06 6.901584e+05 3.038748e+05 4.859648e+05 7.703069e+05 7.232867e+05 4.469560e+05 7.023355e+05 5.894250e+05 6.341267e+05 7.133107e+05 9.783837e+05 6.035961e+05 5.562871e+05 5.858150e+05 3.667836e+05 1.138907e+06 8.876027e+05 5.552176e+05 6.863312e+05 8.077897e+05 9.786841e+05 1.088768e+06 7.307338e+05 5.458175e+05 9.364579e+05 8.425636e+05 3.433142e+05 1.507270e+06 9.952463e+05 C7 H11 N O2_6.716 1.567645e+06 3.334090e+05 5.188444e+05 3.408383e+05 1.882056e+05 3.412580e+05 3.594787e+05 6.105901e+05 148656.98 2.673834e+05 4.660650e+05 4.155544e+05 157804.12 3.620356e+05 3.252325e+05 3.398101e+05 1.579843e+05 4.616399e+05 2.863103e+05 3.665958e+05 1.220138e+05 4.505109e+05 4.627242e+05 4.916963e+05 35583.753 3.916632e+05 2.743834e+05 4.389637e+05 1.702211e+04 4.076728e+05 3.677045e+05 3.296471e+05 119396.69 3.476003e+05 4.977776e+05 4.042721e+05 1.233754e+05 4.047160e+05 4.620936e+05 4.623866e+05 1.100476e+05 2.675720e+05 2.894803e+05 5.802820e+05 1.023830e+05 2.916222e+05 3.082922e+05 4.774282e+05 6.921064e+04 2.451569e+05 1.045328e+05 9.195829e+05 1.264280e+05 5.784576e+05 1.242691e+06 3.239401e+05 5.042383e+05 1.079721e+06 1.375485e+06 1.226164e+05 3.711728e+05 1.917556e+05 6.642469e+05 1.080006e+05 8.010310e+04 8.824796e+04 1.190963e+05 1.129076e+05 6.903884e+04 1.962228e+05 1.037667e+05 2.756036e+05 8.583460e+05 9.865190e+04 9.225751e+04 2.851305e+05 3.537414e+05 7.462755e+04 1.540148e+05 1.918955e+05 8.259652e+04 2.379656e+05 9.431350e+04 8.870254e+04 2.511713e+05 1.398616e+06 1.121342e+05 1.094653e+05 5.864993e+05 1.726786e+05 1.602880e+05 1.070353e+05 1.292409e+05 9.625260e+04 7.321953e+05 9.795061e+04 8.267513e+04 1.347515e+05 3.566857e+05 9.106774e+04 1.157686e+05 1.340285e+05 9.290334e+04 1.615777e+05 5.981405e+04 8.102211e+04 2.200097e+06 1.109628e+05 1.460936e+07 4.161526e+05 3.672730e+05 6.012211e+05 8.151802e+05 3.067003e+05 5.426842e+05 8.075894e+04 6.068709e+04 3.439534e+05 3.683121e+05 1.182295e+05 1.982006e+05 1.006457e+05 2.345055e+05 2.368321e+05 3.314755e+05 2.623257e+05 2.050620e+05 6.490692e+04 7.905937e+04 1.306414e+05 1.527295e+05 5.492777e+05 9.582889e+04 2.657676e+05 1.076508e+05 2.749994e+05 5.697364e+05 1.068331e+05 1.307149e+05 2.046042e+05 1.210163e+05 1.010064e+06 3.551118e+05 1.055318e+05 6.917654e+05 8.642674e+04 5.282146e+05 2.269346e+05 3.189382e+05 3.183342e+05 1.108580e+05 1.360800e+05 1.427422e+05 3.506242e+05 5.616670e+04 1.521337e+05 4.337191e+05 6.790617e+04 3.665115e+05 9.869758e+04 1.670067e+05 4.606592e+05 4.116113e+05 6.284755e+04 2.964890e+05 3.019366e+05 1.209374e+05 3.173300e+05 1.350257e+06 7.329469e+05 1.120009e+05 1.036079e+05 4.151429e+05 1.505394e+05 7.239177e+05 9.892463e+05 8.015700e+04 8.285871e+04 1.322184e+05 2.501493e+05 1.827151e+05 9.208958e+04 7.855261e+04 2.513559e+05 1.261172e+05 6.697380e+04 9.934342e+04 5.214737e+05 3.147757e+05 8.288260e+04 6.729479e+05 3.416784e+05 7.047086e+04 1.686358e+05 1.918459e+05 2.395452e+06 9.711802e+05 3.425971e+05 1.769976e+05 1.065943e+05 2.606473e+06 5.607672e+05 8.595696e+05 1.100981e+06 4.335396e+05 2.848396e+05 3.373288e+05 1.213290e+06 1.030146e+05 2.011082e+05 1.249091e+06 1.362341e+06 2.196939e+05 1.380657e+06 5.285031e+04 2.247215e+05 7.026662e+04 1.804528e+05 7.619430e+04 4.468151e+05 8.152880e+04 5.257779e+05 2.182889e+05 8.403265e+04 8.251653e+04 1.378730e+05 4.293514e+05 1.167112e+05 3.733754e+05 1.123768e+05 1.539363e+06 1.634880e+05 7.282230e+04 3.830694e+05 4.053361e+05 6.953206e+04 3.323648e+05 7.843625e+05 6.970412e+05 1.070402e+06 7.625084e+05 6.851330e+04 7.335339e+05 2.404535e+05 9.965054e+05 1.186874e+06 5.312501e+05 4.131233e+05 2.380818e+05 1.370657e+05 7.035538e+05 3.421702e+05 1.344744e+05 1.379042e+06 1.728359e+05 4.361046e+05 9.326290e+04 2.513103e+05 1.531020e+05 4.541264e+05 1.594680e+05 1.389107e+05 TRYPTOPHAN 1.049822e+09 4.770359e+08 4.776492e+08 5.448790e+08 5.622015e+05 5.328041e+08 6.228452e+08 5.419486e+08 533206.27 5.357503e+08 4.760610e+08 6.373915e+08 457425.88 4.743012e+08 5.128910e+08 5.103644e+08 4.478417e+05 5.718641e+08 4.398951e+08 4.850478e+08 3.768181e+05 5.445733e+08 6.102412e+08 5.960489e+08 109896.873 5.194724e+08 4.264273e+08 5.612021e+08 5.464873e+04 5.520199e+08 5.748461e+08 4.974171e+08 345156.60 4.544606e+08 5.427870e+08 5.376172e+08 3.426435e+05 5.370057e+08 5.884757e+08 6.012556e+08 3.223014e+05 4.037115e+08 5.122133e+08 6.107468e+08 3.304908e+05 4.841924e+08 4.840735e+08 5.674892e+08 4.707766e+08 4.660970e+08 4.372955e+08 8.581884e+08 6.362133e+08 6.604544e+08 6.999552e+08 8.955432e+08 5.316338e+08 6.958679e+08 8.408306e+08 4.254476e+08 6.804461e+08 9.692518e+08 7.237597e+08 5.966881e+08 5.665458e+08 4.124454e+08 5.661269e+08 3.705202e+08 2.589527e+08 6.102278e+08 5.094256e+08 7.324016e+08 5.778004e+08 5.683379e+08 6.441531e+08 6.677204e+08 6.274118e+08 5.218081e+08 1.312323e+09 7.314118e+08 5.297984e+08 4.907337e+08 2.633294e+08 6.179923e+08 3.857015e+08 5.813716e+08 5.294150e+08 4.867698e+08 6.604462e+08 7.267330e+08 5.317299e+08 6.633873e+08 4.319221e+08 5.361663e+08 3.619760e+08 6.817275e+08 6.344939e+08 6.265127e+08 3.499371e+08 7.064950e+08 5.520517e+08 1.064755e+09 6.136867e+08 4.485949e+08 3.202690e+08 5.173106e+08 5.092342e+08 4.001393e+08 5.827177e+08 7.034369e+08 3.865998e+08 5.224350e+08 6.872305e+08 5.637109e+08 4.102035e+08 5.419630e+08 5.478906e+08 6.106139e+08 5.847918e+08 4.891811e+08 3.553742e+08 4.204353e+08 2.509712e+08 3.878501e+08 4.966669e+08 3.303795e+08 4.508373e+08 4.578453e+08 2.712902e+08 7.395520e+08 9.377077e+08 8.846525e+08 5.193265e+08 5.721237e+08 5.585145e+08 3.445820e+08 5.712823e+08 6.150914e+08 3.890062e+08 7.195929e+08 4.828826e+08 6.161539e+08 6.964088e+08 5.241079e+08 6.381440e+08 6.087866e+08 5.679222e+08 6.469128e+08 6.065132e+08 3.813190e+08 3.593532e+08 5.106006e+08 4.826923e+08 4.515821e+08 1.840087e+08 5.881735e+08 7.231136e+08 4.215593e+08 5.818795e+08 1.806603e+08 1.958171e+08 7.206770e+08 2.008176e+08 5.188198e+08 5.040340e+08 5.019451e+08 5.552089e+08 6.709192e+08 4.562453e+08 6.222750e+08 7.494991e+08 7.324917e+08 7.709570e+08 5.920498e+08 3.832701e+08 4.905641e+08 6.328061e+08 5.607473e+08 5.682405e+08 6.019077e+08 2.395583e+08 4.807435e+08 5.113868e+08 4.458930e+08 1.711447e+08 3.740873e+08 5.526630e+08 5.301025e+08 4.913768e+08 5.520948e+08 4.579623e+08 5.861734e+08 2.350186e+08 5.186193e+08 3.134434e+08 4.487413e+08 5.746120e+08 6.833013e+08 4.773091e+08 6.303327e+08 9.248082e+08 4.588164e+08 3.698522e+08 4.519451e+08 4.722634e+08 4.946588e+08 1.825276e+08 3.578669e+08 6.168134e+08 3.612460e+08 6.211501e+08 2.019589e+08 5.916700e+08 4.740701e+08 4.385747e+08 5.354227e+08 3.546133e+08 4.243994e+08 4.786519e+08 4.322132e+08 6.244586e+08 5.958167e+08 4.797596e+08 4.220320e+08 4.932403e+08 3.407919e+08 5.172080e+08 4.999079e+08 6.440338e+08 5.238921e+08 5.975514e+08 6.087949e+08 4.257526e+08 4.546590e+08 6.002558e+08 3.829310e+08 5.607237e+08 7.865090e+08 3.406947e+08 6.586484e+08 1.005317e+09 4.833456e+08 3.700970e+08 6.447849e+08 4.564866e+08 3.413554e+08 2.765031e+08 4.024423e+08 6.318880e+08 6.267375e+08 4.666620e+08 5.734777e+08 6.162005e+08 9.494651e+08 7.741506e+08 4.049505e+08 6.124366e+08 7.135017e+08 7.031629e+08 4.261053e+08 6.250523e+08 8.579053e+08 C9 H9 N_6.73 3.095772e+06 1.447439e+06 1.549070e+06 1.500869e+06 1.944442e+05 1.421476e+06 1.834396e+06 1.608782e+06 200885.98 1.531865e+06 1.499281e+06 1.813522e+06 167723.68 1.481241e+06 1.346723e+06 1.362605e+06 1.602910e+05 1.730952e+06 1.296312e+06 1.475360e+06 1.240477e+05 1.612281e+06 1.908664e+06 1.662120e+06 36783.577 1.507804e+06 1.177645e+06 1.750263e+06 1.708839e+04 1.585301e+06 1.735228e+06 1.370682e+06 121815.72 1.234544e+06 1.617566e+06 1.628486e+06 1.221242e+05 1.588061e+06 1.728440e+06 1.728735e+06 1.123157e+05 1.119856e+06 1.575963e+06 1.827574e+06 1.150405e+05 1.412844e+06 1.343327e+06 1.688141e+06 1.355966e+06 1.380010e+06 1.202820e+06 2.644473e+06 1.843151e+06 1.890588e+06 1.914821e+06 2.548235e+06 1.422089e+06 2.126556e+06 2.451135e+06 1.139621e+06 2.024677e+06 1.751182e+06 2.235372e+06 1.759852e+06 1.534650e+06 1.239365e+06 1.687622e+06 1.089660e+06 1.622747e+06 1.511372e+06 1.507283e+06 2.081459e+06 1.592050e+06 1.625758e+06 1.994742e+06 1.916948e+06 1.880165e+06 1.464903e+06 3.897304e+06 2.080583e+06 1.507784e+06 1.479115e+06 7.013307e+05 1.832418e+06 1.006061e+06 1.796995e+06 1.549197e+06 1.412593e+06 1.523818e+06 1.999336e+06 1.594781e+06 2.055913e+06 1.263617e+06 1.531913e+06 1.019717e+06 2.140040e+06 1.808127e+06 1.753052e+06 9.587306e+05 2.237237e+06 1.732436e+06 3.277937e+06 1.810112e+06 1.295089e+06 8.672061e+05 1.378411e+06 1.429418e+06 1.068069e+06 1.629148e+06 2.010733e+06 1.132833e+06 1.395029e+06 1.993359e+06 1.521059e+06 1.295651e+06 1.574620e+06 1.448179e+06 1.692274e+06 1.576363e+06 1.303620e+06 8.454361e+05 1.240429e+06 6.729980e+05 1.112134e+06 1.392033e+06 9.066875e+05 1.314500e+06 1.276627e+06 1.764582e+06 2.172943e+06 2.641036e+06 2.755955e+06 1.494793e+06 1.588841e+06 1.643578e+06 9.653795e+05 1.601431e+06 1.682455e+06 9.610646e+05 2.053305e+06 1.338791e+06 1.726879e+06 2.147068e+06 1.474494e+06 1.791327e+06 1.878625e+06 1.553704e+06 2.082871e+06 1.837534e+06 9.975468e+05 9.757488e+05 1.541037e+06 1.746521e+06 1.272533e+06 1.092715e+06 1.628311e+06 2.428542e+06 1.270536e+06 1.603414e+06 1.209530e+06 1.355862e+06 2.125221e+06 1.201343e+06 1.426446e+06 1.566413e+06 1.503389e+06 1.692639e+06 2.039578e+06 1.320533e+06 1.779708e+06 2.162189e+06 2.237941e+06 2.236973e+06 1.597501e+06 1.014433e+06 1.545635e+06 1.887839e+06 1.691069e+06 1.700517e+06 1.683653e+06 6.166084e+05 1.388687e+06 1.369641e+06 1.382698e+06 1.731562e+06 1.170393e+06 1.740022e+06 1.483382e+06 1.428539e+06 1.554338e+06 1.282594e+06 1.808874e+06 6.144106e+05 1.441380e+06 8.140345e+05 1.172556e+06 1.771545e+06 2.141957e+06 1.283091e+06 1.886393e+06 2.534049e+06 1.240679e+06 1.113002e+06 1.385859e+06 2.182058e+06 1.372728e+06 1.087888e+06 9.161411e+05 1.834477e+06 1.027852e+06 1.929844e+06 1.244338e+06 1.681389e+06 1.324887e+06 1.278229e+06 1.680213e+06 9.305298e+05 1.281383e+06 1.296219e+06 1.182301e+06 1.739641e+06 1.959686e+06 1.450034e+06 1.185538e+06 1.370135e+06 9.581893e+05 1.645460e+06 1.541359e+06 1.939784e+06 1.481673e+06 1.570428e+06 1.754029e+06 1.231676e+06 1.313691e+06 1.815524e+06 9.202770e+05 1.523658e+06 2.227936e+06 9.541790e+05 1.594808e+06 2.716137e+06 1.344311e+06 1.044651e+06 2.164073e+06 1.291717e+06 1.148765e+06 1.835193e+06 1.251173e+06 1.755063e+06 1.855527e+06 1.412359e+06 1.737712e+06 1.882665e+06 2.843436e+06 2.371202e+06 1.171224e+06 1.787734e+06 2.145764e+06 2.077124e+06 1.173166e+06 1.919433e+06 2.657216e+06 C10 H9 N_6.731 3.304922e+06 1.492638e+06 1.722317e+06 1.403648e+06 2.038597e+05 1.547574e+06 1.911485e+06 1.676369e+06 213202.11 1.586942e+06 1.790066e+06 1.759032e+06 181525.17 1.292708e+06 1.403724e+06 1.741592e+06 1.713750e+05 1.784429e+06 1.350606e+06 1.490279e+06 1.380479e+05 1.612915e+06 2.001481e+06 1.699623e+06 40801.898 1.498941e+06 1.374767e+06 1.735371e+06 1.830872e+04 1.783199e+06 1.692799e+06 1.497362e+06 128305.19 1.277235e+06 1.639934e+06 1.654307e+06 1.276100e+05 1.688056e+06 1.975367e+06 1.845906e+06 1.218385e+05 1.195255e+06 1.299086e+06 1.884754e+06 1.247034e+05 1.548891e+06 1.502505e+06 1.738842e+06 1.437233e+06 1.369955e+06 1.197598e+06 2.303258e+06 2.114460e+06 2.091835e+06 2.044324e+06 2.623864e+06 1.780016e+06 2.204985e+06 2.517223e+06 1.240504e+06 2.154392e+06 2.793814e+06 2.264489e+06 1.892966e+06 1.752418e+06 1.297533e+06 1.800621e+06 1.163612e+06 1.688591e+06 1.868470e+06 1.729606e+06 2.212209e+06 1.552382e+06 1.796574e+06 2.081302e+06 2.014244e+06 2.040283e+06 1.511816e+06 4.303520e+06 2.153657e+06 1.771144e+06 1.433447e+06 7.046733e+05 1.869512e+06 1.117993e+06 1.741326e+06 1.643301e+06 1.575263e+06 2.048305e+06 2.280207e+06 1.744085e+06 2.201925e+06 1.285630e+06 1.525355e+06 9.798667e+05 2.036138e+06 1.869225e+06 1.921054e+06 9.723347e+05 2.245781e+06 1.696376e+06 3.419695e+06 1.871288e+06 1.450335e+06 1.038295e+06 1.527196e+06 1.439837e+06 1.303069e+06 1.861721e+06 2.020905e+06 1.114500e+06 1.580350e+06 2.339850e+06 1.940726e+06 1.326992e+06 1.525519e+06 1.687500e+06 2.054616e+06 1.799827e+06 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1.873754e+06 2.131340e+06 1.373179e+06 1.974851e+06 3.041781e+06 1.282544e+06 1.086169e+06 1.488034e+06 1.376959e+06 1.439783e+06 1.158794e+06 1.107947e+06 2.117493e+06 1.109512e+06 1.849705e+06 1.339163e+06 1.864774e+06 1.407763e+06 1.311155e+06 1.684912e+06 1.207381e+06 1.322128e+06 1.433439e+06 1.308500e+06 2.359833e+06 1.919998e+06 1.383578e+06 1.289529e+06 1.474130e+06 9.284345e+05 1.672419e+06 1.676916e+06 2.004867e+06 1.645427e+06 1.801743e+06 2.018446e+06 1.269051e+06 1.473398e+06 1.947259e+06 1.087009e+06 1.683637e+06 2.395593e+06 1.050952e+06 1.759163e+06 3.256802e+06 1.333017e+06 1.110993e+06 2.458209e+06 1.554380e+06 9.901920e+05 1.824216e+06 1.258255e+06 1.971834e+06 1.785695e+06 1.557754e+06 1.960207e+06 2.201953e+06 3.113106e+06 2.606475e+06 1.345905e+06 1.934344e+06 2.194860e+06 2.159469e+06 1.251341e+06 1.967576e+06 2.856857e+06 C9 H7 N O_6.731 6.312121e+06 3.172111e+06 3.833577e+06 4.027865e+06 1.935471e+05 3.856471e+06 3.092464e+06 4.261737e+06 222269.75 3.886225e+06 3.674138e+06 3.916140e+06 191982.06 3.560695e+06 3.764223e+06 3.554222e+06 1.885768e+05 3.441649e+06 3.299260e+06 3.583679e+06 1.476669e+05 3.762024e+06 4.322846e+06 4.590213e+06 46425.374 2.942301e+06 3.306743e+06 3.524395e+06 1.873661e+04 4.046605e+06 4.069845e+06 3.672909e+06 129206.68 3.292927e+06 3.701309e+06 3.479821e+06 1.345209e+05 3.665997e+06 4.091706e+06 3.894441e+06 1.213512e+05 3.474290e+06 3.663989e+06 4.035559e+06 1.271533e+05 3.567466e+06 3.106282e+06 4.110791e+06 3.308474e+06 3.745297e+06 2.848337e+06 5.632268e+06 4.137697e+06 4.124507e+06 5.186597e+06 6.040686e+06 3.560273e+06 5.506332e+06 6.641335e+06 3.375757e+06 5.103973e+06 7.131098e+06 5.844419e+06 4.269537e+06 3.486464e+06 2.845592e+06 4.264519e+06 2.233476e+06 3.920295e+06 3.827124e+06 3.112195e+06 3.984807e+06 3.565306e+06 3.747985e+06 4.711744e+06 4.544837e+06 4.619714e+06 3.666564e+06 9.827602e+06 4.850800e+06 4.065125e+06 3.630607e+06 1.761840e+06 4.789339e+06 3.069124e+06 4.216137e+06 3.508987e+06 3.586180e+06 4.549354e+06 4.856449e+06 3.792097e+06 4.921281e+06 2.692571e+06 4.916075e+06 2.331322e+06 5.091473e+06 4.093886e+06 4.250390e+06 2.257518e+06 5.485738e+06 4.811940e+06 7.473403e+06 4.050939e+06 2.963269e+06 2.181005e+06 3.027500e+06 3.459616e+06 2.958500e+06 3.800126e+06 4.739262e+06 2.569094e+06 3.562150e+06 4.119162e+06 3.838307e+06 3.073930e+06 3.062141e+06 4.057699e+06 3.972367e+06 3.521654e+06 3.345002e+06 2.135409e+06 2.552665e+06 1.548159e+06 3.080712e+06 3.214191e+06 2.084399e+06 2.668364e+06 3.029896e+06 4.548766e+06 5.778182e+06 6.506283e+06 6.626818e+06 3.570387e+06 3.984541e+06 4.353943e+06 2.730149e+06 4.041246e+06 4.103233e+06 2.706849e+06 4.917222e+06 3.175353e+06 4.227527e+06 5.061831e+06 3.650529e+06 4.545570e+06 4.102076e+06 3.759311e+06 4.458891e+06 4.903831e+06 3.162680e+06 2.633413e+06 3.460665e+06 4.208395e+06 3.096652e+06 2.727025e+06 4.353330e+06 5.240802e+06 3.052753e+06 3.915737e+06 3.061473e+06 3.529280e+06 5.034556e+06 2.376239e+06 3.408443e+06 3.228776e+06 3.820261e+06 3.729017e+06 4.568483e+06 2.994205e+06 4.236663e+06 4.772728e+06 4.996649e+06 5.119497e+06 3.777258e+06 2.425418e+06 4.050465e+06 4.560081e+06 3.543969e+06 4.290920e+06 4.707321e+06 1.433453e+06 3.029040e+06 3.880833e+06 3.253484e+06 2.594691e+06 2.654941e+06 4.045728e+06 3.642603e+06 3.504277e+06 3.531548e+06 2.988068e+06 5.587917e+06 1.589229e+06 3.456053e+06 2.026548e+06 3.005600e+06 3.347313e+06 4.733737e+06 3.327078e+06 4.933608e+06 6.706098e+06 3.099251e+06 2.709892e+06 3.214302e+06 2.212991e+06 3.816876e+06 2.605571e+06 2.159867e+06 4.091216e+06 2.697560e+06 4.241508e+06 3.431773e+06 4.152681e+06 3.382801e+06 3.253085e+06 4.037222e+06 2.395376e+06 2.797026e+06 3.546802e+06 3.025246e+06 4.819101e+06 4.520802e+06 4.004678e+06 2.901077e+06 3.353393e+06 2.456432e+06 3.147417e+06 3.316774e+06 4.804260e+06 3.799225e+06 3.980502e+06 3.564472e+06 2.881420e+06 3.445476e+06 4.240318e+06 2.507289e+06 3.568246e+06 5.250498e+06 2.392170e+06 3.851694e+06 7.344094e+06 3.235952e+06 2.380153e+06 5.730229e+06 3.577041e+06 2.285517e+06 4.628587e+06 3.189040e+06 4.469694e+06 5.209910e+06 3.669091e+06 3.992697e+06 5.092716e+06 7.013080e+06 4.951343e+06 3.152067e+06 4.034825e+06 4.902427e+06 5.295641e+06 2.826968e+06 4.026200e+06 7.197783e+06 C19 H15 Cl N10 O3 S_6.731 5.362039e+06 1.727892e+06 1.744318e+06 1.499541e+06 1.839227e+05 1.514886e+06 2.139983e+06 1.789458e+06 197572.27 1.620681e+06 1.726706e+06 1.821930e+06 162121.85 1.566288e+06 1.437752e+06 1.981078e+06 1.458429e+05 1.811547e+06 1.439947e+06 1.406279e+06 1.120261e+05 1.689009e+06 1.975740e+06 2.276128e+06 31506.904 1.524577e+06 1.279463e+06 1.769886e+06 1.482309e+04 1.956157e+06 1.848079e+06 1.493243e+06 110501.74 1.449702e+06 1.619096e+06 1.649607e+06 1.097711e+05 1.721821e+06 2.148580e+06 2.019940e+06 9.901063e+04 1.259162e+06 1.724209e+06 1.831845e+06 1.054433e+05 1.411286e+06 1.692495e+06 1.826961e+06 1.408296e+06 1.518581e+06 1.146518e+06 3.551754e+06 2.341784e+06 2.396057e+06 2.751039e+06 3.477235e+06 1.686759e+06 2.087377e+06 3.458553e+06 1.143679e+06 2.862443e+06 5.346402e+06 2.613297e+06 2.226644e+06 1.899146e+06 1.149987e+06 2.052123e+06 7.890589e+05 1.795757e+06 2.265779e+06 1.559759e+06 1.803781e+06 1.647723e+06 2.180811e+06 2.573946e+06 2.174918e+06 2.577663e+06 1.776387e+06 6.441244e+06 2.803118e+06 1.678834e+06 1.548475e+06 5.035397e+05 2.154222e+06 1.049241e+06 2.131897e+06 1.675501e+06 1.362303e+06 2.311512e+06 1.876412e+06 1.991854e+06 2.433874e+06 9.785685e+05 1.682141e+06 8.706125e+05 2.782196e+06 2.084722e+06 2.172630e+06 8.864678e+05 2.946498e+06 2.017343e+06 4.299733e+06 1.898765e+06 1.301821e+06 8.430110e+05 1.456280e+06 1.681928e+06 1.029304e+06 1.713442e+06 2.171821e+06 9.267374e+05 1.442065e+06 2.068861e+06 1.736723e+06 9.939189e+05 1.898824e+06 1.897957e+06 2.214332e+06 1.678393e+06 1.627987e+06 8.238952e+05 9.309201e+05 3.882815e+05 1.037760e+06 1.632903e+06 7.462839e+05 1.075058e+06 1.384075e+06 2.013187e+06 3.275236e+06 4.058305e+06 3.945892e+06 1.863012e+06 1.792531e+06 1.684781e+06 7.224952e+05 1.875775e+06 1.969843e+06 1.110561e+06 2.542179e+06 1.494611e+06 1.969576e+06 2.725248e+06 1.482952e+06 2.615435e+06 2.170777e+06 1.863001e+06 2.268809e+06 2.180263e+06 1.048855e+06 8.388017e+05 1.517139e+06 2.108435e+06 1.362867e+06 1.112899e+06 1.797878e+06 3.165455e+06 1.025857e+06 1.804425e+06 9.957395e+05 1.593224e+06 2.447611e+06 9.802362e+05 1.717853e+06 1.566779e+06 1.613603e+06 2.148511e+06 2.603944e+06 1.380315e+06 2.301203e+06 2.944817e+06 2.524900e+06 3.017066e+06 1.351914e+06 1.145064e+06 1.415748e+06 2.369000e+06 1.877966e+06 2.044079e+06 1.900941e+06 2.757631e+05 1.533273e+06 1.701405e+06 1.092132e+06 9.656839e+05 9.087215e+05 1.679672e+06 1.687789e+06 1.375283e+06 1.919185e+06 1.221662e+06 2.338664e+06 3.079453e+05 1.681421e+06 5.236743e+05 1.218460e+06 1.929396e+06 2.074929e+06 1.504706e+06 2.409507e+06 4.205126e+06 1.392450e+06 1.125295e+06 1.416852e+06 1.414196e+06 1.385103e+06 9.648954e+05 7.613607e+05 1.764056e+06 7.685111e+05 2.039633e+06 1.325425e+06 1.673819e+06 1.301348e+06 1.682024e+06 1.717971e+06 8.643230e+05 1.209969e+06 1.416200e+06 1.180767e+06 2.459908e+06 1.972728e+06 1.569697e+06 1.232466e+06 1.596772e+06 7.752838e+05 1.632279e+06 1.469841e+06 2.376688e+06 1.564867e+06 2.074826e+06 2.000573e+06 1.115942e+06 1.245025e+06 2.355445e+06 9.527669e+05 1.800590e+06 2.686719e+06 5.973496e+05 2.040413e+06 3.704312e+06 1.234033e+06 8.576785e+05 3.099493e+06 1.409683e+06 7.692606e+05 2.356836e+06 1.164996e+06 2.368246e+06 2.348990e+06 1.279014e+06 1.946711e+06 2.382271e+06 3.048527e+06 2.829411e+06 1.114385e+06 2.277659e+06 3.059793e+06 2.597283e+06 1.157095e+06 2.165347e+06 3.011724e+06 C9 H7 N_6.731 2.131222e+06 2.651444e+06 2.684648e+06 2.565618e+06 1.272502e+05 2.255168e+06 2.355545e+06 2.412505e+06 174329.32 2.615417e+06 2.672786e+06 2.476857e+06 158842.76 2.593506e+06 2.572664e+06 2.765863e+06 1.644198e+05 2.032375e+06 2.796859e+06 2.768593e+06 1.452388e+05 1.972950e+06 2.314874e+06 2.985263e+06 64912.724 2.298617e+06 3.227737e+06 1.826306e+06 1.750925e+04 2.203218e+06 2.197833e+06 3.409227e+06 116116.09 3.490235e+06 1.648571e+06 2.375740e+06 1.513952e+05 2.047274e+06 1.989869e+06 1.958172e+06 1.391926e+05 3.747070e+06 3.121714e+06 2.641373e+06 1.577964e+05 1.924857e+06 2.177538e+06 2.779858e+06 1.994636e+06 2.432023e+06 1.823450e+06 2.825525e+06 1.904586e+06 1.934767e+06 3.415480e+06 3.938016e+06 1.818040e+06 3.856530e+06 8.451775e+06 2.323076e+06 4.428592e+06 2.476685e+06 4.522284e+06 3.545732e+06 1.860482e+06 1.934409e+06 3.680622e+06 1.023798e+06 2.900346e+06 1.802295e+06 2.242425e+06 4.418578e+06 2.052854e+06 1.601505e+06 4.144225e+06 1.813565e+06 3.258432e+06 3.082783e+06 3.434051e+06 2.151476e+06 2.635328e+06 2.946514e+06 2.807029e+06 3.641624e+06 2.562362e+06 4.478774e+06 1.966254e+06 2.456415e+06 2.229416e+06 2.481491e+06 3.748314e+06 3.315509e+06 1.612275e+06 2.415070e+06 1.852824e+06 4.333912e+06 1.981350e+06 2.034521e+06 1.856079e+06 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4.676263e+06 1.836624e+06 3.388260e+06 2.350771e+06 8.517452e+05 2.172672e+06 2.209057e+06 2.226020e+06 2.555745e+06 1.543067e+06 2.972275e+06 2.279474e+06 2.205483e+06 1.817598e+06 1.566341e+06 3.107360e+06 6.747085e+05 1.493479e+06 9.898830e+05 2.264004e+06 1.782861e+06 2.001715e+06 3.687923e+06 3.085024e+06 2.093449e+06 1.294443e+06 4.840461e+06 2.254442e+06 2.387481e+06 2.845558e+06 1.454576e+06 1.590135e+06 2.085284e+06 1.623484e+06 1.834147e+06 2.625007e+06 2.129964e+06 1.398784e+06 2.931663e+06 2.851783e+06 1.680196e+06 1.423739e+06 2.819801e+06 3.011765e+06 2.857529e+06 3.119386e+06 4.044700e+06 3.520640e+06 1.941973e+06 1.612000e+06 1.537681e+06 3.068733e+06 3.336576e+06 2.567719e+06 2.899456e+06 2.160757e+06 3.103823e+06 2.696926e+06 4.274261e+06 3.684012e+06 2.678007e+06 2.399119e+06 1.784850e+06 2.354375e+06 6.167764e+06 1.939183e+06 1.175025e+06 2.668565e+06 2.056311e+06 1.282946e+06 4.498774e+06 2.653232e+06 3.526343e+06 3.797156e+06 2.202549e+06 1.197720e+06 3.037514e+06 3.261826e+06 3.845851e+06 2.558482e+06 3.054048e+06 2.638679e+06 3.957082e+06 1.323982e+06 2.035106e+06 4.392886e+06 C12 H7 Cl N2 O3 S_6.732 2.848271e+07 1.281683e+07 9.917696e+06 1.397680e+07 2.331365e+05 1.478380e+07 1.754057e+07 1.191170e+07 229079.73 1.451764e+07 1.302812e+07 1.750982e+07 191652.51 1.311217e+07 1.053400e+07 1.248168e+07 1.916871e+05 1.518677e+07 1.133185e+07 1.258471e+07 1.563183e+05 1.514436e+07 1.573217e+07 1.473955e+07 44923.346 1.333316e+07 1.132867e+07 1.431909e+07 2.050214e+04 1.522854e+07 1.496977e+07 1.036374e+07 145159.51 1.228999e+07 1.440050e+07 1.320068e+07 1.423290e+05 1.518596e+07 1.431890e+07 1.585910e+07 1.299604e+05 1.065869e+07 1.277452e+07 1.631195e+07 1.645268e+05 1.328240e+07 1.160144e+07 1.462146e+07 1.295446e+07 1.215973e+07 1.180916e+07 1.962610e+07 1.642718e+07 1.714379e+07 1.734655e+07 2.045412e+07 1.420141e+07 1.636787e+07 1.923699e+07 1.148494e+07 1.612037e+07 2.093996e+07 1.635020e+07 1.219817e+07 1.460590e+07 1.159858e+07 1.459496e+07 1.091413e+07 1.374945e+07 1.548891e+07 1.283641e+07 1.254621e+07 1.420076e+07 1.461877e+07 1.515071e+07 1.769159e+07 1.363993e+07 1.324969e+07 2.810529e+07 1.769436e+07 1.372518e+07 1.310172e+07 7.065011e+06 9.906069e+06 1.063905e+07 1.448004e+07 1.544739e+07 1.368586e+07 1.675096e+07 1.656774e+07 1.395421e+07 1.345541e+07 1.195942e+07 1.377388e+07 9.203651e+06 1.681722e+07 1.700400e+07 1.623863e+07 9.481165e+06 1.878631e+07 1.480949e+07 2.351715e+07 1.592439e+07 1.257137e+07 8.963621e+06 1.577662e+07 1.555810e+07 1.064009e+07 1.462688e+07 1.809428e+07 8.474796e+06 1.371937e+07 1.661476e+07 1.398635e+07 1.101459e+07 1.422613e+07 1.097530e+07 1.552094e+07 1.461883e+07 1.316530e+07 1.027574e+07 1.101200e+07 6.854727e+06 1.032516e+07 1.278655e+07 9.150592e+06 1.289690e+07 1.344551e+07 1.437224e+07 1.828723e+07 2.368131e+07 2.301813e+07 1.470876e+07 1.359802e+07 1.246021e+07 9.480381e+06 1.598353e+07 1.571638e+07 9.531232e+06 1.769596e+07 1.237976e+07 1.586913e+07 1.530745e+07 1.438628e+07 1.723654e+07 1.808302e+07 1.362414e+07 1.647212e+07 1.543343e+07 1.027117e+07 1.018713e+07 1.511107e+07 1.674299e+07 1.377732e+07 1.053448e+07 1.387237e+07 1.895070e+07 1.099273e+07 1.455744e+07 1.190288e+07 1.211731e+07 1.896995e+07 7.698562e+06 1.471207e+07 1.467855e+07 1.146801e+07 1.516821e+07 1.764242e+07 1.280333e+07 1.817853e+07 1.927467e+07 1.395096e+07 1.862168e+07 1.606542e+07 1.261688e+07 1.262403e+07 1.588373e+07 1.521378e+07 1.172270e+07 1.609656e+07 5.495955e+06 1.150354e+07 1.103098e+07 9.869452e+06 1.011319e+07 1.013495e+07 1.538457e+07 1.608611e+07 1.321659e+07 1.350559e+07 1.288390e+07 8.530262e+06 8.000057e+06 1.429753e+07 8.169728e+06 1.218440e+07 1.623322e+07 1.695242e+07 1.115040e+07 1.694746e+07 2.480807e+07 1.266340e+07 9.474146e+06 1.257265e+07 5.560377e+06 1.231315e+07 1.119844e+07 1.090239e+07 1.506809e+07 9.318082e+06 1.671126e+07 9.799851e+06 1.543648e+07 1.402051e+07 1.239175e+07 1.485736e+07 1.061948e+07 1.151584e+07 1.146024e+07 1.118029e+07 1.486180e+07 1.323445e+07 1.201605e+07 1.055362e+07 1.213614e+07 9.914248e+06 1.384323e+07 1.308646e+07 1.716186e+07 1.452178e+07 1.376259e+07 1.513205e+07 1.152324e+07 1.171887e+07 1.409332e+07 1.037605e+07 1.506338e+07 1.996290e+07 6.782147e+06 1.812560e+07 1.898454e+07 1.111654e+07 9.554326e+06 2.057272e+07 1.012929e+07 1.019966e+07 1.463660e+07 1.098446e+07 1.689595e+07 1.561221e+07 1.341945e+07 1.576133e+07 1.462440e+07 1.596399e+07 1.959044e+07 1.157887e+07 1.650791e+07 1.699252e+07 1.797717e+07 1.178527e+07 1.685181e+07 2.134592e+07 C16 H33 N4 O2 P S2_6.734 2.175507e+06 5.102807e+05 5.989279e+05 4.957319e+05 2.064550e+05 5.439063e+05 7.926267e+05 6.856919e+05 202594.35 4.581238e+05 6.525410e+05 5.795785e+05 172125.70 5.292902e+05 6.143710e+05 5.510901e+05 1.659045e+05 6.471995e+05 3.493025e+05 6.210148e+05 1.217198e+05 5.639119e+05 6.306759e+05 8.123859e+05 32858.582 5.504506e+05 4.588130e+05 6.252658e+05 1.585334e+04 5.557930e+05 6.837715e+05 4.996015e+05 116996.40 4.830889e+05 6.138812e+05 4.723629e+05 1.133522e+05 5.633091e+05 9.232696e+05 6.111390e+05 1.032818e+05 3.777515e+05 5.967305e+05 7.036646e+05 1.105247e+05 4.651987e+05 4.473083e+05 7.118058e+05 4.302349e+05 5.528163e+05 3.393871e+05 1.383541e+06 8.152415e+05 8.295609e+05 1.140216e+06 1.575966e+06 4.737421e+05 1.104116e+06 1.651445e+06 4.069420e+05 1.056973e+06 2.119537e+06 1.331667e+06 8.354316e+05 5.326210e+05 3.369797e+05 8.317285e+05 2.288492e+05 8.030353e+05 7.226975e+05 5.114262e+05 1.248870e+06 5.819089e+05 5.861986e+05 8.264944e+05 8.987075e+05 9.499198e+05 8.014804e+05 3.436975e+06 9.018203e+05 5.606165e+05 6.191525e+05 1.236300e+05 8.132017e+05 3.420110e+05 8.612598e+05 4.608669e+05 5.049439e+05 7.839624e+05 8.941055e+05 7.332324e+05 9.627690e+05 2.809905e+05 5.461297e+05 2.762070e+05 1.214473e+06 6.782979e+05 8.391127e+05 2.956269e+05 1.353209e+06 7.330204e+05 2.066322e+06 7.399075e+05 3.710361e+05 2.517666e+05 5.072955e+05 4.993343e+05 3.839583e+05 6.497750e+05 9.882160e+05 3.604794e+05 4.874550e+05 7.904669e+05 5.827898e+05 2.962129e+05 6.859888e+05 8.429193e+05 6.746474e+05 7.531149e+05 4.411479e+05 2.518576e+05 3.288922e+05 1.144126e+05 3.756138e+05 4.357753e+05 1.981659e+05 3.158215e+05 3.933867e+05 7.628640e+05 1.294769e+06 1.656661e+06 1.134210e+06 5.831612e+05 6.835742e+05 7.526198e+05 2.149770e+05 6.729283e+05 6.626335e+05 3.898951e+05 1.039185e+06 4.081137e+05 8.195912e+05 1.295991e+06 7.618738e+05 7.388450e+05 7.039297e+05 5.935156e+05 8.049038e+05 8.099046e+05 3.824167e+05 2.903969e+05 5.278639e+05 6.718377e+05 4.938735e+05 4.360225e+05 6.152650e+05 9.994856e+05 3.168630e+05 6.271437e+05 2.881243e+05 4.997568e+05 1.022942e+06 3.574484e+05 5.753079e+05 4.169923e+05 7.128472e+05 6.129107e+05 1.103074e+06 3.287320e+05 7.315240e+05 1.106796e+06 1.288737e+06 1.082354e+06 5.804509e+05 2.274262e+05 6.520087e+05 9.853197e+05 6.751132e+05 7.849111e+05 7.398906e+05 7.849755e+04 4.277546e+05 5.772007e+05 3.475737e+05 3.859098e+05 1.940113e+05 6.542605e+05 5.956007e+05 3.495625e+05 4.309729e+05 3.743173e+05 9.032419e+05 1.813237e+05 4.519173e+05 1.532688e+05 4.250896e+05 6.619370e+05 8.523924e+05 6.004381e+05 9.272569e+05 1.565674e+06 3.387848e+05 2.801583e+05 5.474723e+05 3.017147e+05 5.222938e+05 3.527001e+05 2.695783e+05 6.838325e+05 1.565561e+05 7.296588e+05 4.945560e+05 7.710551e+05 4.204488e+05 3.698242e+05 6.258364e+05 1.775623e+05 3.260339e+05 4.925145e+05 4.245060e+05 9.612404e+05 8.613382e+05 5.940263e+05 3.407620e+05 4.849405e+05 2.522317e+05 4.482605e+05 4.808519e+05 8.938129e+05 4.119715e+05 7.301618e+05 6.751758e+05 3.947724e+05 4.903070e+05 8.806443e+05 2.344383e+05 7.709635e+05 1.068968e+06 1.360961e+05 7.054638e+05 2.139229e+06 4.243596e+05 2.309791e+05 1.245201e+06 5.433673e+05 1.931161e+05 9.935867e+05 2.639394e+05 9.768352e+05 1.136501e+06 5.530739e+05 7.383318e+05 9.456516e+05 1.907135e+06 1.124678e+06 4.470379e+05 6.880105e+05 1.238271e+06 1.185562e+06 2.939891e+05 9.099595e+05 1.989452e+06 C9 H21 N O3_6.755 8.374432e+05 8.395772e+05 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1.242023e+05 1.511342e+05 1.048963e+05 1.629324e+05 3.436653e+05 5.554540e+04 1.442919e+05 2.606758e+05 6.435507e+04 7.355818e+04 8.393366e+04 2.982285e+05 1.138216e+05 7.482403e+04 9.991940e+04 1.422472e+05 8.192582e+04 1.468530e+05 7.474623e+04 1.640175e+05 3.526640e+05 6.646206e+04 6.252855e+04 9.138423e+04 1.094633e+05 3.345212e+05 1.665109e+05 1.699600e+05 1.035990e+05 3.420087e+05 2.939046e+05 4.394070e+05 2.039197e+05 4.521002e+05 7.763848e+04 2.741695e+05 6.805912e+05 1.393559e+05 1.802266e+05 3.079463e+05 2.536630e+05 2.535497e+05 9.039309e+05 2.449433e+05 5.157587e+05 1.317852e+05 8.649801e+04 4.611969e+05 C6 H15 N O2_6.789 6.902314e+05 3.976739e+06 5.630275e+06 5.610354e+06 2.415723e+05 3.969987e+06 4.001780e+06 5.514014e+06 203582.50 5.197255e+06 3.798701e+06 5.157066e+06 214354.08 4.674981e+06 4.992468e+06 5.041566e+06 1.807455e+05 4.737351e+06 3.824428e+06 4.404889e+06 1.513297e+05 4.826233e+06 5.598187e+06 4.728518e+06 119417.811 5.102234e+06 4.002153e+06 5.346509e+06 1.290658e+05 4.835180e+06 4.964309e+06 4.176120e+06 142661.77 4.164648e+06 4.953183e+06 5.295993e+06 1.536354e+05 4.428222e+06 5.164818e+06 5.450734e+06 1.478714e+05 3.877166e+06 4.635397e+06 5.257418e+06 2.312845e+05 4.250382e+06 4.321537e+06 5.233303e+06 3.258789e+06 3.822419e+06 3.897411e+06 4.133085e+06 3.815305e+06 3.697897e+06 3.832581e+06 3.537459e+06 4.985319e+06 2.816188e+06 3.064375e+06 5.284171e+06 3.182209e+06 4.078331e+06 2.893869e+06 4.493439e+06 1.636905e+07 4.012471e+06 3.384163e+06 1.493368e+07 1.213726e+07 8.215152e+06 1.087492e+07 1.308659e+07 8.722271e+06 1.068109e+07 2.733394e+06 4.171582e+06 4.354179e+06 3.302017e+06 4.283600e+06 4.168827e+06 3.792021e+06 3.833808e+06 3.404200e+06 2.732863e+06 2.744287e+06 3.272344e+06 4.436467e+06 3.756124e+06 3.250384e+06 3.574039e+06 2.888329e+06 3.842240e+06 3.800946e+06 2.878712e+06 3.371067e+06 3.383471e+06 4.351001e+06 3.580371e+06 1.982480e+06 4.576503e+06 3.445244e+06 3.307521e+06 3.315081e+06 3.961686e+06 3.304137e+06 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2.462251e+06 5.294688e+06 2.523660e+06 3.472296e+06 2.948781e+06 3.676015e+06 5.195838e+06 3.785157e+06 3.875525e+06 3.889463e+06 4.249361e+06 3.312930e+06 7.075879e+06 3.668410e+06 4.498753e+06 2.860102e+06 3.134928e+06 4.419102e+06 5.001839e+06 5.240743e+06 3.148517e+06 3.365650e+06 3.167220e+06 3.163951e+06 3.520431e+06 3.807448e+06 3.752198e+06 3.088031e+06 3.929555e+06 2.409539e+06 3.333166e+06 3.798747e+06 2.810804e+06 3.566829e+06 4.083256e+06 3.861811e+06 3.578777e+06 2.479569e+06 3.253737e+06 3.188052e+06 2.941910e+06 2.958076e+06 2.968061e+06 3.561397e+06 4.300276e+06 3.690555e+06 3.301391e+06 3.550906e+06 2.810368e+06 3.777825e+06 2.717656e+06 3.559930e+06 2.996055e+06 3.059854e+06 4.655601e+06 4.504133e+06 4.423334e+06 5.382974e+06 2.695510e+06 2.837898e+06 3.474432e+06 3.507284e+06 3.408806e+06 3.557364e+06 3.007234e+06 2.886503e+06 2.820625e+06 2.783935e+06 3.557484e+06 3.573196e+06 3.909189e+06 4.752998e+06 3.693503e+06 2.911968e+06 3.521342e+06 3.494229e+06 2.205274e+06 3.203469e+06 3.498272e+06 3.048521e+06 C5 H11 N_6.8 4.887814e+08 7.269296e+05 2.026703e+08 2.569197e+08 5.156783e+04 2.051200e+08 3.266623e+08 2.050674e+08 49429.26 1.846838e+08 1.743933e+08 1.429060e+04 48728.70 1.850890e+08 2.081450e+08 1.828947e+08 3.312589e+04 1.782472e+08 1.894249e+08 1.774368e+08 3.837977e+05 2.054341e+08 2.318431e+08 2.124742e+08 4147.951 1.973395e+08 1.621918e+08 2.112378e+08 1.767608e+05 1.981885e+08 2.120257e+08 1.903859e+08 110125.44 1.615724e+08 2.074188e+08 1.981296e+08 2.328470e+04 2.032407e+08 2.135500e+08 2.155691e+08 2.267308e+04 1.573958e+08 1.861464e+08 2.262251e+08 2.231926e+04 1.886052e+08 1.847940e+08 2.037897e+08 1.389779e+08 1.724518e+08 1.661559e+08 2.819909e+08 2.815305e+08 2.677172e+08 2.255494e+08 3.314200e+08 1.908902e+08 1.630684e+08 2.904569e+08 1.579603e+08 2.296596e+08 4.233665e+08 3.286473e+08 1.956097e+08 1.687114e+08 1.631648e+08 1.112996e+04 1.123981e+04 1.536634e+08 1.432555e+08 1.172167e+04 2.670644e+08 1.418320e+08 1.766276e+08 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1.653183e+08 2.968932e+08 2.471138e+08 1.180326e+08 1.591359e+08 1.572000e+08 2.947273e+08 1.844682e+08 4.205092e+08 2.924062e+08 1.128929e+08 1.435446e+08 3.493967e+08 1.089321e+08 1.464043e+08 2.596550e+08 2.842933e+08 1.687131e+08 2.949337e+08 1.042832e+08 2.872282e+08 6.706621e+07 1.885739e+08 2.482969e+08 2.122834e+08 1.464266e+08 2.880898e+08 1.724483e+08 1.457448e+08 2.199188e+08 2.441664e+08 1.402890e+08 2.725780e+08 1.922394e+08 Nitrosoguvacoline (1)_6.816 7.114478e+04 2.680382e+05 2.513567e+05 2.993853e+05 2.107161e+05 2.550450e+05 2.981710e+05 3.213791e+05 158037.38 2.712451e+05 3.103565e+05 2.752628e+05 169083.84 2.454243e+05 2.512275e+05 2.557007e+05 1.590246e+05 3.251500e+05 2.395441e+05 2.828888e+05 1.223699e+05 2.670544e+05 3.278131e+05 3.122567e+05 19772.757 2.275035e+05 2.859202e+05 2.472649e+05 2.002487e+04 3.249047e+05 2.819226e+05 2.797215e+05 109399.49 2.223141e+05 3.345428e+05 2.647041e+05 1.110131e+05 2.427530e+05 3.150314e+05 3.071652e+05 1.109963e+05 2.123336e+05 2.885865e+05 3.350848e+05 1.928231e+05 2.158413e+05 2.222279e+05 2.977050e+05 2.469090e+05 6.543850e+05 1.758230e+05 1.152596e+06 9.946977e+05 9.209853e+04 1.786904e+06 1.603920e+05 4.709231e+04 4.536099e+04 6.537870e+05 1.044019e+05 8.599934e+04 2.711407e+05 3.437732e+06 1.918381e+05 2.756757e+05 2.116112e+05 8.263174e+04 1.739703e+05 3.393708e+05 3.241111e+05 5.649858e+04 4.653010e+04 1.237262e+05 1.017000e+05 1.893755e+05 1.407389e+06 2.542074e+05 4.152347e+04 8.092156e+05 2.237308e+05 7.305375e+05 2.716215e+05 2.354377e+05 2.560683e+05 4.339780e+04 4.427632e+04 6.210860e+05 6.181767e+05 1.856577e+05 4.690226e+04 4.781676e+05 4.038169e+05 4.970227e+05 6.142231e+04 2.423974e+05 5.623636e+04 4.006587e+05 5.172593e+04 6.180805e+04 5.342241e+04 1.086199e+05 6.351595e+05 5.920790e+04 6.026599e+05 1.463866e+05 2.858824e+05 1.849060e+05 3.878002e+05 5.018064e+05 4.385862e+05 4.233525e+04 6.007449e+05 4.613618e+05 1.087904e+05 5.631316e+04 1.906105e+05 2.088379e+05 1.051806e+05 5.910362e+04 1.063908e+05 1.407998e+05 1.285744e+05 6.432865e+04 4.797542e+04 1.025548e+05 5.019182e+04 7.954616e+04 5.657247e+05 5.735936e+04 1.154138e+06 4.469184e+05 6.746456e+04 1.614976e+05 4.051276e+05 5.189735e+05 3.824631e+05 7.120581e+04 7.965445e+04 1.080535e+05 6.726483e+04 2.167357e+06 4.686018e+04 6.795959e+05 8.109308e+04 5.954862e+04 1.055510e+05 5.274642e+04 1.160795e+05 5.320219e+04 3.290127e+05 5.846743e+04 1.590668e+05 7.325133e+05 2.565580e+05 2.108438e+05 6.876285e+04 8.177194e+04 2.675108e+05 1.558548e+05 1.009358e+05 7.846871e+04 2.681052e+05 9.644133e+04 6.050587e+04 1.394817e+06 8.434937e+04 1.600084e+05 3.818448e+05 1.359762e+05 1.254292e+05 5.171883e+04 6.267004e+05 1.103422e+05 3.272653e+05 3.664199e+05 1.165091e+05 2.946635e+05 7.409167e+05 1.451149e+06 2.120174e+05 3.429180e+05 5.898241e+04 1.106425e+06 4.699259e+05 4.540316e+04 5.556954e+04 5.888542e+04 9.970918e+04 3.490121e+05 2.967443e+05 5.449163e+05 5.435453e+04 4.393028e+04 4.120106e+05 5.312104e+04 1.093848e+05 5.352278e+04 5.124892e+04 4.230291e+04 3.179063e+06 7.461025e+05 5.017176e+05 4.445410e+05 2.922219e+05 6.553998e+05 2.333586e+05 1.890815e+05 6.065178e+04 1.459463e+05 9.726675e+04 7.608229e+04 7.622464e+04 1.009486e+05 4.870612e+04 4.704258e+04 1.438018e+05 2.939932e+05 3.654323e+05 5.159215e+04 7.477269e+05 2.227841e+06 5.139511e+05 6.921793e+05 4.940239e+04 5.060466e+04 1.437071e+05 5.518166e+04 9.157599e+04 2.631821e+05 6.056244e+04 2.716120e+06 5.540998e+04 4.786892e+04 1.170517e+06 2.874474e+05 1.090990e+05 7.238684e+05 5.271238e+04 5.662513e+04 9.598303e+04 1.167955e+06 1.494116e+06 4.426894e+04 8.359904e+05 8.334426e+05 1.203621e+05 1.007197e+06 3.106954e+05 4.021924e+05 1.229338e+05 5.899369e+04 8.649256e+05 1.881056e+05 3.467041e+05 2.864286e+05 8.279457e+04 6.478099e+05 1.041745e+06 8.972961e+04 9.473788e+04 7.955383e+05 1.094068e+05 C11 H21 N O5_6.819 5.354697e+06 9.339845e+05 8.582752e+05 1.146161e+06 1.825371e+05 1.086238e+06 1.031351e+06 1.033538e+06 174678.80 1.019169e+06 1.034082e+06 1.113839e+06 173692.68 9.645476e+05 8.694634e+05 1.080903e+06 1.978983e+05 1.094562e+06 8.300454e+05 9.145336e+05 1.430859e+05 1.020796e+06 1.169872e+06 1.138014e+06 22603.970 1.007849e+06 9.227630e+05 9.424806e+05 2.284128e+04 1.100542e+06 9.924299e+05 8.512892e+05 114960.98 1.169985e+06 9.615789e+05 8.395347e+05 1.057882e+05 9.650713e+05 1.500952e+06 9.438688e+05 1.099644e+05 8.038326e+05 1.063574e+06 1.328286e+06 2.272946e+05 7.364305e+05 7.470997e+05 1.214590e+06 1.261082e+06 1.923251e+06 3.882838e+06 1.140565e+06 1.094663e+06 4.783093e+05 7.707693e+05 1.271156e+06 2.375353e+06 1.107493e+06 9.366974e+05 1.215235e+06 1.052872e+06 1.327663e+06 1.240533e+06 4.623318e+06 6.245521e+05 2.518085e+06 1.159281e+06 3.053602e+05 4.562491e+05 4.486667e+05 9.637872e+05 8.036445e+05 1.026206e+06 8.407274e+05 5.198264e+05 7.970964e+05 1.350876e+06 3.367357e+05 9.053648e+05 5.453978e+05 5.214296e+05 6.162377e+05 1.232183e+06 1.418930e+06 3.287690e+05 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2.454790e+06 1.063425e+06 4.324735e+05 1.011812e+06 1.337488e+06 1.320548e+06 2.501336e+06 6.561852e+05 2.277608e+06 2.816006e+06 4.647542e+05 7.761943e+05 3.637872e+06 5.743564e+05 8.268770e+05 3.860536e+06 2.534162e+06 1.117086e+06 8.793846e+05 1.075314e+06 1.218566e+06 7.879060e+05 2.050606e+06 C5 H15 N6 O2 P_6.841 1.453326e+06 1.237174e+06 1.290072e+06 1.269726e+06 1.818260e+05 1.229850e+06 1.263345e+06 1.448333e+06 158416.68 1.247304e+06 1.318769e+06 1.409283e+06 171529.72 1.135256e+06 1.191901e+06 1.266330e+06 1.882715e+05 1.418766e+06 1.057026e+06 1.158887e+06 1.350280e+05 1.292670e+06 1.602873e+06 1.264933e+06 21816.992 1.251679e+06 1.161327e+06 1.329316e+06 1.709518e+04 1.305370e+06 1.331166e+06 1.157967e+06 118264.33 1.271877e+06 1.284434e+06 1.283960e+06 1.176342e+05 1.295062e+06 1.377224e+06 1.426139e+06 1.190543e+05 9.422461e+05 1.282315e+06 1.490334e+06 2.025676e+05 1.293313e+06 1.054865e+06 1.381454e+06 4.821472e+05 1.442684e+06 2.484218e+06 2.662939e+05 1.785169e+06 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1.881817e+06 2.221756e+06 1.439357e+06 1.945954e+06 1.148919e+06 3.004128e+06 8.120448e+05 9.049418e+04 4.745222e+05 1.084400e+06 1.667858e+06 4.936128e+04 1.277658e+06 7.864354e+05 2.630769e+06 3.958578e+05 1.381090e+06 9.733582e+05 1.485462e+06 5.874686e+05 1.267492e+06 4.032405e+05 1.078941e+06 2.044811e+05 1.118492e+05 1.071150e+05 7.610581e+05 2.966352e+05 6.635133e+05 2.504195e+05 2.848792e+05 6.023493e+05 5.498748e+05 8.728050e+05 7.087771e+05 2.250806e+05 6.060625e+06 1.402906e+05 3.472419e+05 1.480071e+06 1.147009e+06 4.337334e+05 8.263581e+05 5.422133e+05 1.506857e+06 3.846190e+05 9.439616e+05 9.312734e+05 5.646931e+04 3.765877e+06 1.892992e+05 2.262999e+06 4.320002e+05 4.409271e+06 3.633218e+06 C10 H18 N2 O5_6.843 4.261461e+06 2.129475e+06 2.230636e+06 2.281882e+06 2.413254e+05 2.212404e+06 2.337637e+06 2.322072e+06 201173.61 2.228652e+06 2.309214e+06 2.461708e+06 208146.23 2.186347e+06 2.101709e+06 2.134627e+06 2.263239e+05 2.463806e+06 1.970810e+06 2.110653e+06 1.646212e+05 2.234797e+06 2.642569e+06 2.392892e+06 27426.241 2.322799e+06 2.083539e+06 1.956296e+06 2.276189e+04 2.366905e+06 2.304969e+06 2.132414e+06 151351.08 2.292414e+06 2.321111e+06 2.342188e+06 1.480694e+05 2.249888e+06 2.418798e+06 2.492264e+06 1.540254e+05 1.668066e+06 2.305208e+06 2.543034e+06 2.533898e+05 2.010911e+06 2.076602e+06 2.451270e+06 1.519414e+06 2.146403e+06 2.267380e+06 2.949479e+06 3.372457e+06 1.703599e+06 4.803885e+06 3.013347e+06 2.676882e+06 2.616722e+06 4.406265e+06 1.643636e+06 1.875638e+06 2.656491e+06 2.059070e+06 4.149020e+06 2.476500e+06 1.530533e+06 2.165271e+06 1.559997e+06 2.200067e+06 2.091113e+06 2.072175e+06 2.795945e+06 1.963510e+06 1.902074e+06 3.905765e+06 1.195161e+06 2.649101e+06 1.556206e+06 7.641076e+06 2.041625e+06 2.409241e+06 2.403443e+06 2.235715e+06 2.282954e+06 1.362622e+06 2.446791e+06 1.186585e+06 2.141138e+06 2.979061e+06 2.035932e+06 2.184968e+06 3.040847e+06 1.233010e+06 2.049510e+06 2.659340e+06 1.768567e+06 2.622577e+06 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2.393309e+06 2.043221e+06 3.012446e+06 2.760128e+06 3.348778e+06 1.552474e+06 4.500466e+05 1.135558e+06 3.914309e+06 1.815794e+06 1.075839e+06 1.344846e+06 1.582052e+06 3.798962e+06 3.136358e+06 2.777639e+06 1.753050e+06 1.309201e+06 1.224008e+06 2.826206e+06 4.517678e+05 2.708234e+06 2.713622e+06 1.623816e+06 2.279368e+06 4.082924e+06 5.415085e+06 2.050191e+06 2.545854e+06 2.443500e+06 2.283862e+06 1.638193e+06 2.653613e+06 1.405430e+06 2.816161e+06 1.386240e+06 3.095110e+06 2.217706e+06 3.120962e+06 2.616011e+06 9.358156e+05 2.943232e+06 1.733637e+06 3.932551e+06 2.111018e+06 2.172298e+06 2.830554e+06 2.777280e+06 2.019097e+06 2.085466e+06 2.499166e+06 2.109438e+06 2.631056e+06 1.133174e+06 2.901002e+06 2.688315e+06 3.475359e+06 1.004462e+06 1.185879e+06 3.548624e+06 3.940790e+06 3.007651e+06 4.624520e+06 1.385127e+06 2.755982e+06 2.433398e+06 2.811523e+06 1.073927e+06 2.417246e+06 3.471745e+06 2.291282e+06 4.140037e+06 5.024009e+06 2.970778e+06 3.043409e+06 2.461377e+06 2.279889e+06 3.660429e+06 1.816633e+06 4.755224e+06 2.420423e+06 1.724361e+06 3.999646e+06 3.165893e+06 1.322433e+06 6.423184e+05 3.113804e+06 2.388320e+06 C10 H18 N2 O5 S_6.887 9.000898e+05 6.573558e+05 6.475026e+05 8.426252e+05 2.885665e+05 7.111428e+05 7.187464e+05 7.675549e+05 221117.24 6.998920e+05 1.041163e+06 7.326267e+05 244919.85 5.565139e+05 6.829801e+05 7.013912e+05 2.091735e+05 7.906830e+05 6.356075e+05 6.982027e+05 1.751578e+05 7.846001e+05 8.681377e+05 7.203455e+05 28710.204 7.349139e+05 7.034637e+05 7.745294e+05 2.758497e+04 6.910801e+05 7.813755e+05 6.659025e+05 164070.55 7.080849e+05 7.714529e+05 7.514771e+05 1.593483e+05 7.289331e+05 8.351351e+05 8.169557e+05 1.654822e+05 5.474059e+05 6.923145e+05 8.659190e+05 1.858753e+05 6.517015e+05 7.386718e+05 7.538809e+05 4.938785e+05 9.376811e+05 9.394785e+05 7.975948e+05 1.266151e+06 7.798879e+05 1.447734e+06 1.356817e+06 7.769523e+05 8.535885e+05 1.312602e+06 2.665559e+05 9.926001e+05 2.118708e+06 7.212638e+05 1.203834e+06 4.694861e+05 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5.024079e+05 7.300847e+05 1.379908e+06 6.962392e+05 7.570751e+05 6.011545e+05 4.077565e+05 1.192568e+06 6.582759e+05 6.157066e+05 8.889021e+05 2.036791e+05 4.737651e+05 7.272649e+05 5.886233e+05 1.041721e+06 6.639550e+05 1.603914e+06 1.196882e+06 5.594510e+05 6.703219e+05 7.262563e+05 4.084931e+05 6.477078e+05 1.251625e+06 4.918226e+05 9.055407e+05 8.649120e+05 6.042499e+05 9.928617e+05 6.693376e+05 7.466816e+05 1.918896e+06 5.529861e+05 9.773975e+05 8.095144e+05 2.500047e+05 1.210458e+06 9.660447e+05 4.233507e+05 4.005511e+05 1.766653e+06 1.349680e+06 Ecgonine_6.908 4.743816e+07 7.635866e+06 7.405124e+06 8.588183e+06 2.120292e+05 8.082645e+06 6.789414e+06 8.017508e+06 170179.19 9.408562e+06 8.165071e+06 8.773065e+06 208292.23 6.962664e+06 7.543480e+06 7.025498e+06 1.879043e+05 9.650512e+06 6.395753e+06 7.166798e+06 1.601403e+05 7.645637e+06 1.030694e+07 7.845534e+06 24887.167 7.761860e+06 7.778671e+06 7.789235e+06 2.378955e+04 7.873244e+06 8.155729e+06 7.349438e+06 146083.09 8.178564e+06 8.349539e+06 6.636325e+06 1.364712e+05 7.436949e+06 1.066198e+07 9.135782e+06 1.394204e+05 5.520654e+06 7.209362e+06 9.581858e+06 1.610686e+05 7.392188e+06 6.673516e+06 8.828475e+06 8.103347e+06 9.227662e+06 6.389443e+06 1.382623e+07 1.135791e+07 1.049507e+07 1.036612e+07 1.405004e+07 1.215804e+07 1.702341e+07 8.515949e+06 7.699846e+06 2.020568e+07 1.292038e+07 7.022687e+06 1.304045e+07 1.362190e+07 6.071792e+06 5.243324e+06 9.930165e+06 7.966566e+06 1.281560e+07 7.426927e+06 1.094583e+07 9.213016e+06 6.972587e+06 8.746452e+06 1.206752e+07 6.275534e+06 1.017056e+07 1.043229e+07 4.395325e+06 5.218174e+06 8.547960e+06 4.555869e+06 3.910322e+06 6.167261e+06 3.290615e+06 8.429101e+06 7.580172e+06 9.345788e+06 5.432288e+06 4.952697e+06 6.975518e+06 1.117274e+07 6.373103e+06 2.702445e+06 7.223831e+06 1.004821e+07 5.854001e+06 7.174485e+06 6.393734e+06 6.002423e+06 6.120169e+06 4.711173e+06 7.303136e+06 4.019776e+06 7.282843e+06 6.449846e+06 6.567929e+06 7.929308e+06 1.212801e+07 4.096369e+06 7.462492e+06 8.785266e+06 9.267964e+06 5.746602e+06 7.171276e+06 4.541374e+06 5.966619e+06 1.509089e+07 7.861585e+06 4.347269e+06 6.320672e+06 3.791045e+06 5.837852e+06 9.718636e+06 5.284001e+06 6.864217e+06 4.612357e+06 3.978174e+06 7.810880e+06 2.317634e+07 1.278365e+07 2.295929e+06 3.803388e+06 6.887298e+06 2.876361e+06 4.287031e+06 5.027664e+06 8.141384e+06 8.623693e+06 7.324495e+06 5.883792e+06 4.870456e+06 1.327346e+07 1.030767e+07 1.140718e+07 9.604845e+06 1.075867e+07 1.057023e+07 1.255233e+07 4.017292e+06 7.005200e+06 2.919045e+06 1.800329e+07 6.992564e+06 1.156291e+07 1.220598e+07 7.637449e+06 9.424419e+06 6.679367e+06 4.829936e+06 9.502235e+06 8.211345e+06 1.006915e+07 7.921020e+06 7.905786e+06 4.293859e+06 1.163279e+07 3.765077e+06 1.249426e+07 1.290223e+07 6.731636e+06 1.373726e+07 9.560096e+06 9.179868e+06 1.065715e+07 8.567919e+06 1.123535e+07 4.070219e+06 4.625710e+06 6.674287e+06 4.714220e+06 7.016101e+06 5.118035e+06 4.541637e+06 5.903653e+06 4.316779e+06 7.938185e+06 7.450319e+06 6.485892e+06 2.057584e+06 1.534438e+07 7.011052e+06 4.958908e+06 3.424916e+06 1.015643e+07 1.537076e+07 2.298569e+07 8.965819e+06 1.002336e+07 1.784671e+07 1.135251e+07 8.414033e+06 1.015914e+07 1.126267e+07 4.287737e+06 1.216300e+07 1.250781e+07 6.649984e+06 9.679533e+06 6.064846e+06 4.897344e+06 1.391960e+07 9.811417e+06 7.327631e+06 7.086055e+06 4.711292e+06 1.009757e+07 3.093155e+06 9.316294e+06 5.355514e+06 7.369673e+06 1.136280e+07 1.178140e+07 7.599996e+06 8.862163e+06 7.922904e+06 8.263737e+06 8.147357e+06 7.655671e+06 8.680301e+06 7.314752e+06 5.893852e+06 1.191493e+07 6.933253e+06 5.769984e+06 1.557398e+07 1.202075e+07 1.015168e+07 6.664767e+06 1.176111e+07 6.265135e+06 8.417705e+06 1.739603e+07 1.012722e+07 8.243632e+06 1.284199e+07 7.977883e+06 1.208115e+07 6.473659e+06 9.453681e+06 1.207681e+07 4.359600e+06 1.606541e+07 6.844352e+06 5.041356e+06 9.558885e+06 1.878740e+07 5.579182e+06 9.431266e+06 6.113888e+06 6.791452e+06 C8 H11 N3 O3 S_6.912 8.146309e+04 1.816821e+05 1.011711e+05 3.235689e+05 2.209618e+05 1.988868e+05 2.882408e+05 2.033727e+05 174630.26 2.026710e+05 2.152382e+05 2.841858e+05 224420.85 1.742865e+05 1.879299e+05 2.025677e+05 2.105024e+05 2.070742e+05 1.740597e+05 2.401103e+05 1.737732e+05 2.101818e+05 2.583862e+05 2.390122e+05 28792.906 2.097356e+05 1.687672e+05 1.962008e+05 2.892436e+04 2.313748e+05 2.278924e+05 1.778738e+05 172338.63 2.497422e+05 2.135955e+05 1.994766e+05 1.562996e+05 1.771803e+05 2.939386e+05 2.571716e+05 1.575903e+05 1.500417e+05 2.116058e+05 2.245347e+05 1.786449e+05 1.794116e+05 1.416998e+05 2.314347e+05 7.568847e+04 5.653786e+04 8.817384e+04 7.003598e+04 7.205385e+04 7.039450e+04 6.017758e+04 7.889567e+04 6.039383e+04 6.546253e+04 6.230817e+04 5.669611e+04 7.120206e+04 7.565795e+04 6.225082e+04 6.958276e+04 6.862506e+04 7.015474e+04 5.770455e+04 6.951038e+04 5.627241e+04 6.321751e+04 5.989891e+04 5.739182e+04 7.112534e+04 5.839452e+04 8.631040e+04 6.638879e+04 5.664754e+04 5.608707e+04 7.921011e+04 7.024484e+04 5.701859e+04 5.890052e+04 6.915373e+04 5.891714e+04 7.920347e+04 6.626788e+04 7.063540e+04 6.381921e+04 5.959438e+04 6.130558e+04 5.776627e+04 6.405729e+04 7.593007e+04 5.975881e+04 6.378434e+04 5.681635e+04 7.153349e+04 6.982824e+04 5.871887e+04 6.668379e+04 7.173752e+04 7.142928e+04 6.032651e+04 7.150842e+04 8.743601e+04 7.204795e+04 7.268002e+04 6.813298e+04 6.370058e+04 7.057435e+04 6.102038e+04 6.107679e+04 6.377414e+04 7.174598e+04 5.764455e+04 7.158755e+04 5.094332e+04 7.035063e+04 7.124261e+04 6.897526e+04 6.900952e+04 6.852543e+04 5.853041e+04 7.146452e+04 6.743109e+04 6.397428e+04 7.278210e+04 7.198959e+04 5.967223e+04 5.816814e+04 6.808094e+04 7.499688e+04 7.151596e+04 5.591428e+04 5.395019e+04 6.034260e+04 7.765728e+04 6.144073e+04 7.561921e+04 5.966318e+04 6.891225e+04 6.355274e+04 6.236368e+04 6.579447e+04 6.400710e+04 6.831287e+04 7.396779e+04 6.964175e+04 5.698065e+04 7.421644e+04 6.104774e+04 7.670486e+04 6.132880e+04 7.266711e+04 7.841381e+04 7.370351e+04 6.770963e+04 7.202204e+04 5.683517e+04 6.859713e+04 5.874725e+04 7.057595e+04 6.578323e+04 6.953556e+04 6.745881e+04 6.440474e+04 6.658314e+04 6.949346e+04 7.191191e+04 6.806914e+04 5.672659e+04 6.152912e+04 6.969119e+04 6.104143e+04 6.418531e+04 6.003593e+04 5.992649e+04 7.099952e+04 5.992971e+04 6.188760e+04 8.073075e+04 1.134673e+05 6.081187e+04 6.412297e+04 6.125974e+04 7.340549e+04 5.759371e+04 6.463734e+04 5.825053e+04 7.278033e+04 6.992085e+04 6.141960e+04 1.478629e+05 7.289283e+04 6.672584e+04 5.895559e+04 7.488839e+04 6.842505e+04 5.943181e+04 5.931977e+04 7.062188e+04 6.012291e+04 5.925773e+04 1.063476e+05 7.436948e+04 6.403193e+04 6.555173e+04 6.498815e+04 5.869163e+04 6.992803e+04 6.988688e+04 5.449004e+04 6.342627e+04 6.727158e+04 6.080357e+04 5.561201e+04 6.818265e+04 7.427465e+04 6.703686e+04 8.422010e+04 5.676288e+04 6.084385e+04 8.925884e+04 6.329197e+04 6.644679e+04 5.723417e+04 7.096793e+04 7.461391e+04 5.629058e+04 6.045853e+04 6.082223e+04 6.985635e+04 6.316957e+04 5.416323e+04 5.552815e+04 6.244735e+04 7.154963e+04 7.473121e+04 5.984790e+04 6.233112e+04 5.317947e+04 6.316921e+04 6.867149e+04 6.031558e+04 5.382847e+04 7.240206e+04 6.037042e+04 6.389865e+04 6.053884e+04 6.089802e+04 8.629069e+04 7.067436e+04 5.581902e+04 7.013530e+04 6.476434e+04 5.075610e+07 9.203061e+04 5.905270e+04 7.241138e+04 7.194634e+04 7.072518e+04 6.971025e+04 C6 H13 N O2 S_6.927 9.181795e+05 5.018036e+05 3.366129e+05 4.646856e+05 4.245687e+05 4.026893e+05 4.637146e+05 4.594885e+05 113888.03 4.487852e+05 4.404276e+05 4.687796e+05 155996.01 4.493750e+05 4.224524e+05 3.965503e+05 1.486718e+05 4.966478e+05 3.938784e+05 3.842550e+05 1.354866e+05 4.041595e+05 5.386444e+05 4.417062e+05 21062.645 4.315552e+05 4.511863e+05 4.092085e+05 1.739991e+04 5.065887e+05 4.590288e+05 3.563171e+05 127751.24 3.976679e+05 4.754992e+05 4.227613e+05 1.147375e+05 4.190918e+05 5.332640e+05 5.364242e+05 1.172478e+05 3.345015e+05 3.785613e+05 5.408966e+05 1.341459e+05 3.662576e+05 4.005292e+05 4.830015e+05 9.009650e+05 1.176235e+06 2.774187e+06 3.159944e+05 3.094238e+05 2.409692e+05 2.952827e+05 3.780216e+05 1.813807e+06 5.499357e+05 4.021735e+05 2.926907e+05 1.855399e+05 3.787683e+05 6.286828e+05 4.788948e+05 7.333787e+04 6.533430e+05 5.726798e+05 2.362394e+05 1.848930e+05 2.291908e+05 8.629725e+05 2.188618e+05 6.705254e+05 6.952863e+04 7.617767e+04 6.059551e+05 2.461488e+05 1.136274e+05 2.761867e+05 3.584220e+05 7.497309e+04 4.952390e+04 2.526430e+05 3.818434e+05 2.499112e+05 1.248516e+06 1.992245e+05 9.810128e+05 6.629193e+05 1.118575e+06 2.400495e+05 1.097976e+05 7.334822e+05 2.202051e+05 9.938977e+05 4.244641e+05 8.887860e+05 5.388490e+04 2.634365e+05 1.486216e+05 3.670287e+05 1.727739e+05 6.501721e+04 6.567203e+05 3.669724e+05 6.653848e+05 3.521361e+05 9.341463e+05 7.159971e+04 1.671697e+05 2.390995e+05 9.319314e+05 2.634595e+05 2.817517e+05 2.751543e+05 1.283409e+05 3.079268e+05 4.262288e+05 4.902375e+05 3.515503e+05 3.884823e+05 1.158249e+06 8.363095e+05 2.897690e+05 4.938047e+05 9.548087e+04 1.380016e+06 3.235495e+05 3.740578e+05 1.857823e+05 7.002938e+05 3.393020e+05 1.605607e+06 5.965418e+04 1.942141e+05 3.356859e+06 1.099145e+06 2.380218e+05 4.026466e+05 2.624324e+05 2.989593e+05 1.997481e+05 2.229722e+05 3.176200e+05 8.293951e+05 4.770830e+05 4.692821e+05 3.013279e+05 4.005733e+05 4.807316e+05 9.123170e+05 3.405072e+05 6.401674e+05 1.518540e+05 2.280551e+05 5.569175e+05 6.819591e+05 5.743368e+05 7.533038e+05 4.807881e+05 1.227635e+06 1.176040e+06 5.653980e+05 1.990867e+05 3.038186e+05 1.120431e+06 2.183381e+05 3.583824e+05 1.146632e+06 4.772729e+05 8.443413e+04 2.354645e+05 4.721790e+05 7.520219e+05 2.708451e+05 7.708999e+04 2.591063e+05 1.605055e+05 7.793419e+05 2.395129e+05 7.465313e+04 4.152042e+05 5.513491e+04 4.540626e+05 3.813833e+05 5.299108e+05 1.341222e+06 3.440969e+05 4.937407e+05 2.721099e+05 6.550089e+05 4.286223e+05 3.598838e+06 2.053159e+05 8.888512e+04 1.407396e+05 5.845177e+05 3.027890e+05 4.099107e+05 2.891413e+05 1.151118e+06 1.791551e+06 4.397012e+04 9.118022e+05 8.359560e+04 3.144495e+05 9.852424e+05 1.705938e+06 3.800237e+05 2.596112e+05 1.062808e+06 4.313358e+05 2.827757e+05 3.829855e+05 1.071951e+05 1.853441e+05 1.357243e+05 2.191566e+05 2.420931e+05 1.618943e+06 5.155183e+05 4.675243e+05 4.086063e+05 1.561559e+05 2.036014e+05 2.574667e+05 5.429043e+04 3.641722e+05 5.832688e+05 2.717746e+05 2.661936e+05 8.477969e+05 5.113088e+05 9.452139e+04 6.038591e+05 5.088551e+05 9.015176e+05 4.864909e+05 1.187485e+06 7.340666e+05 3.321904e+05 1.916726e+05 1.847475e+05 3.128672e+05 1.983112e+05 2.101129e+06 2.019165e+05 5.074353e+05 6.489618e+05 1.649981e+05 6.720368e+05 1.017578e+06 1.705380e+05 2.714834e+05 1.055200e+06 3.314120e+05 6.812060e+05 2.398044e+05 5.834550e+05 7.067506e+05 2.173588e+05 1.184392e+06 THTA_6.93 1.379565e+06 7.330311e+05 6.058812e+05 7.474484e+05 5.172379e+05 6.771228e+05 7.760494e+05 7.316197e+05 195032.75 7.556857e+05 7.315322e+05 7.385155e+05 259153.16 7.082092e+05 7.131449e+05 6.408689e+05 2.670312e+05 7.838074e+05 6.493908e+05 6.519978e+05 2.389898e+05 6.480725e+05 8.822680e+05 7.178994e+05 37090.034 7.187801e+05 6.890286e+05 6.794727e+05 3.045252e+04 8.270195e+05 7.425867e+05 6.079696e+05 221585.48 6.554308e+05 7.511054e+05 6.909939e+05 2.021564e+05 7.078446e+05 8.501256e+05 8.687036e+05 2.083802e+05 5.265532e+05 6.152833e+05 8.907632e+05 2.334843e+05 6.216111e+05 6.341566e+05 7.888596e+05 1.461869e+06 1.878763e+06 4.478216e+06 4.632277e+05 4.706158e+05 3.673847e+05 5.633635e+05 5.987033e+05 3.025006e+06 9.750810e+05 6.395146e+05 4.953955e+05 3.018989e+05 5.851991e+05 1.019292e+06 7.997264e+05 1.488774e+05 1.050266e+06 9.203475e+05 3.498929e+05 2.597036e+05 3.283303e+05 1.314680e+06 3.805790e+05 1.076643e+06 1.076993e+05 1.251307e+05 9.856198e+05 4.281403e+05 1.796387e+05 4.702235e+05 5.740797e+05 1.115204e+05 1.263910e+05 4.172940e+05 6.018979e+05 3.567067e+05 1.951854e+06 3.643124e+05 1.666595e+06 1.147264e+06 1.763362e+06 3.995137e+05 1.653722e+05 1.210935e+06 3.617689e+05 1.614492e+06 6.613208e+05 1.470120e+06 1.169966e+05 3.982562e+05 1.951053e+05 5.816604e+05 2.385437e+05 1.052571e+05 1.142396e+06 5.579127e+05 1.080030e+06 5.244581e+05 1.496961e+06 1.080688e+05 2.493511e+05 4.006899e+05 1.465629e+06 4.680202e+05 4.788644e+05 4.219931e+05 1.741047e+05 4.776166e+05 7.053126e+05 7.632903e+05 5.979146e+05 5.898042e+05 1.872165e+06 1.387661e+06 4.334610e+05 8.569495e+05 1.431051e+05 2.242197e+06 4.881780e+05 6.001863e+05 2.526318e+05 1.106609e+06 5.599130e+05 2.741755e+06 9.276740e+04 3.128415e+05 5.627964e+06 1.823154e+06 3.589048e+05 6.044856e+05 3.940895e+05 4.885795e+05 2.841888e+05 3.466894e+05 4.708755e+05 1.287765e+06 7.813272e+05 7.941325e+05 4.348762e+05 6.403252e+05 8.096990e+05 1.481777e+06 5.410604e+05 1.041565e+06 2.080795e+05 3.389258e+05 8.506907e+05 1.163303e+06 8.987443e+05 1.279954e+06 8.063985e+05 1.950832e+06 1.931813e+06 9.536718e+05 3.005880e+05 5.346785e+05 1.827352e+06 3.794843e+05 5.871958e+05 2.056860e+06 6.232237e+05 1.290008e+05 3.393680e+05 8.207039e+05 1.213445e+06 4.098129e+05 1.305762e+05 4.042224e+05 2.058922e+05 1.041709e+06 3.651354e+05 1.265786e+05 6.575923e+05 9.469786e+04 6.865955e+05 5.981060e+05 8.678829e+05 1.892256e+06 5.733828e+05 6.813284e+05 3.245301e+05 1.075214e+06 5.963716e+05 6.052732e+06 2.549309e+05 1.403370e+05 1.664134e+05 9.438924e+05 3.889332e+05 6.282721e+05 4.955148e+05 1.885353e+06 2.802979e+06 1.044785e+05 1.418601e+06 1.238078e+05 5.383424e+05 1.579034e+06 2.726510e+06 6.559180e+05 4.452865e+05 1.664066e+06 6.275597e+05 4.960475e+05 6.306368e+05 1.432549e+05 3.419520e+05 2.277040e+05 3.108694e+05 4.337397e+05 2.513787e+06 9.197504e+05 6.739668e+05 6.887270e+05 2.034308e+05 3.326435e+05 3.949507e+05 9.657149e+04 5.264125e+05 9.212728e+05 4.830329e+05 4.057748e+05 1.396433e+06 8.192124e+05 1.315265e+05 9.792244e+05 8.649481e+05 1.392466e+06 6.579638e+05 1.922811e+06 1.105070e+06 5.328836e+05 3.125552e+05 3.328382e+05 3.781676e+05 2.527747e+05 3.506487e+06 2.352381e+05 7.831892e+05 1.054461e+06 2.347734e+05 1.013023e+06 1.655638e+06 2.488523e+05 3.276426e+05 1.555512e+06 5.090451e+05 1.044435e+06 3.898595e+05 9.098030e+05 1.209015e+06 3.903066e+05 1.881581e+06 3477_6.941 1.527074e+07 5.139521e+06 7.353207e+06 2.643750e+06 2.361260e+05 7.582508e+06 6.176743e+06 6.860784e+06 222698.24 5.107037e+06 6.844107e+06 6.747307e+06 248187.33 4.105936e+06 5.017242e+06 5.474249e+06 2.228474e+05 6.768083e+06 5.269018e+06 6.053107e+06 1.890096e+05 5.731086e+06 6.998887e+06 4.498987e+06 31595.651 6.189885e+06 6.007052e+06 6.547167e+06 2.688093e+04 6.432417e+06 5.498619e+06 4.132929e+06 200537.42 5.296366e+06 6.340621e+06 6.306028e+06 1.702487e+05 5.611870e+06 6.623090e+06 6.899825e+06 1.679380e+05 4.419689e+06 5.385530e+06 7.324380e+06 1.896977e+05 5.555295e+06 4.057506e+06 6.862068e+06 6.078738e+06 8.015861e+06 4.639521e+06 9.243274e+06 7.352391e+06 6.400468e+06 7.430100e+06 9.016111e+06 8.216657e+06 8.153777e+06 1.095494e+07 1.131025e+07 1.171239e+07 1.132313e+07 7.191002e+06 8.173576e+06 7.294271e+06 5.270582e+06 5.682961e+06 6.038935e+06 4.548771e+06 6.218898e+06 8.725773e+06 5.478173e+06 8.183966e+06 6.750226e+06 1.105318e+07 6.675154e+06 4.820924e+06 8.319972e+06 1.689169e+07 8.011404e+06 4.624713e+06 4.981491e+06 6.829066e+06 8.363213e+06 7.320097e+06 4.335747e+06 3.794425e+06 6.713350e+06 7.604225e+06 6.081873e+06 6.225362e+06 4.746311e+06 5.024153e+06 5.185436e+06 6.020539e+06 7.109864e+06 6.349160e+06 7.132060e+06 4.979086e+06 6.292882e+06 3.273343e+06 7.950102e+06 6.297346e+06 8.001561e+06 4.287827e+06 8.452111e+06 5.074402e+06 6.845805e+06 7.368943e+06 7.916611e+06 3.139867e+06 5.647425e+06 8.583890e+06 5.868678e+06 5.654664e+06 7.542951e+06 5.613598e+06 8.822581e+06 7.900061e+06 9.450836e+06 4.044653e+06 5.919647e+06 2.696591e+06 4.352152e+06 4.804776e+06 5.719097e+06 8.238253e+06 5.786951e+06 5.733241e+06 7.396629e+06 1.249612e+07 7.358865e+06 4.349903e+06 4.237265e+06 6.076555e+06 4.797133e+06 5.408850e+06 8.145662e+06 5.634037e+06 9.786552e+06 5.897534e+06 6.720093e+06 5.486934e+06 7.082526e+06 6.428762e+06 5.360312e+06 6.278899e+06 7.375591e+06 4.636396e+06 3.969652e+06 3.509049e+06 6.349910e+06 4.769415e+06 9.921293e+06 4.714063e+06 6.095461e+06 8.356154e+06 6.121619e+06 5.602221e+06 6.260197e+06 3.667479e+06 7.953266e+06 6.371930e+06 5.782366e+06 6.968089e+06 8.435372e+06 9.652268e+06 7.345331e+06 5.594775e+06 6.439426e+06 7.964666e+06 4.604281e+06 5.130641e+06 8.417118e+06 6.672799e+06 5.784135e+06 6.493301e+06 6.111680e+06 5.166793e+06 3.186136e+06 4.229385e+06 3.522691e+06 5.111960e+06 5.383946e+06 5.012126e+06 5.495519e+06 6.195757e+06 5.684221e+06 4.913665e+06 7.165192e+06 7.131524e+06 4.641242e+06 6.419574e+06 6.332063e+06 3.579675e+06 6.197832e+06 8.111034e+06 7.917828e+06 7.297236e+06 5.923427e+06 8.185975e+06 5.579991e+06 4.981173e+06 4.338340e+06 4.091105e+06 6.352174e+06 6.588074e+06 5.207058e+06 8.697475e+06 5.299953e+06 6.767215e+06 4.905835e+06 7.268276e+06 5.239825e+06 5.730233e+06 5.511414e+06 5.343288e+06 5.752758e+06 7.275551e+06 6.823315e+06 4.586809e+06 3.678916e+06 6.453210e+06 4.588415e+06 6.535310e+06 4.151429e+06 8.455239e+06 5.589643e+06 6.612773e+06 5.483798e+06 7.981220e+06 6.326078e+06 4.962911e+06 4.979401e+06 3.781532e+06 5.434119e+06 4.605076e+06 7.799129e+06 5.635600e+06 6.792118e+06 6.897503e+06 5.212358e+06 6.664888e+06 8.433137e+06 5.641169e+06 5.425678e+06 5.835320e+06 6.107125e+06 9.349167e+06 4.416324e+06 7.829300e+06 8.708461e+06 5.548600e+06 8.929629e+06 9.412510e+06 6.334481e+06 3.773638e+06 6.285406e+06 7.989127e+06 4.717032e+06 9.561820e+06 7.216522e+06 Prolylleucine_6.947 2.242607e+08 6.912370e+07 2.559243e+07 2.593875e+07 3.759908e+05 2.935619e+07 5.687675e+07 4.813515e+07 236111.66 4.839078e+07 5.267271e+07 4.414375e+07 211611.66 3.163775e+07 3.785430e+07 3.830488e+07 2.322280e+05 5.795746e+07 4.330946e+07 2.720400e+07 2.040915e+05 4.809571e+07 4.717379e+07 4.880866e+07 30434.873 4.296983e+07 4.332955e+07 4.389997e+07 2.380107e+04 5.050429e+07 3.817586e+07 3.564636e+07 166018.53 4.444183e+07 5.019059e+07 4.293285e+07 1.537717e+05 4.147937e+07 4.872831e+07 5.366553e+07 1.629926e+05 3.286134e+07 3.954437e+07 4.963512e+07 1.808695e+05 4.031604e+07 3.825435e+07 4.898624e+07 4.747359e+07 6.087478e+07 2.775850e+07 6.323419e+07 5.425044e+07 3.543659e+07 7.628376e+07 5.099582e+07 6.039065e+07 4.975418e+07 8.221715e+07 5.634898e+07 9.451694e+07 5.384290e+07 5.875191e+07 5.389487e+07 4.718592e+07 3.095765e+07 3.067841e+07 6.211053e+07 4.804675e+07 4.667060e+07 6.127715e+07 3.751482e+07 3.629940e+07 5.041052e+07 4.010906e+07 5.366439e+07 4.457995e+07 6.861930e+07 1.176219e+08 6.396518e+07 5.702324e+07 2.114268e+07 6.403009e+07 1.085778e+07 4.788971e+07 1.196912e+07 4.339241e+07 3.908205e+07 6.767491e+07 6.627230e+07 4.317364e+07 3.779451e+07 3.782919e+07 3.263639e+07 4.615753e+07 1.122659e+07 3.209320e+07 7.643533e+07 3.006527e+07 9.165229e+07 1.489630e+07 5.235834e+07 5.680351e+07 5.893633e+07 3.642163e+07 5.746188e+07 3.340022e+07 5.081307e+07 5.624122e+07 4.437865e+07 2.561647e+07 2.455584e+07 4.035718e+07 3.539951e+07 2.539619e+07 8.677673e+07 2.618279e+07 6.345953e+07 4.683894e+07 5.221545e+07 2.956722e+07 5.593069e+07 1.195294e+07 2.759646e+07 3.381021e+07 4.024490e+07 5.929432e+07 6.319440e+07 5.392235e+07 7.612549e+07 1.563343e+08 4.440687e+07 2.673161e+07 1.884872e+07 5.412021e+07 3.823950e+07 2.966011e+07 6.275834e+07 3.175527e+07 5.115773e+07 4.129932e+07 3.968850e+07 3.120614e+07 4.329447e+07 3.635819e+07 2.897918e+07 4.539694e+07 4.033662e+07 2.484601e+07 2.277702e+07 2.088894e+07 3.657272e+07 3.178875e+07 5.716863e+07 3.717990e+07 5.631512e+07 5.081474e+07 3.991430e+07 4.359515e+07 3.896980e+07 2.351574e+07 6.060105e+07 5.123449e+07 4.693301e+07 3.158833e+07 5.960722e+07 9.088649e+07 6.043360e+07 4.913034e+07 4.319709e+07 6.012224e+07 3.452455e+07 3.911447e+07 8.975530e+07 5.380168e+07 4.076095e+07 3.760106e+07 7.649602e+07 3.965390e+07 2.750710e+07 3.568108e+07 3.545608e+07 4.375131e+07 3.743510e+07 3.002870e+07 3.850663e+07 5.659183e+07 3.776998e+07 1.070493e+07 6.282480e+07 4.574201e+07 5.027608e+07 1.883903e+07 4.590848e+07 2.808587e+07 4.301164e+07 6.546415e+07 5.281249e+07 6.406067e+07 5.349451e+07 6.715393e+07 6.158324e+07 3.685345e+07 4.068139e+07 4.203647e+07 6.440305e+07 5.484655e+07 4.114188e+07 9.602590e+07 7.067407e+07 3.396563e+07 3.169558e+07 6.651012e+07 3.435468e+07 4.481997e+07 6.172286e+07 3.775743e+07 3.968622e+07 4.028653e+07 6.033987e+07 3.256155e+07 2.723983e+07 3.801306e+07 1.301986e+07 6.278108e+07 2.977897e+07 7.271589e+07 3.917079e+07 5.740849e+07 5.136777e+07 7.296684e+07 4.591286e+07 3.870551e+07 4.857404e+07 2.783931e+07 2.729982e+07 6.612704e+07 4.997844e+07 4.155971e+07 2.907604e+07 6.441989e+07 5.344817e+07 4.758852e+07 1.074649e+08 5.084196e+07 4.217379e+07 5.594326e+07 2.889712e+07 9.417861e+07 6.598157e+07 4.794377e+07 6.085009e+07 3.307415e+07 6.693426e+07 1.018335e+08 5.051703e+07 2.521644e+07 4.140506e+07 5.625612e+07 4.455620e+07 7.816507e+07 5.502295e+07 METHIONINE 4.014545e+08 1.686502e+08 1.967680e+08 1.996742e+08 2.095382e+05 2.050475e+08 2.074543e+08 2.105800e+08 180603.95 2.388301e+08 1.917832e+08 2.065033e+08 156676.72 1.824813e+08 1.905680e+08 1.878650e+08 1.786112e+05 2.313369e+08 1.670538e+08 1.744653e+08 1.496181e+05 2.189886e+08 2.327117e+08 1.996715e+08 24199.446 1.968987e+08 1.988625e+08 2.018631e+08 1.897655e+04 1.965827e+08 2.156258e+08 1.922412e+08 133785.93 1.860141e+08 2.039061e+08 2.037706e+08 1.257365e+05 1.870004e+08 2.296975e+08 2.337291e+08 1.281344e+05 1.512829e+08 1.915915e+08 2.281815e+08 1.365800e+05 1.888930e+08 1.776179e+08 2.182935e+08 1.418934e+08 1.857745e+08 1.672626e+08 3.525025e+08 1.949161e+08 1.861615e+08 2.759022e+08 2.607537e+08 2.450018e+08 2.279889e+08 1.636938e+08 1.842633e+08 2.179687e+08 3.953372e+08 1.836386e+08 1.647076e+08 1.387854e+08 1.554359e+08 1.862360e+08 1.360659e+08 1.474906e+08 1.185845e+08 1.431147e+08 2.792015e+08 1.321236e+08 2.026700e+08 2.171975e+08 2.050125e+08 1.331872e+08 1.857744e+08 3.987015e+08 2.129800e+08 1.205356e+08 1.258767e+08 1.448274e+08 3.106092e+07 1.625652e+08 1.645257e+08 1.699390e+08 2.100798e+08 2.262608e+08 2.265909e+08 1.466914e+08 3.225051e+08 7.601309e+07 8.121333e+07 1.398841e+08 2.711245e+08 2.126192e+08 2.359643e+08 1.115568e+08 2.756320e+08 1.849064e+08 2.533868e+08 2.656761e+08 1.669882e+08 1.658372e+08 2.310730e+08 1.484250e+08 2.763324e+08 1.397335e+08 1.710935e+08 9.707758e+07 1.225457e+08 1.951468e+08 1.890133e+08 2.013449e+08 6.211420e+07 1.546197e+08 2.243065e+08 1.312027e+08 1.986285e+08 1.813434e+08 1.849125e+08 9.273799e+07 1.444711e+08 1.104297e+08 1.330186e+08 2.081778e+08 1.383854e+08 2.231668e+08 2.266211e+08 1.945068e+08 1.918166e+08 1.238541e+08 8.988100e+07 2.583130e+08 1.095939e+08 1.446592e+08 1.797936e+08 1.504816e+08 2.885903e+08 1.458989e+08 1.802516e+08 2.808243e+08 2.271537e+08 1.752169e+08 1.045780e+08 2.034652e+08 1.955090e+08 1.762344e+08 1.625059e+08 1.155754e+08 1.072403e+08 2.563799e+08 1.341730e+08 1.781393e+08 2.227347e+08 1.777910e+08 2.990278e+08 1.833768e+08 1.127717e+08 1.970529e+08 1.660896e+08 2.460947e+08 1.201258e+08 1.841453e+08 2.116849e+08 2.363573e+08 2.026852e+08 1.717256e+08 2.103897e+08 1.603371e+08 1.581858e+08 1.976777e+08 1.744698e+08 1.792182e+08 1.511617e+08 1.399061e+08 1.746889e+08 2.053193e+08 1.328022e+08 1.200918e+08 1.902194e+08 1.996660e+08 1.579983e+08 1.633086e+08 2.180886e+08 2.338075e+08 2.412580e+08 1.767302e+08 2.966328e+08 3.532447e+07 1.403224e+08 2.979313e+08 2.619120e+08 1.645166e+08 1.986097e+08 3.333805e+08 2.048254e+08 2.390971e+08 1.831866e+08 3.473379e+08 2.446924e+08 1.011162e+08 4.200933e+08 1.786894e+08 2.052935e+08 1.873860e+08 1.087940e+08 2.415999e+08 3.861683e+07 2.460522e+08 2.555768e+08 1.886953e+08 1.981355e+08 2.098778e+08 2.390944e+08 2.347562e+08 1.643651e+08 2.884416e+08 2.356012e+08 4.357088e+07 3.168064e+08 2.511107e+08 1.915900e+08 2.087363e+08 1.405789e+08 3.159527e+08 3.516359e+08 1.848488e+08 2.782658e+08 1.831104e+08 2.183384e+08 2.638714e+08 1.912820e+08 2.438849e+08 1.581549e+08 4.138789e+08 4.174356e+08 1.279823e+08 4.666649e+07 1.754245e+08 1.747100e+08 1.320213e+08 2.543870e+08 2.768394e+08 1.488368e+08 1.750013e+08 6.320678e+07 1.940934e+08 1.958892e+08 2.196468e+08 2.627319e+08 2.020624e+08 1.945506e+08 2.668029e+08 1.289888e+08 2.325526e+08 1.636413e+08 1.824435e+08 1.065161e+08 2.394878e+08 2.338533e+08 C6 H6 Cl N O3 S2_6.963 1.508818e+07 4.643876e+06 4.289483e+06 5.444382e+06 2.544609e+05 5.009385e+06 5.211416e+06 4.919403e+06 233735.27 5.938034e+06 4.713357e+06 4.976802e+06 197174.60 4.669313e+06 4.537089e+06 4.631033e+06 2.076020e+05 6.251440e+06 4.264437e+06 3.647266e+06 1.648141e+05 5.716914e+06 5.768402e+06 4.916658e+06 35234.766 5.082118e+06 4.656769e+06 5.164271e+06 1.947090e+04 5.274863e+06 5.222195e+06 3.932566e+06 139143.36 5.024054e+06 5.167192e+06 4.905860e+06 1.316831e+05 5.540514e+06 5.014046e+06 5.593202e+06 1.374292e+05 3.849636e+06 4.413420e+06 5.707284e+06 1.431597e+05 5.336614e+06 4.481489e+06 5.124237e+06 4.474493e+06 5.802889e+06 5.573784e+06 1.177838e+07 9.092850e+06 8.724242e+06 8.959200e+06 1.130806e+07 5.733893e+06 8.566036e+06 6.985016e+06 4.009522e+06 6.667052e+06 1.231050e+07 8.366228e+06 6.618960e+06 5.710288e+06 5.727189e+06 7.906235e+06 4.408291e+06 7.050516e+06 5.518397e+06 6.959297e+06 8.890472e+06 5.341443e+06 6.859419e+06 8.383885e+06 7.340606e+06 5.878804e+06 6.038066e+06 1.587490e+07 1.065316e+07 5.284180e+06 4.415462e+06 5.809066e+06 4.327570e+06 7.975534e+06 7.240828e+06 6.905834e+06 9.622486e+06 8.347711e+06 7.786017e+06 4.910790e+06 1.025347e+07 3.045846e+06 3.834479e+06 4.925224e+06 8.415314e+06 1.013226e+07 8.497924e+06 3.772484e+06 1.040349e+07 7.072811e+06 9.127976e+06 8.741568e+06 5.094980e+06 5.286539e+06 8.138762e+06 7.053434e+06 1.004216e+07 5.451680e+06 5.973970e+06 4.149230e+06 4.468767e+06 6.019823e+06 8.993110e+06 8.489567e+06 7.879164e+06 5.712361e+06 9.186111e+06 6.346953e+06 7.325699e+06 7.159855e+06 6.346972e+06 3.407727e+06 4.664946e+06 3.582014e+06 4.794549e+06 7.627038e+06 4.488134e+06 7.591725e+06 7.575015e+06 7.844489e+06 6.584289e+06 4.974540e+06 3.951122e+06 8.269345e+06 3.083906e+06 5.046549e+06 6.059293e+06 5.050866e+06 9.971674e+06 5.471011e+06 5.514088e+06 1.021334e+07 7.749981e+06 6.532219e+06 3.338622e+06 7.394762e+06 6.866246e+06 7.086982e+06 6.392213e+06 3.497188e+06 4.493186e+06 9.822614e+06 5.995336e+06 5.873298e+06 8.675140e+06 8.644979e+06 1.185641e+07 5.391124e+06 5.877872e+06 6.902478e+06 6.065777e+06 7.791357e+06 5.885122e+06 6.432446e+06 6.734762e+06 8.746443e+06 6.212516e+06 7.041373e+06 6.146423e+06 5.313914e+06 6.221167e+06 9.831051e+06 5.589259e+06 5.405900e+06 4.708693e+06 5.743507e+06 8.019315e+06 7.013732e+06 4.205890e+06 8.799605e+05 3.436782e+06 3.533376e+06 2.699721e+06 2.712596e+06 3.307170e+06 3.251712e+06 4.370780e+06 2.095659e+06 4.881909e+06 1.635242e+06 2.721344e+06 2.195045e+05 4.930608e+06 1.527410e+06 3.610660e+06 5.202797e+06 2.639130e+06 2.971957e+06 2.517975e+06 4.293483e+06 2.847520e+06 4.207520e+06 8.610133e+06 2.828928e+06 3.915069e+06 2.810393e+06 1.487705e+06 3.721911e+06 2.347915e+06 3.803762e+06 2.920359e+06 2.998472e+06 3.085192e+06 2.877913e+06 3.678813e+06 3.848882e+06 2.418391e+06 5.197740e+06 3.511798e+06 2.601745e+06 6.550846e+06 4.352815e+06 2.985576e+06 3.278278e+06 2.633170e+06 4.612619e+06 3.618254e+06 2.794805e+06 3.252689e+06 2.205838e+06 3.264046e+06 4.369952e+06 2.577546e+06 3.950694e+06 2.494952e+06 7.139944e+06 7.439810e+06 1.594658e+06 2.576268e+06 5.604314e+06 4.679056e+06 4.155402e+06 8.961662e+06 6.239122e+06 5.369677e+06 5.111066e+06 2.784306e+06 7.095938e+06 7.094331e+06 6.047769e+06 9.322098e+06 7.984584e+06 6.184780e+06 8.835153e+06 4.103424e+06 9.147193e+06 7.202717e+06 6.482728e+06 4.520172e+06 1.063369e+07 1.000168e+07 2-Methylthiazolidine_6.97 1.593338e+07 5.691424e+06 6.783155e+06 7.543344e+06 2.573835e+05 7.440296e+06 6.602756e+06 8.107139e+06 224582.19 8.823281e+06 5.180609e+06 9.269809e+06 214330.16 6.201711e+06 7.283506e+06 6.621876e+06 2.217781e+05 5.885315e+06 6.462155e+06 6.007482e+06 1.725162e+05 7.845397e+06 8.637088e+06 7.514856e+06 27388.207 7.040819e+06 7.317172e+06 7.349428e+06 2.311479e+04 5.480530e+06 7.744911e+06 6.339342e+06 158874.08 6.936457e+06 7.522812e+06 7.347464e+06 1.398721e+05 6.587430e+06 8.182167e+06 8.202716e+06 1.398986e+05 4.969215e+06 7.270648e+06 8.131475e+06 1.820629e+05 6.492379e+06 6.384610e+06 7.582721e+06 4.826884e+06 6.839545e+06 5.697254e+06 1.336699e+07 7.382665e+06 9.019979e+06 1.094471e+07 1.041074e+07 7.835563e+06 1.104979e+07 7.854735e+06 6.265778e+06 8.890532e+06 1.494964e+07 9.270556e+06 7.791119e+06 6.731053e+06 5.367965e+06 6.864927e+06 4.566028e+06 7.102271e+06 5.565326e+06 7.006809e+06 9.474848e+06 5.716544e+06 6.779617e+06 8.113360e+06 7.009215e+06 5.848382e+06 6.887525e+06 1.606908e+07 8.451070e+06 4.972893e+06 4.658060e+06 5.187672e+06 4.785458e+06 7.726359e+06 7.235006e+06 6.264157e+06 8.897113e+06 8.111153e+06 8.033892e+06 4.424196e+06 1.000151e+07 2.612462e+06 8.397500e+06 3.574953e+06 9.144616e+06 9.894728e+06 8.851438e+06 3.253617e+06 1.097859e+07 7.077802e+06 1.013097e+07 1.012934e+07 5.498023e+06 4.374907e+06 9.347998e+06 7.785770e+06 1.096520e+07 5.868395e+06 6.447894e+06 4.363370e+06 3.281939e+06 7.145259e+06 7.290317e+06 7.709686e+06 1.061887e+07 5.173462e+06 8.166849e+06 5.169706e+06 7.081427e+06 6.617052e+06 5.530501e+06 2.200281e+06 4.520427e+06 3.396948e+06 3.326857e+06 7.332704e+06 3.635322e+06 7.785218e+06 9.022105e+06 9.672806e+06 6.619335e+06 3.803716e+06 3.094207e+06 9.760029e+06 3.395109e+06 4.990096e+06 5.947217e+06 5.684888e+06 1.024930e+07 3.993604e+06 7.516314e+06 1.056109e+07 7.704238e+06 6.563573e+06 3.786808e+06 7.233900e+06 6.752103e+06 6.935025e+06 5.881111e+06 3.275987e+06 5.419733e+06 8.497308e+06 6.555762e+06 6.279547e+06 9.043131e+06 7.238873e+06 1.141997e+07 6.585610e+06 3.396972e+06 7.720508e+06 7.073364e+06 9.214718e+06 4.381404e+06 6.537308e+06 6.370656e+06 7.575755e+06 5.461132e+06 6.293370e+06 7.760732e+06 5.942851e+06 7.525204e+06 9.094327e+06 6.277143e+06 5.227683e+06 4.768125e+06 5.802798e+06 7.811859e+06 7.815823e+06 5.251866e+06 4.129688e+06 6.280911e+06 7.484571e+06 5.697422e+06 5.501442e+06 7.725509e+06 8.641421e+06 8.833880e+06 6.246394e+06 1.075206e+07 5.460270e+06 4.863583e+06 9.929348e+06 9.390815e+06 5.448234e+06 6.781163e+06 1.205815e+07 7.382288e+06 7.098532e+06 6.672523e+06 1.273647e+07 8.398583e+06 2.994271e+06 1.565094e+07 5.850666e+06 7.733057e+06 6.610032e+06 3.490476e+06 8.783941e+06 5.752170e+06 8.147297e+06 7.125513e+06 6.950286e+06 7.092156e+06 7.495656e+06 8.278029e+06 8.252613e+06 5.687920e+06 1.161262e+07 8.503170e+06 6.873835e+06 1.203607e+07 9.894472e+06 6.420088e+06 7.082909e+06 4.870390e+06 1.130842e+07 1.282125e+07 7.205775e+06 1.116723e+07 6.512278e+06 7.897942e+06 9.760378e+06 6.819315e+06 8.768001e+06 5.285638e+06 1.625504e+07 1.707914e+07 4.344488e+06 5.523331e+06 7.412411e+06 5.545154e+06 4.707406e+06 9.180750e+06 1.140461e+07 5.034138e+06 5.332475e+06 2.495551e+06 7.272190e+06 7.013552e+06 8.118615e+06 9.495554e+06 7.031989e+06 6.440214e+06 7.020600e+06 4.738268e+06 8.307323e+06 6.010189e+06 6.734471e+06 4.508347e+06 1.001605e+07 1.154812e+07 3-Methylsulfolene_6.97 4.690444e+08 1.924495e+08 2.224846e+08 2.279682e+08 5.372404e+05 2.360280e+08 2.379153e+08 2.406009e+08 473499.52 2.732323e+08 2.164320e+08 2.385331e+08 454698.26 2.082255e+08 2.182362e+08 2.119968e+08 7.337585e+05 2.685072e+08 1.852281e+08 2.004393e+08 3.818416e+05 2.512762e+08 2.650045e+08 2.297346e+08 96228.042 2.250123e+08 2.281428e+08 2.311552e+08 4.989849e+04 2.226953e+08 2.456526e+08 2.169949e+08 340483.74 2.150942e+08 2.332855e+08 2.331536e+08 3.184395e+05 2.129603e+08 2.627326e+08 2.669649e+08 3.237458e+05 1.717774e+08 2.199689e+08 2.624716e+08 3.459772e+05 2.154391e+08 2.007259e+08 2.501030e+08 1.623446e+08 2.117496e+08 1.895657e+08 4.026278e+08 2.241720e+08 2.222878e+08 3.164456e+08 3.025914e+08 2.789577e+08 2.718431e+08 1.900454e+08 2.105342e+08 2.419373e+08 4.546901e+08 2.106332e+08 1.886502e+08 1.576289e+08 1.769368e+08 2.147153e+08 1.543851e+08 1.709290e+08 1.358025e+08 1.834988e+08 3.110292e+08 1.562807e+08 2.326909e+08 2.510965e+08 2.355056e+08 1.675896e+08 2.137343e+08 4.577251e+08 2.464186e+08 1.379447e+08 1.415816e+08 1.653045e+08 1.414482e+08 1.928139e+08 1.876523e+08 1.957016e+08 2.418484e+08 2.613833e+08 2.525806e+08 1.671836e+08 3.642024e+08 8.690649e+07 2.518831e+08 1.612341e+08 3.127559e+08 2.450820e+08 2.620702e+08 1.283993e+08 3.096624e+08 2.092929e+08 2.848764e+08 3.054177e+08 1.910205e+08 1.859333e+08 2.660254e+08 1.704809e+08 3.182838e+08 1.585393e+08 1.973802e+08 1.114821e+08 1.358855e+08 2.241101e+08 2.158609e+08 2.272812e+08 2.450819e+08 1.773963e+08 2.561853e+08 1.566899e+08 2.272573e+08 2.068332e+08 2.111093e+08 1.048003e+08 1.634969e+08 1.259883e+08 1.517048e+08 2.381883e+08 1.566605e+08 2.500525e+08 2.557516e+08 2.243051e+08 2.182867e+08 1.374431e+08 1.041404e+08 2.958251e+08 1.261032e+08 1.657267e+08 2.007062e+08 1.724374e+08 3.307623e+08 1.658744e+08 2.024919e+08 3.197154e+08 2.607443e+08 2.008739e+08 1.204409e+08 2.323835e+08 2.236977e+08 2.024121e+08 1.867360e+08 1.316631e+08 1.278739e+08 2.940212e+08 1.516588e+08 1.977569e+08 2.572069e+08 2.060733e+08 3.340000e+08 2.093646e+08 1.253449e+08 2.269823e+08 1.899094e+08 2.824015e+08 1.396525e+08 2.039649e+08 2.443372e+08 2.705151e+08 2.234658e+08 1.982862e+08 2.404218e+08 1.826779e+08 1.895037e+08 2.279949e+08 2.006751e+08 2.057096e+08 1.714395e+08 1.612195e+08 2.070742e+08 2.321891e+08 1.506890e+08 1.368106e+08 2.164507e+08 2.304342e+08 1.804902e+08 1.867956e+08 2.502274e+08 2.680821e+08 2.777037e+08 1.999873e+08 3.384922e+08 1.506988e+08 1.664663e+08 3.412961e+08 2.984695e+08 1.856770e+08 2.261309e+08 3.867769e+08 2.340052e+08 2.693373e+08 2.136312e+08 3.974884e+08 2.804887e+08 1.141976e+08 4.815828e+08 2.050548e+08 2.361631e+08 2.134608e+08 1.257941e+08 2.771088e+08 1.583714e+08 2.796182e+08 2.893079e+08 2.152006e+08 2.275116e+08 2.338644e+08 2.734087e+08 2.696268e+08 1.879222e+08 3.296874e+08 2.693153e+08 1.820550e+08 3.592360e+08 2.872721e+08 2.185864e+08 2.390635e+08 1.634460e+08 3.589941e+08 4.033831e+08 2.074330e+08 3.198176e+08 2.081712e+08 2.504787e+08 3.015495e+08 2.179615e+08 2.801624e+08 1.803110e+08 4.762422e+08 4.778242e+08 1.414613e+08 1.300295e+08 2.023210e+08 1.988356e+08 1.465225e+08 2.922163e+08 3.209791e+08 1.703514e+08 1.999979e+08 7.246048e+07 2.227571e+08 2.243967e+08 2.516125e+08 2.954330e+08 2.321130e+08 2.220029e+08 2.921728e+08 1.485912e+08 2.596565e+08 1.875971e+08 2.103475e+08 1.272224e+08 2.861249e+08 2.826427e+08 147.51764_6.987 1.050209e+05 9.070934e+06 7.257258e+06 1.114710e+07 2.399643e+05 8.412245e+06 5.829732e+06 1.211751e+07 171191.18 1.181254e+07 6.630747e+06 1.089233e+07 150353.40 6.089705e+06 1.136086e+07 1.057722e+07 1.712592e+05 1.234756e+07 3.167349e+06 3.437040e+06 2.454520e+05 1.763448e+07 3.331915e+06 5.926518e+06 41872.424 4.106591e+05 1.972347e+07 1.015842e+07 3.177441e+04 5.556816e+05 2.696783e+05 1.146505e+07 156059.59 8.662290e+06 1.925510e+05 9.244138e+06 1.358244e+05 9.677103e+06 9.835030e+06 1.206466e+07 1.392823e+05 5.202668e+06 1.123992e+07 4.019451e+06 1.447450e+05 1.158709e+07 7.663500e+06 1.101684e+07 5.669201e+04 4.333021e+04 1.185913e+05 7.176329e+04 6.677766e+04 1.370529e+05 7.957373e+04 5.153852e+05 2.118184e+05 2.990596e+06 1.088876e+05 1.319741e+05 6.957130e+04 7.082519e+04 5.242088e+04 6.026694e+04 6.748685e+04 4.483740e+05 1.038613e+05 5.825555e+04 6.960089e+04 8.492300e+04 7.085531e+04 8.168657e+04 5.559863e+04 9.817099e+04 3.263911e+05 8.020514e+04 8.498579e+04 1.117705e+05 6.327705e+04 6.577658e+04 7.803934e+04 1.462525e+05 5.541804e+04 7.354918e+04 8.792756e+04 5.550911e+04 5.721929e+04 5.070439e+04 9.993458e+04 9.893836e+04 7.744882e+04 5.344038e+04 7.934907e+04 6.421738e+04 5.364853e+04 8.646461e+04 7.150238e+04 6.664522e+04 7.809888e+04 4.956783e+04 3.229276e+05 7.918674e+04 8.950157e+04 2.699714e+05 6.951019e+04 7.552403e+04 6.649769e+04 8.275305e+04 8.110952e+04 7.088059e+04 5.964482e+04 1.057609e+05 8.220017e+04 6.706011e+04 5.030404e+04 6.864226e+04 8.410359e+04 6.497417e+04 6.745467e+04 7.269850e+04 6.233942e+04 6.095364e+04 5.305428e+04 1.022443e+05 5.848125e+04 5.707761e+04 6.424421e+04 4.842581e+04 5.031466e+04 4.719255e+04 8.989122e+04 6.505181e+04 6.074235e+04 9.206810e+04 5.621501e+04 7.490348e+05 8.166688e+04 8.931148e+04 9.665345e+04 9.994740e+04 7.464359e+04 1.523257e+06 5.550731e+04 8.632455e+04 6.549174e+04 6.672969e+04 6.910944e+04 7.064245e+04 5.757720e+04 6.530709e+04 8.640361e+04 9.974463e+04 9.684423e+04 6.452082e+04 1.010911e+05 6.420414e+04 6.250767e+04 6.313264e+04 9.394180e+04 4.715719e+04 8.476444e+04 6.566574e+04 9.331744e+04 9.967556e+04 6.101916e+04 5.598320e+04 6.290046e+04 6.471728e+04 6.659855e+04 5.997795e+04 8.624487e+04 1.045030e+05 6.517628e+04 8.908555e+04 5.059269e+04 4.707057e+04 5.933191e+04 6.271796e+04 5.465321e+04 5.713114e+04 6.232065e+06 1.709973e+07 5.537991e+06 1.167241e+07 9.392243e+06 3.492040e+06 7.354789e+06 1.751678e+06 1.706856e+07 1.726040e+06 8.527538e+06 1.407865e+07 1.044579e+07 1.174256e+07 1.412776e+06 1.427437e+07 7.751735e+06 6.983343e+06 1.104546e+07 5.441328e+06 7.010023e+06 8.187544e+06 5.464586e+04 6.445701e+06 1.622269e+07 9.177215e+06 4.668794e+06 1.429893e+07 1.624631e+07 1.232576e+07 1.546219e+07 2.149390e+07 8.793067e+06 1.641675e+07 4.542815e+06 1.203337e+07 9.608233e+06 4.547196e+06 6.957767e+06 7.543444e+06 1.826357e+07 2.940467e+06 3.049948e+07 3.636009e+06 2.959660e+07 8.777405e+06 9.732386e+06 6.971796e+06 1.485117e+07 1.058076e+07 9.908340e+06 5.779048e+06 9.561562e+06 1.614970e+07 6.453957e+06 8.384947e+06 1.191993e+07 3.013065e+06 1.538920e+07 7.214615e+04 8.374559e+05 6.724775e+04 8.623104e+04 6.536385e+04 6.320432e+04 8.092936e+04 7.707669e+04 7.346199e+04 6.509860e+04 4.906562e+04 5.615265e+04 9.322462e+04 4.996869e+04 1.256281e+06 6.748008e+04 5.432873e+04 7.534951e+04 1.680533e+05 4.894953e+04 5.352029e+04 8.212668e+04 5.733060e+04 C5 H16 N5 O13 P_6.991 4.126664e+04 1.886269e+05 3.465787e+05 3.461541e+05 9.107000e+04 3.901414e+05 3.014741e+05 3.088622e+05 82230.42 3.843858e+05 2.877498e+05 4.941087e+05 75364.72 2.663361e+05 2.859234e+05 3.009811e+05 8.614900e+04 3.728491e+05 1.913597e+05 2.728689e+05 7.936887e+04 3.233254e+05 4.571208e+05 3.841709e+05 12503.977 2.555170e+05 3.299870e+05 4.122610e+05 1.142170e+04 2.236384e+05 3.641089e+05 2.780917e+05 75312.78 2.953908e+05 3.422776e+05 2.912204e+05 6.638600e+04 2.661255e+05 5.214188e+05 4.233625e+05 6.552935e+04 1.272830e+05 3.333835e+05 4.144590e+05 7.565120e+04 2.719635e+05 1.747957e+05 4.381079e+05 3.101146e+04 2.041040e+04 6.691999e+04 3.328333e+04 3.446077e+04 3.289489e+04 4.128254e+04 4.323788e+04 3.145126e+04 4.151626e+04 5.609598e+04 3.085148e+04 3.097921e+04 3.646951e+04 2.440827e+04 2.800248e+04 3.098470e+04 3.115831e+04 2.581516e+04 3.063785e+04 2.773479e+04 2.823011e+04 2.945099e+04 2.910045e+04 3.304421e+04 2.767550e+04 3.531434e+04 2.867333e+04 3.148309e+04 3.433957e+04 3.295180e+04 2.974129e+04 2.024875e+04 2.641663e+04 2.593458e+04 2.406921e+04 3.114194e+04 2.584509e+04 3.121398e+04 2.632111e+04 2.859911e+04 2.572842e+04 3.753772e+04 2.584320e+04 2.785891e+04 2.452138e+04 2.673757e+04 3.918326e+04 3.057676e+04 3.069725e+04 3.202784e+04 2.545576e+04 2.387806e+04 3.172948e+04 2.713378e+04 3.140676e+04 2.627978e+04 3.465042e+04 3.407083e+04 3.240431e+04 2.788886e+04 3.266968e+04 2.768188e+04 2.935888e+04 2.918604e+04 3.174839e+04 2.483805e+04 3.063666e+04 2.338126e+04 2.950752e+04 3.333205e+04 3.148266e+04 2.924676e+04 2.900759e+04 2.599178e+04 3.330052e+04 2.824222e+04 2.596057e+04 2.927536e+04 2.819808e+04 2.371902e+04 2.336108e+04 2.880311e+04 3.364653e+04 3.459948e+04 2.819728e+04 2.165142e+04 2.415911e+04 3.052032e+04 2.710912e+04 2.896421e+04 2.776315e+04 3.026884e+04 3.026919e+04 2.811448e+04 2.879799e+04 2.848161e+04 3.165264e+04 3.000645e+04 3.387383e+04 2.811241e+04 3.401982e+04 2.158844e+04 3.008822e+04 2.784282e+04 3.406433e+04 3.093580e+04 3.012163e+04 3.308111e+04 2.994499e+04 2.614309e+04 2.337627e+04 3.295204e+04 3.199238e+04 3.261864e+04 5.670501e+04 3.077650e+04 2.592549e+04 3.033098e+04 3.178166e+04 2.881347e+04 2.803055e+04 2.375692e+04 3.085998e+04 2.987344e+04 2.662070e+04 2.986966e+04 2.301558e+04 2.957921e+04 2.951700e+04 2.624524e+04 2.558692e+04 1.318044e+06 4.963332e+05 1.081501e+06 5.831238e+05 8.891916e+05 1.574923e+06 1.412013e+06 1.478021e+06 1.058075e+06 1.917970e+06 1.252422e+06 1.174782e+06 1.933124e+06 7.503460e+05 1.688413e+06 7.638736e+05 3.259888e+06 1.557726e+06 2.017018e+06 7.997535e+05 2.647060e+06 2.316208e+06 2.478351e+04 1.546545e+06 7.132308e+05 5.228541e+05 1.024077e+06 4.483915e+05 1.411409e+06 7.627013e+05 1.601394e+06 1.900694e+06 9.897920e+05 1.111789e+06 1.658062e+06 1.608181e+06 1.588726e+06 9.157597e+05 1.569070e+06 1.485214e+06 1.195880e+06 1.189901e+06 1.174773e+06 1.306837e+06 1.437054e+06 6.809410e+05 2.530311e+06 4.653207e+06 1.584511e+06 2.528900e+06 1.067080e+06 1.581236e+06 1.933194e+06 1.275863e+06 1.938836e+06 8.210482e+05 3.370193e+06 3.099369e+06 4.474500e+05 3.202579e+04 2.445404e+04 2.434720e+04 2.901743e+04 2.777160e+04 3.185002e+04 4.640660e+04 2.633720e+04 2.777781e+04 2.757640e+04 2.575250e+04 2.649264e+04 3.564448e+04 2.424253e+04 2.928823e+04 2.910338e+04 2.505293e+04 3.503090e+04 2.587236e+04 2.527319e+04 2.539599e+04 3.219024e+04 2.943243e+04 154.96684_7.004 1.886577e+07 1.263889e+07 9.762000e+06 6.181619e+06 5.614646e+05 1.303405e+07 1.167424e+07 6.410723e+06 571458.75 1.383360e+07 4.446538e+06 1.516511e+07 348154.92 1.001476e+07 1.470458e+07 3.345237e+06 6.127826e+05 1.422036e+07 1.223301e+07 1.693942e+06 6.300193e+05 1.186570e+07 1.347445e+07 1.192616e+07 67241.150 1.545375e+07 7.554455e+06 3.420781e+06 2.227608e+05 2.466009e+06 1.026316e+07 4.424473e+06 1241581.07 1.622894e+07 6.048450e+06 9.365634e+06 1.391859e+06 7.436107e+06 1.036640e+07 2.776536e+06 1.513268e+06 8.544000e+06 7.039327e+06 1.305060e+06 4.102688e+05 1.883810e+07 8.328797e+06 8.666797e+06 1.157809e+06 7.663749e+06 3.067147e+07 3.161946e+06 2.451551e+06 1.697884e+06 1.611669e+07 1.413126e+06 1.300311e+07 7.480442e+05 2.820197e+06 1.836502e+07 3.305573e+06 1.169634e+06 8.224970e+06 4.061356e+06 3.669480e+07 7.828284e+05 1.312346e+06 6.119567e+06 2.642590e+06 5.425048e+06 2.032683e+07 8.787877e+06 8.486739e+05 9.405322e+06 2.243950e+07 9.513185e+05 4.162948e+05 1.803836e+07 6.356312e+06 1.375186e+06 9.354976e+06 3.776575e+06 5.638208e+06 4.282159e+06 1.395153e+07 1.013211e+06 7.982663e+06 1.578416e+06 7.731238e+06 6.459209e+05 1.129101e+07 9.669992e+06 1.192317e+06 7.571203e+06 8.827667e+05 1.646670e+07 1.213625e+06 1.210705e+06 1.487712e+07 1.096105e+07 2.216899e+06 1.964917e+06 9.831634e+06 5.050075e+07 5.968751e+07 2.889219e+06 2.671199e+06 1.134504e+06 9.434918e+05 1.363941e+06 4.038384e+06 1.079975e+06 1.709117e+06 1.976226e+06 3.805968e+06 1.063676e+07 4.668608e+05 1.611456e+07 1.781177e+06 2.237683e+06 2.724528e+06 1.155477e+06 1.074512e+07 1.564892e+06 7.783111e+05 3.055574e+07 1.882914e+07 8.810115e+05 9.202917e+06 1.737751e+06 1.134280e+06 2.287131e+06 4.512409e+05 2.654206e+07 7.696784e+06 7.016577e+06 7.739284e+05 6.928259e+05 2.737178e+06 6.443570e+05 6.603673e+05 1.290916e+06 5.866800e+06 6.082782e+05 1.136745e+07 2.221138e+06 1.297152e+06 1.420056e+06 2.500132e+06 1.291783e+06 3.699145e+06 1.147843e+06 8.275641e+06 3.046123e+06 1.948071e+05 1.825297e+07 2.974645e+06 1.616971e+07 8.396760e+05 9.517905e+06 5.328354e+06 2.086001e+06 8.933030e+06 1.824318e+06 1.640447e+06 3.884454e+06 2.276917e+06 5.973680e+05 1.247683e+06 1.474045e+06 1.035829e+07 7.695047e+05 1.650192e+06 5.835369e+05 1.177221e+06 9.183733e+06 2.452094e+06 2.120171e+06 5.618761e+05 5.691760e+06 1.311207e+07 1.103553e+07 9.580351e+06 7.915279e+06 1.215048e+07 2.196258e+07 3.537742e+06 9.145779e+06 3.523362e+06 1.708718e+07 1.432897e+07 8.171603e+06 1.583449e+08 2.164942e+07 1.764388e+07 2.962685e+06 8.067998e+06 1.364167e+07 1.359470e+07 6.000498e+06 4.470497e+06 7.351365e+06 2.213265e+06 1.108731e+07 1.007951e+07 8.800792e+06 8.617185e+06 4.775059e+06 6.893690e+06 8.762469e+06 1.949299e+07 5.451990e+06 1.718482e+07 2.719022e+07 8.188651e+06 6.147367e+06 7.153334e+06 1.066250e+07 4.395917e+06 3.702401e+06 6.537593e+06 8.456189e+06 1.019020e+07 9.162745e+06 1.685078e+07 7.132207e+06 1.874722e+07 1.414009e+07 4.943221e+06 7.308662e+06 5.286727e+06 8.267476e+06 6.671380e+07 4.394720e+06 9.727634e+06 1.812052e+07 1.041194e+07 2.472003e+07 1.266161e+07 1.080158e+07 5.134889e+06 1.312633e+07 1.112074e+07 1.065524e+07 1.159470e+07 1.148370e+07 2.771358e+07 2.279625e+06 1.286794e+07 7.016791e+06 1.726493e+07 1.865234e+06 1.194366e+07 1.241076e+07 1.427045e+07 1.130415e+07 1.721607e+07 1.292612e+06 5.410688e+05 2.116123e+07 2.635734e+07 6.280790e+06 Acetyl-_-methylcholine_7.004 1.566578e+08 7.448392e+07 9.820856e+07 1.067565e+08 2.030263e+05 3.997909e+07 1.013457e+08 8.095962e+07 187171.49 1.082086e+08 9.298679e+07 1.048772e+08 180516.63 2.552050e+07 1.009588e+08 8.108828e+07 1.674010e+05 9.751358e+07 7.344036e+07 8.647669e+07 1.553937e+05 9.854214e+07 1.135855e+08 2.314006e+07 28328.533 9.557022e+07 9.587238e+07 9.483427e+07 2.257483e+04 8.561759e+07 8.857724e+07 7.796820e+07 136387.35 8.523082e+07 8.492673e+07 8.888469e+07 1.242865e+05 8.327825e+07 9.236296e+07 9.863787e+07 1.236168e+05 6.281513e+07 8.703070e+07 9.524813e+07 1.379218e+05 8.083182e+07 7.878442e+07 9.033076e+07 4.680235e+07 1.020122e+08 1.322140e+08 9.068141e+07 8.214888e+07 9.621799e+07 1.121159e+08 1.208954e+08 1.864974e+08 1.716115e+08 3.443805e+07 1.042925e+08 1.256361e+08 1.077982e+08 7.875662e+07 7.905121e+07 1.508698e+08 5.696920e+07 9.512397e+07 7.211008e+07 9.119453e+07 1.544809e+08 1.483200e+08 1.504257e+08 1.789263e+08 7.017875e+07 1.223412e+08 8.858648e+07 1.313023e+08 6.664357e+07 1.057336e+08 5.432508e+07 7.315507e+07 8.325243e+07 3.712235e+07 4.980883e+07 1.112426e+08 4.459065e+07 2.742806e+07 9.593473e+07 1.087133e+08 4.155085e+07 7.006941e+07 4.525008e+07 1.467150e+08 6.079233e+07 7.438409e+07 8.621637e+07 1.336299e+08 6.898317e+07 9.353822e+07 5.084712e+07 1.089753e+08 7.034070e+07 4.534853e+07 6.634861e+07 4.145904e+07 5.970800e+07 1.427116e+08 1.076520e+08 1.041055e+08 1.270654e+08 5.550841e+07 3.172201e+08 1.012247e+08 1.339567e+08 1.343153e+08 5.332831e+07 1.348503e+08 4.225594e+07 7.122231e+07 9.347244e+07 6.585921e+07 6.168303e+07 8.750135e+07 1.259764e+08 1.093335e+08 6.970270e+07 8.452968e+07 3.313730e+07 5.088484e+07 5.453655e+07 6.879754e+07 1.209299e+08 7.269444e+07 8.645525e+07 1.002357e+08 1.107984e+08 1.249780e+08 1.066775e+08 1.240874e+08 6.819422e+07 7.675921e+07 2.174721e+08 6.627953e+07 1.117800e+08 1.628016e+08 9.252302e+07 7.437259e+07 1.200267e+08 2.081173e+08 7.591913e+07 6.780674e+07 8.133112e+07 1.012594e+08 1.159400e+08 9.139558e+07 9.413043e+07 1.150727e+08 5.808987e+07 7.723514e+07 2.155227e+07 9.821270e+07 9.362004e+07 8.511987e+07 8.880742e+07 5.041750e+07 5.931167e+07 4.670754e+07 1.159386e+08 6.203376e+07 7.720930e+07 9.848334e+07 2.165717e+08 8.429087e+07 3.604686e+07 7.831555e+07 9.210038e+07 7.620894e+07 8.958201e+07 8.198985e+07 8.619092e+07 2.135434e+07 1.142546e+08 6.146469e+07 3.722607e+07 5.921018e+07 5.440548e+07 3.243370e+07 9.752892e+07 5.425483e+07 9.404018e+07 5.976233e+07 9.985719e+07 2.381040e+07 5.669434e+07 3.626469e+07 6.513437e+07 1.350395e+08 1.296816e+08 1.095244e+08 2.276831e+07 1.253015e+08 1.609638e+08 8.120241e+07 1.445860e+08 9.334457e+07 7.754193e+07 9.005118e+07 2.250505e+08 7.950731e+07 6.250594e+07 1.026616e+08 1.079724e+08 9.272710e+07 1.435785e+08 6.479784e+07 1.601347e+08 4.395944e+07 6.799272e+07 1.120202e+08 7.767606e+07 8.263624e+07 4.514014e+07 1.379198e+08 5.862463e+07 6.047598e+07 8.182650e+07 9.303424e+07 6.382033e+07 9.019046e+07 9.826756e+07 9.573610e+07 5.366403e+07 1.377950e+08 7.223281e+07 4.770954e+07 4.494178e+07 9.717931e+07 7.984481e+07 9.459573e+07 5.679962e+07 1.126648e+08 5.691584e+07 9.490079e+07 1.466403e+08 6.263409e+07 6.804994e+07 1.067875e+08 5.919308e+07 6.595917e+07 2.747249e+07 1.164645e+08 8.603995e+07 3.264705e+07 1.050108e+08 8.419380e+07 8.742237e+07 7.173035e+07 1.179523e+08 6.682740e+07 9.004694e+07 5.763670e+07 1.050995e+08 C12 H29 N4 O4 P3_7.006 1.177725e+05 1.053704e+06 1.154928e+06 1.552944e+06 2.872457e+05 1.572222e+06 1.626587e+06 1.429719e+06 232108.82 2.111937e+06 1.436785e+06 1.421969e+06 240122.68 1.044819e+06 1.513649e+06 1.252239e+06 2.526407e+05 1.769495e+06 1.335791e+06 1.216131e+06 2.316124e+05 1.573933e+06 1.740186e+06 1.199324e+06 35473.171 1.417662e+06 1.776178e+06 1.564317e+06 3.034289e+04 1.384618e+06 1.472110e+06 1.337907e+06 204532.18 1.348910e+06 1.488602e+06 1.395620e+06 1.892933e+05 1.606873e+06 1.650505e+06 1.496441e+06 1.832484e+05 8.766423e+05 2.078104e+06 1.423639e+06 1.987095e+05 1.304252e+06 1.253114e+06 1.636363e+06 7.659767e+04 7.068084e+04 2.495856e+05 9.415983e+04 8.838222e+04 8.672869e+04 1.229549e+05 1.263697e+05 8.911566e+04 1.145262e+05 1.519260e+05 9.752850e+04 7.550190e+04 9.155302e+04 7.869097e+04 8.301207e+04 8.861395e+04 7.703129e+04 7.545565e+04 7.908433e+04 7.656159e+04 7.333831e+04 1.131355e+05 8.040699e+04 8.216255e+04 7.845604e+04 9.405317e+04 7.323806e+04 1.129121e+05 9.591720e+04 1.002436e+05 8.526879e+04 6.789745e+04 7.476937e+04 7.648899e+04 7.288057e+04 9.060970e+04 6.974214e+04 7.723037e+04 8.294316e+04 8.229805e+04 7.711785e+04 9.133002e+04 7.441807e+04 7.215324e+04 7.727898e+04 6.758206e+04 1.096240e+05 8.724298e+04 8.445727e+04 1.420298e+05 1.649325e+05 7.403600e+04 7.821699e+04 7.195433e+04 8.091202e+04 6.997005e+04 8.378396e+04 8.600036e+04 8.097014e+04 7.210694e+04 8.061046e+04 6.871729e+04 8.295032e+04 7.372803e+04 8.569067e+04 7.796397e+04 8.429677e+04 9.502011e+04 8.549268e+04 8.138832e+04 1.011284e+05 7.884122e+04 7.637926e+04 6.652110e+04 8.593457e+04 7.285897e+04 7.826606e+04 8.114761e+04 7.276084e+04 7.528658e+04 7.363103e+04 7.410279e+04 9.073265e+04 8.328744e+04 6.801703e+04 7.794487e+04 7.843875e+04 8.512495e+04 7.364992e+04 8.512372e+04 7.782083e+04 7.908304e+04 7.743833e+04 9.066262e+04 7.561146e+04 8.072372e+04 7.682399e+04 8.715242e+04 8.231958e+04 8.545217e+04 9.095269e+04 7.218259e+04 7.256302e+04 7.826697e+04 8.633557e+04 8.654023e+04 8.461369e+04 8.551636e+04 8.354275e+04 7.314476e+04 7.809884e+04 8.233316e+04 9.702897e+04 9.022749e+04 1.400675e+05 8.505611e+04 8.759031e+04 8.645069e+04 8.102416e+04 7.983583e+04 8.293936e+04 7.133592e+04 9.213703e+04 8.791675e+04 7.229114e+04 7.414120e+04 7.401053e+04 7.237199e+04 8.510310e+04 7.461308e+04 7.524180e+04 3.045519e+06 1.915049e+06 2.876770e+06 1.678667e+06 2.790683e+06 3.084181e+06 2.590240e+06 2.517977e+06 2.844703e+06 2.957600e+06 4.133515e+06 3.576117e+06 3.149034e+06 2.418120e+06 3.857434e+06 3.831096e+06 3.620138e+06 3.152019e+06 3.048306e+06 2.312843e+06 4.949877e+06 3.465212e+06 6.947053e+04 5.511994e+06 2.567367e+06 2.147167e+06 3.646834e+06 3.632503e+06 3.496116e+06 3.220531e+06 3.021561e+06 3.920030e+06 3.653658e+06 3.264245e+06 2.254377e+06 2.890766e+06 3.053250e+06 3.251033e+06 2.343139e+06 3.202244e+06 3.085958e+06 3.421353e+06 3.656120e+06 3.135368e+06 3.957567e+06 2.956234e+06 2.873075e+06 2.222106e+06 2.789348e+06 3.286139e+06 3.497589e+06 3.163115e+06 3.988141e+06 3.213420e+06 2.552294e+06 2.271709e+06 2.202807e+06 3.291136e+06 2.386713e+06 8.858240e+04 7.019732e+04 6.840527e+04 7.500760e+04 8.353178e+04 1.009645e+05 1.146773e+05 6.491352e+04 7.666504e+04 7.777376e+04 7.950516e+04 9.239021e+04 8.732295e+04 7.103079e+04 8.837524e+04 7.989100e+04 8.199163e+04 9.632539e+04 7.412784e+04 7.486630e+04 7.302124e+04 8.372460e+04 8.671570e+04 159.52741_7.007 1.538985e+05 6.586690e+06 6.121792e+06 7.201319e+06 3.345681e+05 7.074744e+06 7.224290e+06 7.259794e+06 315558.75 7.574061e+06 6.026366e+06 7.475436e+06 291273.80 6.464475e+06 7.932056e+06 6.006919e+06 2.956840e+05 7.539271e+06 6.248996e+06 5.834579e+06 3.033308e+05 7.232365e+06 7.728122e+06 7.586941e+06 46806.997 6.781347e+06 6.520839e+06 6.499979e+06 4.069463e+04 7.080804e+06 6.908856e+06 7.514444e+06 253142.87 6.460432e+06 7.615568e+06 7.083339e+06 2.493559e+05 6.736480e+06 6.170768e+06 7.997400e+06 2.468383e+05 5.723779e+06 7.243929e+06 7.265549e+06 2.378239e+05 6.248367e+06 6.751323e+06 7.380152e+06 8.884737e+04 8.352718e+04 4.084808e+05 1.543628e+05 1.242721e+05 2.077396e+05 1.475790e+05 5.988245e+05 1.383034e+06 1.423552e+06 8.340031e+05 1.145590e+05 1.482710e+05 5.313761e+05 1.163221e+05 1.813002e+05 1.349092e+05 3.536878e+05 9.354516e+04 2.178004e+05 1.438359e+05 1.904213e+05 1.500534e+05 1.308750e+05 1.183168e+05 9.937236e+04 2.330845e+05 9.995263e+04 1.364886e+05 2.243710e+05 1.515301e+05 1.204638e+05 1.771491e+05 8.843985e+04 1.027467e+05 4.918836e+05 1.108167e+05 8.775564e+04 8.934026e+04 9.718051e+04 1.035682e+05 9.940053e+04 1.145941e+05 1.038866e+05 9.852504e+04 1.023677e+05 9.601557e+04 1.304626e+05 1.270483e+05 1.216722e+05 1.693893e+05 9.475592e+04 2.595648e+05 1.035108e+05 1.001641e+05 2.325667e+05 9.079010e+04 1.068294e+05 1.081247e+05 1.075321e+05 9.983071e+04 1.020787e+05 8.731247e+04 1.080127e+05 1.006360e+05 1.135700e+05 9.865797e+04 1.072735e+05 1.230878e+05 1.166174e+05 2.004113e+05 1.437709e+05 1.038006e+05 9.936407e+04 8.417949e+04 2.780885e+05 9.396726e+04 2.174358e+05 1.155666e+05 7.762849e+04 2.586799e+05 1.001134e+05 1.165016e+05 1.173727e+05 9.505861e+04 1.470508e+05 9.243639e+04 3.489806e+05 9.406209e+04 1.021306e+05 1.147531e+05 1.037519e+05 1.032329e+05 8.226974e+05 1.265491e+05 1.189770e+05 1.061145e+05 1.616584e+05 1.838237e+05 1.035876e+05 1.108048e+05 1.261067e+05 9.067396e+04 9.425732e+04 9.947272e+04 1.071098e+05 1.081942e+05 1.190178e+05 1.081771e+05 1.140265e+05 9.615075e+04 1.664196e+05 1.018331e+05 1.427133e+05 1.690749e+05 1.567443e+05 1.096284e+05 1.137142e+05 1.165483e+05 1.030900e+05 1.304067e+05 1.111692e+05 9.354437e+04 1.432321e+05 1.189635e+05 1.510754e+05 8.045896e+04 9.540018e+04 1.511293e+05 1.287618e+05 8.808481e+04 9.034203e+04 1.169697e+07 8.274372e+06 9.585176e+06 1.052000e+07 8.702581e+06 6.303658e+06 9.449040e+06 1.160068e+07 9.973090e+06 1.118792e+07 1.658270e+07 1.009795e+07 1.245950e+07 1.005502e+07 1.243965e+07 1.083293e+07 1.036225e+07 1.066271e+07 1.141074e+07 8.860086e+06 1.278154e+07 1.136261e+07 9.264992e+04 1.160694e+07 9.664259e+06 6.617802e+06 1.109606e+07 1.112504e+07 1.042249e+07 9.473820e+06 1.503433e+07 1.233968e+07 1.043725e+07 1.016324e+07 7.926860e+06 1.006863e+07 1.092033e+07 1.573089e+07 7.799687e+06 1.051489e+07 1.109865e+07 1.166928e+07 9.658105e+06 1.013192e+07 1.149715e+07 8.196267e+06 1.234123e+07 1.012671e+07 9.867603e+06 1.140780e+07 1.686026e+07 1.031608e+07 1.046513e+07 1.168582e+07 8.840908e+06 9.090524e+06 1.221919e+07 1.133466e+07 9.238430e+06 1.117246e+05 3.854999e+05 1.325998e+05 1.016160e+05 1.599296e+05 1.216418e+05 1.275142e+05 8.828340e+04 9.530596e+04 9.647776e+04 1.659666e+05 1.379357e+05 1.295632e+05 1.076941e+05 9.630838e+05 1.080603e+05 9.644070e+04 1.289479e+05 1.701592e+05 1.357312e+05 1.376792e+05 1.444997e+05 1.129857e+05 C5 H13 N6 O2 P_7.015 2.365288e+06 1.205502e+06 1.503704e+06 1.474080e+06 2.180882e+05 1.936290e+06 1.597368e+06 2.122475e+06 177283.28 1.459164e+06 1.513373e+06 2.051530e+06 166911.46 1.201004e+06 1.817836e+06 1.322918e+06 1.757233e+05 1.588303e+06 1.405346e+06 1.548715e+06 1.658670e+05 1.611331e+06 1.816504e+06 1.941271e+06 26672.546 1.391543e+06 1.672299e+06 1.696208e+06 2.407862e+04 1.202960e+06 1.829719e+06 1.438116e+06 145407.76 1.404714e+06 2.128604e+06 1.579348e+06 1.321517e+05 1.257696e+06 1.891089e+06 1.960710e+06 1.349311e+05 1.004877e+06 1.695788e+06 2.093698e+06 1.580236e+05 1.172867e+06 1.457753e+06 1.752674e+06 9.280409e+05 1.026029e+06 7.723496e+05 1.749936e+06 1.078103e+06 8.203300e+05 1.640856e+06 1.647921e+06 2.162661e+06 2.721527e+06 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1.783030e+06 1.377988e+06 1.328421e+06 1.338809e+06 1.599724e+06 1.936884e+06 1.386978e+06 1.994359e+06 1.621402e+06 1.425634e+06 1.529673e+06 1.405301e+06 2.118404e+06 1.738238e+06 1.055950e+06 1.713988e+06 1.337601e+06 1.636769e+06 2.182223e+06 1.455415e+06 1.943609e+06 2.039992e+06 1.363073e+06 1.158131e+06 2.045865e+06 1.666954e+06 1.589081e+06 9.593887e+05 1.466266e+06 1.243836e+06 1.635947e+06 1.461213e+06 1.291432e+06 1.243093e+06 9.544569e+05 9.950342e+05 1.187545e+06 1.193645e+06 2.318923e+06 8.714816e+05 9.181963e+05 2.687433e+06 1.638819e+06 6.977413e+05 1.220374e+06 7.893945e+05 7.959435e+05 9.629250e+05 8.419226e+05 1.301048e+06 421.0807_7.017 1.093453e+05 9.916108e+05 1.187878e+06 1.203073e+06 2.855766e+05 1.019330e+06 1.050006e+06 9.501707e+05 242361.28 1.306947e+06 1.109350e+06 1.270410e+06 197237.53 8.496988e+05 1.039607e+06 8.752424e+05 1.750478e+05 1.706692e+06 9.363003e+05 9.413664e+05 1.930964e+05 1.048440e+06 1.371090e+06 1.186983e+06 33978.784 9.402049e+05 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6.330971e+06 2.112276e+06 2.497222e+06 2.963923e+06 2.850143e+06 3.956949e+06 3.912783e+06 3.016682e+06 4.739792e+06 3.771118e+06 5.986596e+06 3.729074e+06 6.607109e+06 1.828324e+06 5.322743e+06 3.267591e+06 5.750664e+06 3.829740e+06 2.864846e+06 2.381930e+06 7.481042e+06 4.373874e+06 6.111892e+04 2.960331e+06 3.110840e+06 1.455694e+06 3.329314e+06 3.802725e+06 3.841946e+06 3.498319e+06 3.826786e+06 4.055916e+06 5.904943e+06 3.723333e+06 3.300876e+06 3.173716e+06 2.870716e+06 4.062303e+06 2.083297e+06 3.795334e+06 4.438211e+06 3.708900e+06 3.725330e+06 3.373411e+06 3.750239e+06 3.380964e+06 5.913965e+06 6.232582e+06 3.028925e+06 4.832981e+06 4.173953e+06 4.429869e+06 3.998628e+06 1.921441e+06 4.698491e+06 3.168578e+06 5.114548e+06 3.753422e+06 4.036324e+06 9.306106e+04 6.378280e+04 7.639106e+04 7.530524e+04 8.951288e+04 7.773933e+04 1.049376e+05 6.500772e+04 6.579880e+04 5.346921e+04 5.827758e+04 7.750142e+04 7.394259e+04 6.898608e+04 9.408941e+04 8.510603e+04 5.782670e+04 1.035992e+05 6.319720e+04 5.305795e+04 6.437094e+04 7.287748e+04 5.768796e+04 C4 H8 N6 O4_7.018 2.341071e+06 6.682884e+07 1.451772e+08 1.677373e+08 4.271109e+05 1.767042e+08 2.207742e+08 7.174134e+07 278148.54 2.821280e+08 1.452325e+08 1.464482e+08 248237.18 1.232444e+08 2.427172e+08 9.631101e+07 2.512716e+05 1.935065e+08 1.497637e+08 1.034937e+08 2.661614e+05 1.854072e+08 2.019840e+08 1.224178e+08 38240.828 1.566672e+08 2.236979e+08 1.298986e+08 3.129401e+04 1.674598e+08 1.495507e+08 1.429267e+08 186794.15 1.534553e+08 1.976830e+08 1.896777e+08 1.715846e+05 1.360887e+08 1.691974e+08 1.983730e+08 1.818349e+05 8.436645e+07 1.752491e+08 1.860127e+08 1.856743e+05 1.402019e+08 1.441339e+08 1.800242e+08 2.476312e+05 1.536416e+05 3.235312e+05 4.954360e+05 2.667833e+05 1.980707e+06 4.981656e+05 8.735630e+06 1.545155e+07 1.980782e+07 1.324594e+07 1.375972e+06 3.998052e+05 1.069789e+07 3.872296e+05 4.884820e+05 1.150565e+06 3.664927e+06 1.019879e+06 3.488846e+05 2.377834e+05 4.138063e+05 2.821758e+06 5.464512e+05 5.120476e+05 1.164718e+06 2.488006e+06 6.045136e+05 4.545673e+05 9.993049e+05 1.135221e+06 2.850094e+05 9.198397e+05 1.591238e+06 4.042873e+05 3.794298e+06 2.571382e+05 1.266735e+05 1.476346e+05 2.735586e+05 1.069785e+05 2.987914e+05 2.738251e+05 4.192352e+05 9.060925e+05 5.516711e+05 1.889925e+05 4.320595e+05 8.177125e+05 1.507922e+05 2.187401e+05 2.471728e+05 1.895022e+06 4.706237e+05 2.638670e+05 1.490431e+06 1.330680e+05 1.479664e+05 2.400277e+05 1.609103e+05 1.472545e+05 2.486136e+05 3.012396e+05 1.610831e+06 2.409771e+06 2.995301e+05 3.045438e+05 2.757715e+05 1.833248e+06 1.212650e+05 2.613457e+06 5.272927e+05 7.688186e+04 2.030362e+05 5.323182e+05 1.550013e+06 1.062431e+06 2.696840e+05 1.083070e+06 9.577409e+04 5.860084e+05 6.004153e+05 4.286211e+05 2.368699e+05 8.460857e+05 3.421645e+05 7.648879e+05 3.357884e+06 1.115834e+06 5.202112e+05 2.983884e+05 1.281362e+06 2.763403e+05 8.376293e+06 2.050839e+05 4.320062e+05 3.842162e+05 2.835929e+05 2.123684e+06 2.416851e+05 3.756112e+05 7.525652e+05 7.256153e+05 3.669097e+05 9.100844e+04 7.571038e+05 2.187439e+05 7.545934e+05 1.326417e+06 4.778265e+05 3.490622e+05 4.701682e+05 2.204210e+05 8.077429e+05 6.677294e+05 3.177017e+05 1.519114e+05 2.897760e+05 3.078327e+05 2.245465e+05 2.688348e+05 2.734322e+05 1.734812e+06 8.919285e+05 2.573745e+05 3.805023e+05 1.016089e+05 1.987451e+05 5.573725e+05 3.673378e+05 1.080032e+06 7.672476e+05 3.384159e+08 1.169613e+08 2.129446e+08 2.522729e+08 2.160715e+08 2.224105e+08 1.758681e+08 1.689885e+08 8.180368e+07 2.473902e+08 2.967303e+08 3.572157e+08 8.972873e+07 1.680405e+08 2.540227e+08 5.294247e+07 1.922453e+08 2.127312e+08 2.911304e+08 1.899549e+08 3.898475e+08 2.424095e+08 1.908451e+05 3.461501e+08 1.488997e+08 1.845931e+08 3.749722e+08 3.858519e+08 2.954739e+08 4.249761e+08 3.137305e+08 2.279354e+08 2.641139e+08 2.292229e+08 1.358091e+08 1.915230e+08 3.074264e+08 2.235451e+08 1.845550e+08 3.160730e+08 2.210399e+08 2.608787e+08 2.902985e+08 1.932964e+08 1.671613e+08 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1.096678e+05 4.761419e+04 4.757638e+04 4.770875e+04 4.896735e+04 5.536988e+04 452.05837_7.034 1.284123e+05 6.797913e+07 9.858267e+07 8.211192e+07 3.411984e+05 8.955706e+07 3.692136e+07 3.993580e+07 273925.65 1.462900e+08 6.529282e+07 9.818275e+07 236018.54 5.007135e+07 1.353509e+08 9.353322e+07 2.377093e+05 5.291071e+07 3.731824e+07 3.812947e+07 2.283329e+05 1.264265e+08 5.270659e+07 9.963676e+07 26493.315 8.324590e+07 9.370740e+07 8.790519e+07 2.264161e+04 8.359728e+07 4.011474e+07 1.186371e+08 163132.34 3.758115e+07 1.022553e+08 1.093652e+08 1.692533e+05 3.328286e+07 1.345642e+08 6.223348e+07 1.842681e+05 3.279199e+07 4.811289e+07 1.290456e+08 1.576089e+05 8.478427e+07 6.858305e+07 7.978838e+07 5.479839e+04 6.651959e+04 2.683012e+05 8.527576e+04 6.346386e+04 1.363207e+05 1.040776e+05 7.343027e+05 2.788539e+06 4.122763e+06 2.040450e+06 1.109705e+05 5.896121e+04 8.694932e+05 7.583138e+04 7.533332e+04 8.568623e+04 7.712719e+04 7.910268e+04 6.410683e+04 7.411929e+04 5.344106e+04 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6.229319e+04 9.252917e+04 6.915941e+04 9.863063e+04 5.571950e+04 6.526666e+04 6.670522e+04 7.168072e+04 1.155998e+05 7.114189e+04 1.074424e+05 6.075392e+04 7.440462e+04 5.952487e+04 8.422210e+04 8.304862e+04 8.912642e+04 7.066357e+04 8.077277e+04 7.155550e+04 6.816042e+04 7.558658e+04 7.326447e+04 7.684486e+04 7.903108e+04 8.298854e+04 4.951422e+04 5.173097e+04 8.078016e+04 5.989385e+04 8.193803e+04 9.134142e+04 7.508136e+04 3.626653e+08 1.598310e+08 1.939920e+08 1.941184e+08 2.552131e+08 1.250709e+08 1.089551e+08 1.764374e+08 2.939581e+08 3.318974e+08 3.459363e+08 6.042325e+07 5.378138e+08 2.195839e+08 5.062821e+08 7.334764e+07 5.137357e+08 3.198358e+08 2.539215e+08 1.885916e+08 4.260634e+08 4.959388e+08 6.207022e+04 3.049938e+08 1.084371e+08 1.406347e+08 2.225790e+08 2.381216e+08 2.604071e+08 2.052675e+08 3.439763e+08 3.105392e+08 2.448921e+08 9.536105e+07 1.946208e+08 2.409247e+08 2.581256e+08 3.378323e+08 6.008083e+07 3.915240e+08 3.571993e+08 1.234710e+08 7.571413e+07 2.371225e+08 2.795961e+08 1.721014e+08 1.609164e+08 6.048602e+08 2.326745e+08 2.608245e+08 3.635976e+08 3.372155e+08 3.576671e+08 3.949124e+08 2.104120e+08 1.887592e+08 3.261397e+08 1.999409e+08 2.959229e+08 1.134718e+05 3.071105e+05 9.752656e+04 4.990298e+04 1.098008e+05 9.013317e+04 8.225066e+04 4.786275e+04 6.802508e+04 1.017197e+05 7.060903e+04 9.251367e+04 6.089049e+04 9.300262e+04 2.074889e+06 1.019608e+05 7.962419e+04 1.236476e+05 6.783370e+04 6.613443e+04 6.933696e+04 5.537978e+04 7.591721e+04 C13 H25 N3 O4 P2 S2_7.034 6.357098e+04 1.296140e+05 2.404835e+05 2.284962e+05 1.702444e+05 1.400011e+05 3.469733e+05 1.540271e+05 174906.41 1.058303e+05 2.154596e+05 2.032162e+05 170379.06 2.016262e+05 1.923541e+05 1.579710e+05 2.052059e+05 2.646131e+05 1.552400e+05 1.846248e+05 1.850150e+05 1.564459e+05 2.963338e+05 3.346925e+05 28504.979 1.764550e+05 1.371866e+05 1.454321e+05 3.053946e+04 1.465486e+05 2.694056e+05 1.921800e+05 152776.96 1.746639e+05 8.742510e+04 2.287827e+05 1.101113e+05 1.983830e+05 2.475332e+05 2.360774e+05 1.159664e+05 1.923606e+05 1.743478e+05 2.102906e+05 1.735777e+05 1.580936e+05 1.390674e+05 2.328970e+05 9.023118e+04 5.853335e+04 3.503249e+05 4.934092e+04 5.433631e+04 5.240307e+04 9.205488e+04 1.377978e+05 7.025794e+04 8.544363e+04 6.222859e+04 8.080621e+04 6.101311e+04 7.289560e+04 6.836373e+04 4.575439e+04 5.124686e+04 6.672324e+04 6.005244e+04 5.182844e+04 5.681475e+04 6.532471e+04 7.977742e+04 5.856653e+04 7.777743e+04 5.464730e+04 8.365733e+04 6.490049e+04 8.881552e+04 6.548315e+04 7.652086e+04 4.570870e+04 5.337582e+04 5.817429e+04 4.089682e+04 6.577880e+04 6.969168e+04 5.049022e+04 6.756289e+04 6.452442e+04 5.477205e+04 5.188409e+04 5.364999e+04 5.414960e+04 7.108050e+04 6.269722e+04 5.462364e+04 7.939592e+04 4.810394e+04 5.079040e+04 1.144157e+05 6.261887e+04 6.165142e+04 7.258164e+04 5.642455e+04 5.295791e+04 3.894491e+04 6.411448e+04 5.886543e+04 7.201339e+04 6.379041e+04 6.533913e+04 7.290937e+04 6.263236e+04 8.910349e+04 5.567692e+04 6.488357e+04 5.348954e+04 7.593382e+04 4.639309e+04 6.183769e+04 4.819927e+04 5.151841e+04 5.358597e+04 4.883610e+04 7.943332e+04 5.468881e+04 4.297926e+04 6.346216e+04 7.165932e+04 6.192924e+04 6.043682e+04 6.728393e+04 5.204653e+04 7.002188e+04 6.473416e+04 6.013482e+04 6.222845e+04 8.495386e+04 6.043098e+04 7.496123e+04 5.982134e+04 5.195037e+04 7.269633e+04 6.581148e+04 6.226504e+04 5.509300e+04 6.172774e+04 5.419552e+04 6.345679e+04 6.850523e+04 4.576859e+04 7.505116e+04 6.792572e+04 5.486553e+04 5.628880e+04 5.932571e+04 6.489856e+04 5.592676e+04 6.383477e+04 5.660512e+04 6.455562e+04 5.327134e+04 6.049336e+04 6.676540e+04 1.126722e+05 4.925207e+04 7.289227e+04 4.298116e+04 5.937366e+04 4.957058e+04 4.422182e+04 5.546667e+04 6.479551e+04 4.963738e+04 5.781005e+04 7.449158e+04 6.055926e+04 6.015334e+04 4.912476e+04 7.632645e+04 6.200164e+04 1.709708e+06 3.705439e+05 1.482091e+06 8.631838e+05 1.607464e+06 1.277188e+06 1.386913e+06 1.737935e+06 2.073180e+06 1.207674e+06 3.748938e+06 1.820514e+06 2.195009e+06 6.573764e+05 1.704184e+06 1.320794e+06 2.392896e+06 3.786437e+06 2.732599e+06 1.298087e+06 2.835738e+06 2.714339e+06 3.898225e+04 8.747895e+05 1.074097e+06 5.135671e+05 1.763242e+06 1.916042e+06 1.591674e+06 1.150316e+06 1.252328e+06 1.677866e+06 1.971558e+06 1.881267e+06 1.804029e+06 1.694812e+06 1.222344e+06 1.224056e+06 1.216088e+06 1.646874e+06 1.749203e+06 1.317512e+06 2.034928e+06 1.560562e+06 1.514644e+06 1.444572e+06 1.552308e+06 2.776620e+06 1.641824e+06 1.852717e+06 1.541332e+06 1.465087e+06 1.569195e+06 1.736131e+06 1.970757e+06 1.439968e+06 1.525205e+06 1.338695e+06 1.305896e+06 5.774316e+04 5.271526e+04 5.492780e+04 6.187829e+04 5.763928e+04 7.979823e+04 1.110504e+05 6.556147e+04 6.007198e+04 5.905255e+04 6.142149e+04 7.603924e+04 7.099656e+04 6.371246e+04 7.195239e+04 5.273051e+04 6.738622e+04 6.766275e+04 3.949773e+04 5.817223e+04 4.177009e+04 6.942721e+04 6.638189e+04 "(2E)-Penta-2,4-dienoic acid_7.035" 6.222507e+05 5.373338e+06 1.254777e+07 1.308445e+07 6.415100e+05 1.020488e+07 1.267411e+07 1.237214e+07 475158.09 1.533651e+07 1.101379e+07 1.386406e+07 456513.41 4.050917e+06 1.393157e+07 1.072390e+07 4.516925e+05 1.339342e+07 8.997143e+06 9.555403e+06 3.975714e+05 1.221213e+07 1.328025e+07 1.172490e+07 223058.825 1.109209e+07 1.156091e+07 1.142830e+07 4.867147e+04 1.077183e+07 1.153100e+07 1.252745e+07 326075.81 1.156776e+07 1.220782e+07 1.356533e+07 5.116935e+05 3.908374e+06 1.568257e+07 1.573223e+07 4.338096e+05 3.329354e+06 1.614168e+07 1.576964e+07 4.188994e+05 3.596595e+06 1.224364e+07 1.227483e+07 5.455326e+05 2.835645e+05 7.447479e+05 6.975591e+05 3.829316e+05 4.561617e+05 4.458201e+05 1.173660e+06 1.526373e+06 1.754810e+06 1.331531e+06 7.889386e+05 1.802803e+05 1.281008e+06 3.699951e+05 6.422547e+05 8.128738e+05 1.008953e+06 1.946595e+05 5.532048e+05 3.150444e+05 3.831153e+05 6.211777e+05 3.192601e+05 7.310386e+05 3.754272e+05 4.904714e+05 2.362309e+05 4.587051e+05 3.168407e+05 4.254276e+05 4.620401e+05 3.419576e+05 2.985479e+05 3.644014e+05 5.298723e+05 3.818761e+05 3.405374e+05 4.299777e+05 4.297135e+05 4.571338e+05 2.497728e+05 1.891832e+05 3.408531e+05 3.870552e+05 1.542944e+05 2.144717e+05 3.093488e+05 4.711377e+05 2.555404e+05 3.286503e+05 2.828936e+05 3.948089e+05 5.312349e+05 1.655907e+05 7.348991e+05 2.076517e+05 3.809564e+05 3.283839e+05 3.186328e+05 2.448915e+05 2.225381e+05 3.574291e+05 3.508313e+05 4.114062e+05 2.644303e+05 1.504450e+05 4.579762e+05 3.360238e+05 4.424349e+05 4.428207e+05 4.111068e+05 2.661826e+05 4.942875e+05 2.312017e+05 2.399490e+05 6.018393e+05 5.472941e+05 3.997700e+05 3.110922e+05 3.141549e+05 2.030229e+05 2.589877e+05 4.000520e+05 4.747976e+05 2.767073e+05 1.632808e+05 5.715924e+05 7.644727e+05 2.891398e+05 2.029260e+05 3.671009e+05 5.021615e+05 1.061084e+06 3.192534e+05 3.768934e+05 3.468197e+05 5.475113e+05 5.251050e+05 2.599551e+05 2.640315e+05 3.652573e+05 3.364566e+05 3.716061e+05 1.449226e+05 6.642383e+05 1.968705e+05 4.608227e+05 2.714275e+05 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2.925731e+07 2.695097e+07 1.589307e+07 3.683633e+07 9.750444e+06 3.348780e+05 4.934286e+05 2.924738e+05 4.170268e+05 2.964112e+05 3.732183e+05 5.361447e+05 1.870623e+05 1.596053e+05 3.903308e+05 1.785086e+05 3.664411e+05 3.503152e+05 3.255562e+05 1.247307e+06 5.691128e+05 2.288376e+05 3.249990e+05 5.500900e+05 2.808389e+05 3.669692e+05 2.431123e+05 2.204122e+05 5-Ethyl-4-hydroxy-3(2H)-furanone_7.035 1.156838e+06 5.742840e+07 7.283661e+07 6.745684e+07 9.426381e+05 7.309551e+07 7.967760e+07 7.010631e+07 670508.42 9.063881e+07 6.443037e+07 8.088518e+07 544635.09 6.122484e+07 8.141164e+07 6.334761e+07 6.190919e+05 8.001632e+07 6.033871e+07 5.855288e+07 6.155982e+05 7.977100e+07 8.969134e+07 6.383195e+07 94790.957 7.254378e+07 7.676927e+07 7.355113e+07 1.182737e+05 6.836053e+07 7.362598e+07 7.179211e+07 562216.41 7.249443e+07 6.997641e+07 7.370133e+07 4.646041e+05 6.914460e+07 8.047210e+07 7.956479e+07 4.594118e+05 5.175119e+07 7.913944e+07 8.181419e+07 5.605631e+05 6.718705e+07 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3.763279e+08 2.143488e+08 1.358604e+06 2.049044e+08 1.908798e+08 9.714136e+07 2.109889e+08 2.321524e+08 2.405354e+08 2.106104e+08 2.050848e+08 2.220358e+08 2.333389e+08 2.009121e+08 1.708968e+08 6.418388e+07 1.673043e+08 2.001458e+08 1.373454e+08 2.241757e+08 2.425562e+08 1.695570e+08 1.914896e+08 1.843210e+08 2.232505e+08 1.607078e+08 2.624092e+08 3.255065e+08 4.340701e+07 2.685454e+08 2.425355e+08 2.087359e+08 2.216789e+08 2.420431e+08 1.882022e+08 1.666111e+08 7.781320e+07 2.170881e+08 2.291836e+08 1.103706e+06 3.114968e+06 9.622503e+05 9.286094e+05 8.236714e+05 1.551591e+06 3.434625e+06 9.966569e+05 7.291457e+05 1.454123e+06 4.095801e+05 7.678702e+05 4.376058e+05 1.714827e+06 6.225730e+06 8.618907e+05 2.273221e+05 8.375279e+05 2.193828e+06 6.702716e+05 1.378034e+06 8.365903e+05 8.358820e+05 C8 H19 N3 O5 P2_7.035 9.116490e+04 2.747421e+07 2.826494e+07 3.121117e+07 2.292504e+05 3.086954e+07 3.181543e+07 3.502562e+07 169160.32 3.497001e+07 3.016070e+07 4.628687e+07 150038.40 2.704153e+07 1.032492e+07 2.996280e+07 1.885200e+05 4.071140e+07 3.275938e+07 3.576003e+07 2.124796e+05 3.986990e+07 1.644064e+07 1.757768e+07 33793.155 3.627104e+07 3.869961e+07 3.327909e+07 2.358280e+04 2.847436e+07 3.488547e+07 3.658853e+07 143450.60 2.638572e+07 3.117418e+07 3.514113e+07 1.881397e+05 2.797441e+07 3.960993e+07 1.400568e+07 1.644862e+05 2.744882e+07 3.799076e+07 4.087558e+07 1.546016e+05 2.818966e+07 2.583578e+07 3.426647e+07 5.522796e+04 5.183433e+04 2.710372e+05 7.677425e+04 5.597894e+04 6.125419e+04 8.373411e+04 9.087256e+04 8.822589e+04 2.093914e+05 8.258853e+04 7.182621e+04 5.242567e+04 6.084120e+04 6.167770e+04 6.800271e+04 7.766690e+04 5.399478e+04 6.272437e+04 5.690952e+04 5.745652e+04 6.608413e+04 9.002256e+04 6.419102e+04 5.434996e+04 7.117850e+04 6.688731e+04 5.455203e+04 9.075182e+04 7.930208e+04 6.914132e+04 6.938816e+04 5.163657e+04 5.484300e+04 6.768766e+04 5.972212e+04 7.543634e+04 5.146195e+04 5.551918e+04 5.746999e+04 6.951724e+04 6.795584e+04 4.556244e+04 5.195430e+04 6.065613e+04 5.805934e+04 5.497919e+04 7.627450e+04 7.129245e+04 6.485958e+04 1.107183e+05 5.588782e+04 5.579094e+04 5.568109e+04 6.200507e+04 5.907704e+04 4.831180e+04 5.176891e+04 5.759322e+04 5.523107e+04 5.625981e+04 6.863617e+04 5.940240e+04 8.011438e+04 7.999240e+04 7.447499e+04 5.751093e+04 6.107997e+04 1.004361e+05 6.960579e+04 5.378565e+04 6.064761e+04 6.540169e+04 6.303060e+04 5.107243e+04 6.100950e+04 6.064170e+04 6.451739e+04 6.739462e+04 4.864644e+04 5.467240e+04 5.345003e+04 6.398765e+04 6.820046e+04 5.581235e+04 5.073079e+04 5.288608e+04 6.231443e+04 6.290539e+04 6.374042e+04 7.743451e+04 7.898424e+04 6.231075e+04 6.777637e+04 5.885787e+04 6.043000e+04 6.270299e+04 6.439613e+04 6.753677e+04 5.329164e+04 6.206583e+04 5.839584e+04 6.618519e+04 5.292721e+04 7.031805e+04 5.892140e+04 7.275932e+04 6.974899e+04 6.337776e+04 6.549175e+04 7.449599e+04 5.699447e+04 5.235068e+04 7.288107e+04 7.411656e+04 8.589800e+04 6.369624e+04 6.532035e+04 6.422312e+04 6.330877e+04 6.447167e+04 6.489054e+04 5.077014e+04 7.745381e+04 7.100634e+04 6.224868e+04 5.281240e+04 5.461517e+04 5.298613e+04 7.453186e+04 7.157123e+04 5.879168e+04 1.846011e+08 8.525185e+07 4.913561e+07 2.916321e+07 5.116229e+07 6.777689e+07 5.404669e+07 5.442875e+07 7.128830e+07 6.883712e+07 1.047793e+08 4.813464e+07 1.558112e+08 3.155604e+07 1.242778e+08 5.339655e+07 1.225257e+08 9.985589e+07 9.575577e+07 4.807862e+07 1.548045e+08 1.712438e+08 5.632806e+04 4.080773e+07 4.708866e+07 6.166325e+07 6.557577e+07 6.199964e+07 1.013741e+08 4.662485e+07 6.756982e+07 1.016088e+08 8.940467e+07 2.062140e+08 4.583545e+07 6.955064e+07 1.574919e+08 6.988244e+07 1.228170e+08 1.115076e+08 8.174416e+07 5.344716e+07 5.694243e+07 5.905076e+07 3.157048e+08 3.903399e+07 1.110145e+08 1.674863e+08 6.415735e+07 6.728471e+07 1.187787e+08 2.433388e+08 6.724609e+07 8.518334e+07 7.080227e+07 7.114656e+07 5.532660e+07 7.130794e+07 6.405829e+07 7.088197e+04 6.860708e+04 5.764930e+04 6.130799e+04 6.663283e+04 7.079314e+04 8.343328e+04 5.298858e+04 6.006355e+04 5.806929e+04 5.524012e+04 6.704057e+04 5.640317e+04 5.977515e+04 7.465313e+04 6.243261e+04 6.259642e+04 7.450810e+04 5.923862e+04 5.302315e+04 6.313877e+04 5.361180e+04 6.064602e+04 C5 H6 O_7.035 2.808248e+05 9.712143e+06 9.420296e+06 1.070598e+07 3.426373e+05 9.891054e+06 1.091740e+07 1.102846e+07 307236.90 1.258409e+07 8.995477e+06 1.390203e+07 302019.43 2.763541e+06 1.334910e+07 8.906902e+06 2.609268e+05 1.275182e+07 8.831425e+06 7.758050e+06 2.430250e+05 1.147975e+07 1.186398e+07 9.916825e+06 35109.282 1.044047e+07 1.109758e+07 1.003633e+07 1.411541e+05 9.786572e+06 1.006869e+07 1.106549e+07 269102.01 9.742848e+06 1.038071e+07 9.791096e+06 1.823965e+05 9.562936e+06 1.175776e+07 1.151553e+07 1.767008e+05 7.549033e+06 1.114382e+07 1.127264e+07 1.976512e+05 1.014743e+07 9.598529e+06 1.032764e+07 9.816718e+04 2.038619e+05 3.714772e+05 8.199288e+04 7.498066e+04 2.272223e+05 1.960496e+05 5.088421e+05 9.905456e+05 1.197411e+06 6.023845e+05 2.257692e+05 7.228852e+04 5.325440e+05 9.050836e+04 7.731264e+04 1.327192e+05 3.529174e+05 1.689873e+05 7.496232e+04 1.143277e+05 8.591017e+04 2.065106e+05 8.058077e+04 8.024076e+04 3.214547e+05 2.637233e+05 6.770133e+04 1.135043e+05 1.554112e+05 1.054228e+05 7.533755e+04 9.596774e+04 2.326890e+05 6.857599e+04 4.814532e+05 9.031597e+04 8.428019e+04 7.373574e+04 1.322510e+05 1.906548e+05 2.037672e+05 1.545111e+05 9.542278e+04 1.686413e+05 1.091812e+05 6.675346e+04 1.002540e+05 7.609432e+04 1.038936e+05 1.446066e+05 1.250674e+05 3.444410e+05 7.394509e+04 6.649317e+04 1.971875e+05 6.352055e+04 7.302030e+04 8.066653e+04 7.297495e+04 8.085015e+04 8.024888e+04 1.077981e+05 2.758196e+05 1.510843e+05 1.041046e+05 1.033540e+05 1.548061e+05 2.109888e+05 1.321804e+05 2.716910e+05 7.614693e+04 1.236909e+05 7.204462e+04 2.106180e+05 2.554591e+05 1.650949e+05 1.206085e+05 1.191771e+05 1.072670e+05 1.628142e+05 9.653266e+04 7.314462e+04 8.564288e+04 8.906639e+04 6.906571e+04 1.045247e+05 5.222645e+05 8.834109e+04 1.219428e+05 8.528977e+04 1.926214e+05 1.369111e+05 7.427578e+05 9.053428e+04 1.512326e+05 1.079781e+05 1.310664e+05 4.031770e+05 1.155610e+05 1.978154e+05 1.120735e+05 1.114003e+05 7.181798e+04 8.306387e+04 7.861555e+04 8.160985e+04 1.226515e+05 1.225355e+05 1.175437e+05 1.517685e+05 9.489829e+04 7.085574e+04 9.311701e+04 8.703976e+04 1.436818e+05 1.275692e+05 9.942187e+04 7.274941e+04 7.512264e+04 7.325197e+04 7.648424e+04 1.912554e+05 2.403737e+05 8.145230e+04 1.037955e+05 7.604424e+04 1.001901e+05 7.294040e+04 1.869573e+05 2.293394e+05 1.684583e+05 4.383547e+07 1.805446e+07 2.524257e+07 2.043328e+07 2.238890e+07 2.957724e+07 2.078058e+07 2.816168e+07 7.086880e+06 2.880235e+07 4.276303e+07 3.474266e+07 5.055481e+07 1.893129e+07 3.793866e+07 1.089916e+07 4.097408e+07 3.761666e+07 3.555449e+07 1.937888e+07 6.331878e+07 4.444250e+07 6.523415e+04 3.146560e+07 2.778041e+07 1.407882e+07 2.927712e+07 3.439045e+07 3.248164e+07 6.556123e+06 2.992897e+07 3.146121e+07 3.335448e+07 2.834091e+07 6.957492e+06 7.319269e+06 2.433231e+07 3.029011e+07 2.076077e+07 3.022337e+07 4.002575e+07 3.258066e+07 2.640847e+07 2.681934e+07 5.932312e+06 2.743584e+07 3.980204e+07 4.577115e+07 2.819853e+07 3.941259e+07 3.421061e+07 3.081596e+07 3.137835e+07 3.519296e+07 3.040742e+07 2.688484e+07 1.052935e+07 3.051759e+07 3.476823e+07 2.143671e+05 3.322344e+05 1.050215e+05 2.072611e+05 1.125156e+05 1.315805e+05 1.162144e+05 2.218514e+05 1.504751e+05 1.957721e+05 1.738867e+05 1.181302e+05 7.837160e+04 1.102812e+05 8.336323e+05 1.037238e+05 1.269606e+05 1.294327e+05 3.557028e+05 7.510091e+04 6.955530e+04 7.219333e+04 1.733078e+05 "Hexa-2,4-dienedial (2)_7.036" 3.873955e+05 2.218692e+07 3.066188e+07 6.783991e+06 4.461022e+05 1.804859e+07 2.495715e+07 1.756597e+07 293471.61 2.764987e+07 1.872257e+07 2.371250e+07 263750.01 1.945229e+07 2.309264e+07 1.795477e+07 2.568613e+05 2.401102e+07 1.791746e+07 1.548265e+07 2.573638e+05 2.383970e+07 2.557957e+07 1.855946e+07 44339.339 2.118411e+07 2.325976e+07 2.111482e+07 7.399320e+04 1.967562e+07 2.090438e+07 2.129330e+07 196255.43 2.224784e+07 1.998694e+07 2.101200e+07 1.880966e+05 2.016230e+07 2.346893e+07 2.172255e+07 1.869268e+05 1.500361e+07 2.446676e+07 2.430187e+07 2.062308e+05 1.946269e+07 2.006714e+07 2.079022e+07 7.844750e+04 1.342219e+05 3.875166e+05 1.924132e+05 7.539522e+04 2.811632e+05 2.495554e+05 9.486755e+05 2.185558e+06 2.605041e+06 1.371831e+06 3.892673e+05 9.061489e+04 9.703118e+05 8.495225e+04 8.073783e+04 2.641799e+05 6.150586e+05 1.498883e+05 7.565454e+04 1.965048e+05 1.503113e+05 3.966105e+05 8.492466e+04 1.066126e+05 2.631601e+05 3.941112e+05 7.079211e+04 2.321348e+05 2.384801e+05 1.723575e+05 8.522896e+04 2.148408e+05 3.402452e+05 7.150580e+04 7.693773e+05 1.924603e+05 6.524733e+04 7.691482e+04 8.159484e+04 7.809444e+04 7.276867e+04 1.164481e+05 8.856661e+04 1.607859e+05 9.838635e+04 6.976021e+04 1.023699e+05 1.066010e+05 7.648385e+04 1.481458e+05 7.888055e+04 4.823905e+05 9.297545e+04 7.254871e+04 3.112943e+05 1.575494e+05 7.336706e+04 8.099647e+04 7.407978e+04 7.251297e+04 8.054166e+04 9.407730e+04 3.760003e+05 1.844717e+05 8.590804e+04 9.018963e+04 1.206622e+05 2.231315e+05 1.331654e+05 4.889341e+05 7.764017e+04 7.660772e+04 7.564653e+04 2.367923e+05 2.177545e+05 2.582752e+05 7.527902e+04 2.205798e+05 1.241876e+05 8.556634e+04 8.416602e+04 7.639132e+04 8.766783e+04 1.854280e+05 9.916384e+04 1.912186e+05 8.331069e+05 2.519576e+05 1.804022e+05 9.456586e+04 2.534982e+05 7.624954e+04 1.248535e+06 8.314633e+04 1.742158e+05 1.182246e+05 7.371479e+04 4.424766e+05 7.847013e+04 2.837354e+05 1.824810e+05 2.913940e+05 7.243776e+04 7.904311e+04 1.864476e+05 2.433472e+05 2.446358e+05 2.704103e+05 1.167863e+05 7.977403e+04 1.229993e+05 7.110332e+04 9.459692e+04 1.276673e+05 1.238125e+05 8.074757e+04 9.123785e+04 7.635945e+04 1.584134e+05 7.738085e+04 7.920555e+04 2.556029e+05 2.089607e+05 8.589968e+04 7.560453e+04 1.680154e+05 8.839717e+04 1.009552e+05 8.555636e+04 2.320338e+05 2.104050e+05 9.392850e+07 3.616357e+07 4.804317e+07 4.399336e+07 4.782397e+07 6.198996e+07 6.195222e+07 5.719047e+07 2.559043e+07 5.916376e+07 8.310670e+07 6.108714e+07 9.463321e+07 3.898181e+07 7.834688e+07 1.877313e+07 7.968264e+07 1.454556e+07 7.148109e+07 4.425257e+07 1.132849e+08 1.360888e+07 6.770121e+04 5.536958e+07 6.166054e+07 2.850471e+07 5.850650e+07 7.517033e+07 6.893099e+07 6.927079e+07 5.968201e+07 6.720952e+07 6.838515e+07 5.552907e+07 4.901362e+07 1.947170e+07 4.874020e+07 6.023159e+07 3.975823e+07 6.491413e+07 7.772655e+07 5.004421e+07 5.563647e+07 5.333951e+07 6.639092e+07 1.570535e+07 7.478267e+07 9.116170e+07 1.253956e+07 8.958809e+07 7.167628e+07 6.088235e+07 6.201847e+07 6.950341e+07 5.471446e+07 5.255406e+07 2.614675e+07 6.117716e+07 7.189472e+07 1.793558e+05 6.186498e+05 1.045554e+05 9.510703e+04 1.216855e+05 1.018201e+05 1.833419e+05 2.139897e+05 8.273076e+04 3.248038e+05 8.762527e+04 1.029737e+05 7.885062e+04 1.004671e+05 1.817715e+06 2.234865e+05 8.502623e+04 2.744451e+05 5.680370e+05 7.324362e+04 7.303935e+04 9.431284e+04 9.785207e+04 HEXITOL 6.425306e+06 5.318942e+08 5.513198e+08 5.270840e+08 1.292243e+06 5.630141e+08 6.553719e+08 5.335741e+08 933544.94 8.030171e+08 4.916877e+08 6.498775e+08 809954.51 4.811809e+08 6.898618e+08 4.549667e+08 8.968812e+05 7.041667e+08 5.125552e+08 4.393280e+08 9.330757e+05 6.196334e+08 7.167258e+08 5.376262e+08 136531.541 5.887051e+08 6.606512e+08 5.512476e+08 1.145480e+05 5.677899e+08 5.801379e+08 5.807136e+08 719944.63 5.588182e+08 6.233149e+08 6.218707e+08 6.709354e+05 5.420262e+08 6.191591e+08 6.818093e+08 6.869989e+05 4.020940e+08 6.195769e+08 6.670804e+08 7.479218e+05 5.319891e+08 5.565878e+08 6.073030e+08 1.399641e+06 8.725875e+05 1.432702e+06 2.470251e+06 1.805450e+06 8.751116e+06 2.181610e+06 3.106377e+07 6.122755e+07 7.284589e+07 4.136828e+07 6.491881e+06 2.201905e+06 3.507223e+07 1.699106e+06 2.229905e+06 6.848227e+06 1.811921e+07 4.102227e+06 2.462901e+06 2.235106e+06 2.854800e+06 8.172312e+06 1.659792e+06 2.223204e+06 4.629478e+06 8.827713e+06 2.894051e+06 2.136162e+06 4.344717e+06 3.892500e+06 1.995087e+06 3.394854e+06 7.270529e+06 2.309219e+06 1.982947e+07 1.193002e+06 8.144602e+05 1.066539e+06 1.067223e+06 9.682733e+05 1.277762e+06 2.779795e+06 9.391900e+05 4.782926e+06 1.956796e+06 9.570110e+05 1.509337e+06 3.954871e+06 8.958930e+05 1.245592e+06 9.055178e+05 1.022823e+07 2.650435e+06 1.108153e+06 7.568512e+06 8.059157e+05 8.029305e+05 1.067157e+06 1.214718e+06 7.467162e+05 8.751267e+05 2.613863e+06 1.027891e+07 5.835262e+06 1.667854e+06 1.010779e+06 1.356234e+06 5.790869e+06 7.867742e+05 1.068878e+07 2.617018e+06 5.142032e+05 1.150304e+06 3.421782e+06 6.162088e+06 5.684762e+06 2.393648e+06 3.637260e+06 8.094830e+05 2.532312e+06 2.149432e+06 1.770436e+06 1.357511e+06 4.773259e+06 1.492290e+06 2.626999e+06 1.464107e+07 6.682721e+06 2.893145e+06 2.170631e+06 5.976352e+06 1.409590e+06 3.824409e+07 7.916903e+05 3.700531e+06 1.261038e+06 1.742460e+06 1.027498e+07 2.542290e+06 2.195797e+06 3.923871e+06 5.277397e+06 1.650087e+06 1.380885e+06 4.012242e+06 1.254250e+06 2.316025e+06 7.925770e+06 1.753078e+06 1.631675e+06 2.831582e+06 1.225345e+06 2.557227e+06 2.738771e+06 3.243460e+06 9.828351e+05 1.663743e+06 1.381532e+06 1.566554e+06 1.452148e+06 1.857886e+06 5.643392e+06 3.953536e+06 2.488638e+06 1.928573e+06 7.654600e+05 7.952036e+05 2.805166e+06 2.093143e+06 3.962211e+06 3.452421e+06 2.203907e+09 8.049772e+08 1.176699e+09 1.045334e+09 1.267417e+09 1.460367e+09 1.192492e+09 1.262181e+09 1.250206e+09 1.388653e+09 2.000268e+09 1.382809e+09 2.018968e+09 9.423393e+08 1.778495e+09 9.678030e+08 1.833172e+09 1.672701e+09 1.727764e+09 1.024246e+09 2.547811e+09 2.113224e+09 9.549454e+05 1.381948e+09 1.197980e+09 6.926891e+08 1.626792e+09 1.527025e+09 1.698412e+09 1.109969e+09 1.489141e+09 1.483079e+09 1.651004e+09 1.488298e+09 8.043763e+08 1.341874e+09 1.279483e+09 1.380231e+09 7.606757e+08 1.618747e+09 1.378679e+09 1.183355e+09 1.367172e+09 9.480881e+08 1.520498e+09 1.238900e+09 1.708001e+09 1.902760e+09 4.056873e+08 1.582328e+09 1.640755e+09 1.469801e+09 1.508199e+09 1.679223e+09 1.305548e+09 1.252063e+09 9.990700e+08 1.473159e+09 1.310801e+09 2.878719e+06 1.824480e+07 3.591936e+06 2.581261e+06 1.530164e+06 1.655699e+06 7.345363e+05 3.717088e+06 9.133976e+05 5.114643e+06 1.809750e+06 2.254771e+06 6.587466e+05 2.616919e+06 6.360298e+07 1.798886e+06 7.112192e+05 2.143961e+06 1.541130e+07 1.539641e+06 1.499801e+06 3.138368e+06 2.247709e+06 2396_7.036 1.338897e+06 4.459151e+07 1.133971e+08 1.326794e+08 1.099361e+06 1.211374e+08 1.173920e+08 1.039833e+08 774902.25 1.372045e+08 9.329792e+07 1.231071e+08 657319.67 9.549032e+07 1.218618e+08 9.418312e+07 7.043151e+05 1.224213e+08 9.017555e+07 9.165512e+07 7.054162e+05 1.188679e+08 1.324671e+08 9.749938e+07 106416.156 1.126857e+08 1.145828e+08 1.112047e+08 9.308752e+04 9.754942e+07 1.134287e+08 1.110656e+08 644761.95 1.068536e+08 1.069837e+08 1.099438e+08 5.321927e+05 1.046112e+08 1.212426e+08 1.225202e+08 5.300631e+05 8.055507e+07 1.163346e+08 1.199558e+08 6.500478e+05 1.017292e+08 1.062326e+08 1.103156e+08 2.638209e+05 2.821489e+05 1.103239e+06 4.071042e+05 2.762350e+05 1.857396e+06 3.827598e+05 4.483368e+06 9.588190e+06 1.089870e+07 5.727332e+06 1.349819e+06 4.453548e+05 4.949279e+06 2.660924e+05 4.610775e+05 1.390358e+06 3.412894e+06 8.416357e+05 4.052828e+05 5.632422e+05 6.781852e+05 1.620961e+06 3.020016e+05 3.473897e+05 8.334242e+05 1.774950e+06 5.457126e+05 4.137325e+05 7.943376e+05 6.465462e+05 3.458557e+05 5.599242e+05 1.359970e+06 3.404849e+05 3.742076e+06 3.191014e+05 2.544615e+05 2.628244e+05 2.244572e+05 2.530878e+05 2.687132e+05 4.569659e+05 2.698488e+05 8.616297e+05 3.709745e+05 2.295686e+05 3.673542e+05 8.877962e+05 2.825942e+05 4.720609e+05 2.386085e+05 1.944288e+06 4.226357e+05 2.842027e+05 1.437794e+06 1.918787e+05 3.074451e+05 2.707027e+05 2.695782e+05 2.467070e+05 2.381432e+05 4.594008e+05 1.652743e+06 7.845252e+05 3.572294e+05 2.618706e+05 3.815093e+05 1.033181e+06 3.102761e+05 1.687411e+06 4.659301e+05 2.419713e+05 3.736365e+05 6.836401e+05 1.201327e+06 1.119081e+06 5.282145e+05 4.850229e+05 3.015824e+05 3.848744e+05 3.691398e+05 2.940578e+05 3.689963e+05 8.716723e+05 2.816602e+05 6.672867e+05 3.383239e+06 1.397361e+06 4.874292e+05 4.565368e+05 1.079415e+06 2.628773e+05 7.277277e+06 2.272616e+05 7.307406e+05 3.012929e+05 4.416458e+05 1.863671e+06 5.154422e+05 4.139653e+05 8.405203e+05 1.033096e+06 2.629590e+05 2.841285e+05 7.932832e+05 2.687094e+05 3.959040e+05 1.240272e+06 4.000942e+05 2.239428e+05 4.123593e+05 2.321292e+05 3.470404e+05 5.034115e+05 3.728376e+05 2.799458e+05 2.764109e+05 3.239772e+05 3.126506e+05 2.203007e+05 2.540801e+05 1.072384e+06 6.463800e+05 3.494871e+05 4.514267e+05 2.650516e+05 2.916484e+05 5.652199e+05 3.170909e+05 7.756818e+05 7.660828e+05 4.889254e+08 1.860197e+08 2.461618e+08 2.108998e+08 2.406570e+08 3.320333e+08 2.544310e+08 3.006894e+08 2.812434e+08 3.002943e+08 4.521149e+08 3.043266e+08 5.062595e+08 2.005844e+08 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1.867849e+08 588262.36 2.580632e+08 4.217169e+07 2.264612e+08 456491.90 1.522569e+08 1.973470e+08 8.857257e+07 4.668565e+05 1.496992e+08 1.410040e+08 1.165799e+08 4.367950e+05 1.918190e+08 1.800926e+08 2.009274e+08 68417.942 1.268190e+08 1.190012e+08 1.668894e+08 6.559403e+04 1.624289e+08 1.354632e+08 1.955238e+08 417918.12 1.067248e+08 1.409019e+08 2.018704e+08 3.652054e+05 1.504953e+08 1.442189e+08 1.602931e+08 3.547205e+05 1.276959e+08 1.727244e+08 1.279107e+08 3.694551e+05 1.676944e+08 1.829424e+08 1.347426e+08 1.353181e+06 5.726725e+05 1.215625e+06 2.193431e+06 1.097281e+06 7.226066e+06 2.791286e+06 4.225848e+07 3.902271e+07 6.452544e+07 3.784733e+07 6.378605e+06 2.470585e+06 2.570834e+07 2.229249e+06 8.539775e+05 6.856681e+06 1.125463e+07 2.673372e+06 1.747642e+06 2.956801e+06 2.216819e+06 7.311511e+06 7.783827e+05 1.662937e+06 2.825860e+06 7.610801e+06 1.939169e+06 1.877581e+06 2.835716e+06 4.437601e+06 1.098287e+06 2.314114e+06 5.299502e+06 1.497444e+06 1.690154e+07 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3.780812e+06 1.858601e+06 2.083788e+06 8.524053e+05 1.949753e+06 9.576164e+05 9.858927e+05 8.684787e+05 2.013100e+06 2.911888e+06 2.303576e+06 4.076601e+05 1.352801e+06 6.959618e+05 5.753405e+05 4.234889e+06 1.768594e+06 3.129633e+06 2.661357e+06 2.972477e+08 2.240744e+08 2.132459e+08 7.544185e+07 1.532819e+08 1.181784e+08 3.075286e+08 9.692416e+07 1.244989e+08 1.826812e+08 2.941374e+08 2.777718e+07 2.841626e+08 1.837540e+08 6.974227e+07 2.065872e+08 1.482544e+08 2.214584e+08 1.892236e+08 1.230929e+08 1.230516e+08 1.886394e+08 6.924398e+05 2.577670e+08 1.525968e+08 1.845625e+08 2.118812e+08 8.085570e+07 1.967602e+08 1.104863e+08 2.268206e+08 2.342856e+08 3.016331e+08 2.097887e+08 5.730164e+07 7.675586e+07 2.491521e+08 2.280805e+08 1.974868e+08 1.810113e+08 2.895909e+08 2.361106e+08 2.287643e+08 1.443840e+08 2.010671e+08 2.072552e+08 1.728218e+08 1.956909e+08 1.425475e+08 4.032370e+08 2.430405e+08 1.736925e+08 7.257003e+07 1.632132e+08 5.316603e+07 1.329095e+08 1.875560e+08 2.088454e+08 2.615019e+08 2.626631e+06 1.208991e+07 3.055842e+06 2.040707e+06 1.257619e+06 8.418218e+05 7.041846e+05 4.068020e+06 7.438100e+05 3.447513e+06 1.566438e+06 1.891269e+06 6.308788e+05 2.047799e+06 5.826258e+07 1.632589e+06 7.427078e+05 1.746320e+06 8.973884e+06 2.403227e+06 1.224379e+06 3.137957e+06 8.342161e+05 C6 H22 N6 O11 P2_7.036 4.431559e+05 1.583867e+08 1.605338e+08 1.628364e+08 9.196304e+05 1.790673e+08 1.595708e+08 1.655076e+08 676770.98 1.758080e+08 2.273788e+08 1.838048e+08 610952.93 1.292521e+08 1.768424e+08 1.416945e+08 6.613828e+05 2.010912e+08 1.439732e+08 1.445386e+08 6.856834e+05 1.686028e+08 2.048371e+08 1.965492e+08 104709.733 1.522445e+08 1.731822e+08 1.626353e+08 1.076999e+05 1.564632e+08 1.770156e+08 1.929993e+08 594930.74 1.559989e+08 1.745958e+08 1.737653e+08 5.682010e+05 1.487540e+08 1.748503e+08 2.051076e+08 5.402962e+05 1.248354e+08 1.885793e+08 1.975064e+08 5.683340e+05 1.455381e+08 1.548188e+08 1.819426e+08 2.146700e+05 1.843818e+05 1.030923e+06 2.504951e+05 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5.344988e+08 5.389855e+08 5.553185e+08 4.745907e+08 5.673306e+08 5.590189e+08 5.809432e+08 5.504744e+08 4.569262e+08 4.546079e+08 4.200732e+08 5.405428e+08 3.130878e+08 5.592094e+08 4.864880e+08 4.468360e+08 4.135017e+08 4.539643e+08 5.522606e+08 3.556109e+08 6.883548e+08 7.499196e+08 3.905025e+08 6.273363e+08 5.332527e+08 5.623138e+08 6.300346e+08 5.919766e+08 4.831185e+08 4.648341e+08 5.329316e+08 5.661674e+08 5.130468e+08 2.847143e+05 5.925371e+05 2.323128e+05 2.111189e+05 2.669563e+05 2.559072e+05 3.195617e+05 2.045051e+05 2.758551e+05 2.458104e+05 2.012667e+05 2.451748e+05 2.397106e+05 2.281153e+05 2.093493e+06 2.615877e+05 2.199908e+05 2.970340e+05 2.915955e+05 1.913403e+05 2.171321e+05 2.397538e+05 2.123523e+05 Levulinic acid_7.036 1.409627e+06 6.178341e+06 1.331845e+07 1.402263e+07 6.469011e+05 1.107265e+07 1.385034e+07 1.330259e+07 924117.20 1.636526e+07 1.173826e+07 1.556993e+07 426865.09 4.630358e+06 1.466698e+07 1.164474e+07 4.592333e+05 1.450772e+07 9.627057e+06 1.027944e+07 4.065798e+05 1.337376e+07 1.446247e+07 1.252610e+07 143687.522 1.195751e+07 1.242625e+07 1.262575e+07 1.383362e+05 1.170928e+07 1.248992e+07 1.343471e+07 331585.64 1.238921e+07 1.314027e+07 1.430226e+07 6.613953e+05 4.944009e+06 1.666142e+07 1.730132e+07 4.327592e+05 4.091875e+06 1.708775e+07 1.647033e+07 4.194508e+05 4.231159e+06 1.312286e+07 1.347093e+07 5.418714e+05 6.312991e+05 8.594875e+05 9.054166e+05 3.856203e+05 8.280547e+05 4.407166e+05 1.163992e+06 1.374190e+06 1.668672e+06 1.792870e+06 6.516052e+05 7.206423e+05 1.164258e+06 3.523021e+05 7.596526e+05 6.393686e+05 1.180048e+06 1.964627e+05 5.865578e+05 7.850298e+05 3.161827e+05 5.065203e+05 2.974207e+05 6.294659e+05 3.362461e+05 7.688890e+05 2.368655e+05 4.697556e+05 5.577697e+05 4.296100e+05 4.331227e+05 8.265570e+05 3.014410e+05 5.815917e+05 9.247752e+05 3.881920e+05 3.447517e+05 4.330153e+05 1.394799e+05 7.937396e+05 5.789010e+05 4.720531e+05 6.907618e+05 3.520243e+05 7.631959e+05 4.316501e+05 3.146124e+05 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2.568364e+06 2.261772e+06 2.585051e+06 2.429081e+06 2.313784e+06 3.088072e+06 2.242891e+06 2.877585e+06 1.087998e+05 6.435542e+04 9.604509e+04 6.567775e+04 1.054039e+05 9.845029e+04 1.059405e+05 6.366010e+04 7.655434e+04 7.113229e+04 7.591135e+04 1.005620e+05 7.355032e+04 9.684352e+04 1.227849e+05 1.014768e+05 7.933870e+04 1.198534e+05 6.984111e+04 6.895287e+04 7.378927e+04 6.845213e+04 7.778458e+04 C4 H6 O2_7.038 1.017709e+06 1.891057e+07 2.033831e+07 2.329608e+07 5.928356e+05 2.239430e+07 2.281859e+07 2.034550e+07 497596.73 2.788936e+07 1.711622e+07 2.713397e+07 416408.64 1.909190e+07 2.303761e+07 2.092682e+07 4.834377e+05 2.616745e+07 1.516271e+07 1.655080e+07 4.807998e+05 2.328375e+07 2.797416e+07 2.298797e+07 209219.664 1.937053e+07 2.300416e+07 2.257923e+07 2.663448e+05 2.072976e+07 2.232499e+07 2.289651e+07 353298.50 2.114161e+07 2.137529e+07 2.207755e+07 3.362122e+05 2.020751e+07 2.401190e+07 2.438947e+07 3.846840e+05 1.624974e+07 2.447710e+07 2.375646e+07 3.738275e+05 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1.031304e+07 1.593290e+07 1.345599e+07 1.214649e+07 1.131565e+07 1.155924e+07 1.663884e+07 1.136946e+07 1.761426e+07 9.639303e+06 1.091431e+07 1.187712e+07 9.258564e+06 1.663061e+07 1.534121e+07 9.158365e+06 1.282781e+07 1.267373e+07 1.948961e+07 1.569664e+07 1.603724e+07 2.354426e+05 4.823589e+05 1.688308e+05 1.744631e+05 2.450362e+05 1.567447e+05 2.025371e+05 1.503504e+05 1.619562e+05 1.593055e+05 1.464785e+05 1.875750e+05 1.334484e+05 1.572756e+05 1.470466e+06 1.860364e+05 1.379469e+05 2.068874e+05 4.310670e+05 1.793742e+05 1.492874e+05 2.295653e+05 1.592148e+05 C12 H17 Cl N4 O13_7.042 1.580786e+05 9.323042e+05 1.061007e+06 1.022816e+06 3.773577e+05 1.257811e+06 1.239468e+06 1.151826e+06 232612.59 1.222097e+06 1.029009e+06 1.444899e+06 171846.25 9.057408e+05 1.370730e+06 7.814237e+05 1.925208e+05 1.342034e+06 9.769011e+05 8.396430e+05 1.911796e+05 1.303825e+06 1.452981e+06 1.196987e+06 29087.297 9.929701e+05 1.048394e+06 1.225784e+06 2.317281e+04 9.851504e+05 1.131014e+06 1.388429e+06 150322.88 1.163150e+06 1.154931e+06 1.004803e+06 1.494335e+05 7.826888e+05 1.339084e+06 1.645208e+06 1.459522e+05 7.167267e+05 1.183018e+06 1.300098e+06 1.665190e+05 9.471336e+05 9.561583e+05 1.295811e+06 6.237685e+04 5.319106e+04 3.071992e+05 6.752574e+04 5.824023e+04 6.300248e+04 8.591008e+04 1.189064e+05 7.468251e+04 8.606214e+04 9.245824e+04 7.689523e+04 5.542674e+04 6.715733e+04 6.386159e+04 6.401684e+04 6.897107e+04 6.026399e+04 5.992755e+04 5.891108e+04 5.593126e+04 6.125470e+04 1.332091e+05 6.302712e+04 6.358161e+04 5.869563e+04 6.914786e+04 5.197375e+04 8.782476e+04 6.883619e+04 7.477869e+04 6.215293e+04 7.116049e+04 5.537224e+04 5.422929e+04 6.135249e+04 7.052395e+04 5.230704e+04 6.162873e+04 5.889051e+04 5.840519e+04 5.556293e+04 4.822908e+04 7.012918e+04 5.960583e+04 7.706690e+04 5.633625e+04 7.631213e+04 6.152748e+04 5.965648e+04 1.103681e+05 5.948583e+04 5.749944e+04 5.873888e+04 5.535679e+04 6.364963e+04 4.924673e+04 5.502934e+04 5.825608e+04 5.813649e+04 5.527078e+04 6.183256e+04 7.231428e+04 6.566423e+04 7.801398e+04 6.189245e+04 6.926746e+04 9.423294e+04 8.180967e+04 6.129962e+04 5.663419e+04 6.135964e+04 5.923760e+04 6.037775e+04 5.068718e+04 6.448317e+04 5.885259e+04 5.946646e+04 9.690158e+04 5.738127e+04 6.474015e+04 6.453291e+04 6.091849e+04 6.863005e+04 5.984219e+04 5.392070e+04 5.844135e+04 6.099505e+04 7.231661e+04 5.798944e+04 7.111253e+04 6.433445e+04 6.073133e+04 6.506870e+04 6.226088e+04 5.703422e+04 9.441476e+04 5.652863e+04 5.965269e+04 5.746792e+04 7.848735e+04 5.914309e+04 7.438817e+04 5.622068e+04 5.707207e+04 6.122893e+04 6.069162e+04 1.007387e+05 6.541214e+04 9.238580e+04 6.076615e+04 6.351207e+04 5.465561e+04 7.465544e+04 6.819032e+04 9.783208e+04 6.433229e+04 6.871156e+04 5.896405e+04 6.329028e+04 5.954746e+04 6.126087e+04 6.519718e+04 6.783279e+04 6.363666e+04 5.974372e+04 6.152179e+04 6.852449e+04 5.587271e+04 1.923071e+05 7.244069e+04 5.919661e+04 3.696369e+06 1.919606e+06 2.051598e+06 1.853127e+06 2.068053e+06 1.611730e+06 2.373642e+06 3.425782e+06 2.531966e+06 2.882731e+06 4.066265e+06 2.420186e+06 1.939489e+05 2.089442e+06 3.743118e+06 1.998475e+06 2.593260e+06 3.969390e+06 2.400963e+06 1.349140e+06 6.764287e+06 3.377560e+06 5.401977e+04 2.697652e+06 1.942077e+06 1.330500e+06 2.546214e+06 2.626865e+06 3.217149e+06 2.847256e+06 3.089263e+06 3.109799e+06 3.018583e+06 2.297136e+06 2.485541e+06 2.015927e+06 2.822947e+06 2.615805e+06 1.837391e+06 2.609550e+06 2.698854e+06 2.406854e+06 2.825091e+06 2.140025e+06 2.986169e+06 1.820967e+06 2.687603e+06 3.554142e+06 2.202356e+06 3.941347e+06 3.029561e+06 4.171074e+06 2.955904e+06 3.403136e+06 2.566571e+06 1.878736e+06 3.692282e+06 3.405211e+06 2.515781e+06 1.102322e+05 5.530009e+04 8.432739e+04 5.734825e+04 9.988275e+04 7.698227e+04 9.547487e+04 5.399082e+04 6.324919e+04 5.634752e+04 5.757657e+04 7.870638e+04 6.087986e+04 7.903828e+04 1.069878e+05 9.855952e+04 6.362356e+04 1.089032e+05 5.425855e+04 5.433823e+04 5.748170e+04 5.683547e+04 6.208121e+04 C21 H14 Cl2 N6 S5_7.043 1.674662e+05 7.524977e+06 6.758567e+06 7.791953e+06 4.221955e+05 7.709935e+06 6.838673e+06 6.598360e+06 299783.95 1.046369e+07 5.478218e+06 1.116618e+07 232726.84 6.617236e+06 8.090954e+06 5.997961e+06 2.721482e+05 7.952346e+06 6.152158e+06 5.397729e+06 2.581274e+05 9.228999e+06 9.208112e+06 7.643196e+06 37072.114 7.871117e+06 7.502022e+06 8.462991e+06 3.183959e+04 5.829053e+06 8.326413e+06 6.653088e+06 193409.89 7.532842e+06 7.198931e+06 1.003032e+07 1.796506e+05 6.997156e+06 7.782209e+06 9.495312e+06 2.135421e+05 6.029249e+06 5.256628e+06 7.800997e+06 2.593610e+05 7.597335e+06 7.394520e+06 8.486546e+06 9.974620e+04 7.745985e+04 4.674183e+05 9.448720e+04 7.304233e+04 7.617217e+04 1.210550e+05 2.236644e+05 2.365914e+05 2.548080e+05 1.060798e+05 1.064329e+05 7.248790e+04 1.030365e+05 8.929651e+04 8.618816e+04 9.765340e+04 1.119237e+05 8.274937e+04 7.818418e+04 1.317364e+05 7.692823e+04 1.785661e+05 8.603334e+04 9.466380e+04 7.672445e+04 8.857977e+04 7.088827e+04 1.219081e+05 9.181989e+04 1.047554e+05 8.243360e+04 9.419145e+04 7.818921e+04 7.044854e+04 1.212087e+05 9.655317e+04 8.370138e+04 1.273104e+05 8.467124e+04 7.699672e+04 1.236538e+05 7.241450e+04 9.053605e+04 7.669361e+04 1.005610e+05 8.909515e+04 1.074056e+05 8.846612e+04 9.249388e+04 1.551097e+05 8.317676e+04 8.068634e+04 7.648138e+04 7.183789e+04 9.462074e+04 6.113915e+04 7.309063e+04 7.755756e+04 8.158860e+04 7.325050e+04 8.113341e+04 9.490899e+04 8.431530e+04 9.851734e+04 1.017472e+05 9.200730e+04 1.195170e+05 1.057772e+05 8.786163e+04 7.415978e+04 7.636933e+04 9.304021e+04 9.570877e+04 8.147659e+04 8.407818e+04 9.403065e+04 7.551469e+04 1.271364e+05 8.575470e+04 8.733100e+04 8.587531e+04 7.665977e+04 8.132860e+04 9.486841e+04 7.066455e+04 7.987693e+04 8.506955e+04 1.071649e+05 7.407157e+04 8.928074e+04 8.275058e+04 9.462206e+04 2.364147e+05 8.606828e+04 7.171129e+04 1.184605e+05 7.725562e+04 9.774596e+04 7.532075e+04 1.031908e+05 7.027324e+04 1.005832e+05 7.538294e+04 7.781244e+04 7.869705e+04 8.326685e+04 1.264964e+05 9.398534e+04 1.184403e+05 7.796531e+04 8.822161e+04 7.012629e+04 8.958484e+04 9.300817e+04 1.462617e+05 7.629205e+04 9.522878e+04 7.584498e+04 1.001106e+05 9.083848e+04 7.761053e+04 8.540651e+04 9.075334e+04 8.988066e+04 7.500378e+04 8.999921e+04 9.024773e+04 7.282600e+04 8.820198e+04 1.023624e+05 8.456883e+04 1.088978e+07 8.416010e+06 8.633005e+06 7.791023e+06 7.624520e+06 7.230561e+06 8.794041e+06 1.447781e+07 6.638950e+06 1.893686e+07 1.176944e+07 7.628361e+06 5.738341e+06 4.167156e+06 1.282584e+07 8.105871e+06 1.498136e+07 1.062662e+07 1.150928e+07 7.414781e+06 1.398998e+07 1.182464e+07 6.568171e+04 1.251668e+07 8.516533e+06 6.885769e+06 1.063721e+07 1.180695e+07 1.182284e+07 9.834899e+06 1.108683e+07 1.935440e+07 1.166597e+07 6.898880e+06 1.010841e+07 8.530360e+06 6.063013e+06 1.636181e+07 8.134932e+06 1.094700e+07 1.112806e+07 9.819571e+06 1.444597e+07 1.138153e+07 1.024698e+07 9.754359e+06 1.460518e+07 1.644010e+07 8.533676e+06 1.018711e+07 1.130278e+07 1.599747e+07 1.124397e+07 1.150119e+07 8.694371e+06 8.323025e+06 1.319072e+07 1.097920e+07 1.005708e+07 1.306578e+05 9.368502e+04 1.065384e+05 7.205772e+04 1.223098e+05 1.052559e+05 1.421070e+05 7.126985e+04 1.082865e+05 8.039368e+04 8.328942e+04 1.051488e+05 8.309886e+04 1.027064e+05 1.798416e+05 1.236654e+05 8.997387e+04 1.357861e+05 1.335063e+05 7.753020e+04 7.424508e+04 7.428684e+04 8.764826e+04 C4 H16 N9 O P3_7.044 7.080837e+04 9.422885e+05 1.248664e+06 1.274107e+06 1.693447e+05 1.473474e+06 1.192215e+06 1.690969e+06 109020.34 1.583868e+06 1.132345e+06 1.566135e+06 90423.62 1.044254e+06 1.498183e+06 9.748056e+05 1.041506e+05 1.590739e+06 1.141354e+06 1.211919e+06 1.075408e+05 1.194899e+06 1.678279e+06 1.545613e+06 15924.350 1.049148e+06 1.368343e+06 1.337937e+06 1.293170e+04 1.271936e+06 1.406551e+06 1.497964e+06 97983.97 1.358109e+06 8.262403e+05 1.408724e+06 1.149755e+05 1.600107e+06 1.842776e+06 1.078960e+06 1.340763e+05 1.450316e+06 5.190280e+05 1.770625e+06 9.591608e+04 1.039121e+06 9.099991e+05 1.767669e+06 3.103228e+04 2.863477e+04 1.492553e+05 5.887941e+04 4.117150e+04 4.424661e+04 4.614757e+04 3.670727e+04 6.243295e+04 7.253468e+04 8.605446e+04 4.166084e+04 3.471704e+04 3.696596e+04 3.527503e+04 5.213854e+04 5.966409e+04 3.159162e+04 3.379408e+04 4.270794e+04 3.154002e+04 3.095529e+04 6.097142e+04 3.354741e+04 2.612148e+04 3.262556e+04 3.732219e+04 2.922005e+04 4.397865e+04 3.859462e+04 3.951306e+04 5.433869e+04 3.327601e+04 3.111675e+04 4.429973e+04 3.410423e+04 3.974752e+04 3.872231e+04 3.035695e+04 3.200084e+04 3.259340e+04 3.010259e+04 3.155215e+04 3.340695e+04 3.276394e+04 3.468234e+04 3.744633e+04 4.132004e+04 5.599794e+04 5.225004e+04 4.937519e+04 3.241521e+04 3.069218e+04 3.264956e+04 3.004005e+04 4.446960e+04 3.677826e+04 3.482383e+04 4.067216e+04 3.295805e+04 3.079400e+04 3.659034e+04 4.020217e+04 3.381310e+04 4.335330e+04 5.397286e+04 3.561534e+04 3.991644e+04 4.522971e+04 5.546500e+04 3.466800e+04 4.459506e+04 5.225081e+04 4.918744e+04 3.836059e+04 3.860410e+04 4.701626e+04 4.824839e+04 4.463226e+04 2.174531e+04 3.156441e+04 3.253830e+04 3.363824e+04 5.204755e+04 3.013780e+04 3.325815e+04 2.894805e+04 3.351316e+04 3.263361e+04 3.181619e+04 3.905157e+04 3.547861e+04 5.039230e+04 3.599806e+04 3.171278e+04 2.925345e+04 4.306056e+04 3.508364e+04 5.237989e+04 3.538425e+04 3.913104e+04 4.302369e+04 3.961892e+04 3.402905e+04 3.059072e+04 4.374667e+04 3.399185e+04 4.637922e+04 4.783749e+04 4.290195e+04 3.347129e+04 4.315159e+04 3.821391e+04 5.542466e+04 3.840616e+04 4.636287e+04 4.582538e+04 3.420250e+04 4.893323e+04 4.892647e+04 5.109877e+04 4.965892e+04 3.007095e+04 3.803284e+04 5.263024e+04 3.075725e+04 2.457282e+04 3.434401e+04 3.728498e+04 5.715090e+04 4.068029e+04 3.328692e+04 4.988506e+05 1.407304e+06 1.346468e+06 9.720301e+05 1.192555e+06 1.084257e+06 1.446763e+06 1.347313e+05 9.628256e+05 2.346546e+06 1.622225e+06 9.489070e+05 1.995586e+07 6.188498e+05 1.063493e+06 8.563244e+05 2.364724e+06 1.717782e+06 1.234093e+06 7.027463e+05 2.129208e+06 1.742020e+06 4.311148e+04 1.794111e+06 7.730468e+05 9.947448e+05 7.813005e+05 1.108368e+06 1.675227e+06 1.437185e+06 2.066777e+06 9.434261e+05 1.341625e+06 2.596166e+05 6.420484e+05 1.445340e+06 5.594537e+05 1.925719e+06 9.342487e+05 1.620072e+06 1.272123e+06 1.514232e+06 6.529349e+05 1.745828e+05 9.703643e+05 9.728041e+05 1.169430e+06 3.167811e+05 8.475837e+05 9.452492e+05 1.598478e+06 7.048671e+05 2.337441e+06 1.710304e+06 4.930356e+05 1.428530e+06 1.825167e+06 1.466400e+05 1.983098e+06 4.778010e+04 3.039539e+04 3.803190e+04 3.156718e+04 4.487078e+04 4.157829e+04 4.414487e+04 3.068531e+04 3.791932e+04 3.175602e+04 3.119457e+04 4.104994e+04 3.654242e+04 3.819488e+04 4.907102e+04 4.319282e+04 3.542377e+04 4.997973e+04 4.513592e+04 2.965562e+04 4.901803e+04 3.442191e+04 3.463815e+04 C9 H12 Cl N O7 S_7.044 1.877336e+05 9.385272e+06 5.066074e+06 6.731392e+06 4.693966e+05 6.670419e+06 6.867581e+06 5.228507e+06 321634.40 1.098256e+07 5.039603e+06 1.048598e+07 243657.52 5.484152e+06 8.329336e+06 3.989156e+06 2.781438e+05 9.657993e+06 5.476209e+06 6.015771e+06 2.794742e+05 7.966768e+06 1.012554e+07 5.475567e+06 42613.974 6.542764e+06 7.466978e+06 6.211824e+06 3.365416e+04 8.268720e+06 7.614070e+06 7.481061e+06 205906.58 6.761488e+06 7.486330e+06 7.423652e+06 2.001059e+05 7.033171e+06 6.327874e+06 7.670460e+06 1.864324e+05 5.989390e+06 7.513944e+06 7.374352e+06 1.759231e+05 7.797156e+06 7.322671e+06 6.803520e+06 1.103212e+05 8.887287e+04 3.153030e+05 8.877216e+04 7.921816e+04 3.281963e+05 1.236523e+05 1.743418e+06 3.236473e+06 3.156494e+06 2.222240e+06 4.193360e+05 8.450020e+04 1.258039e+06 9.142425e+04 1.745560e+05 7.644601e+05 4.232582e+05 1.744684e+05 2.142276e+05 1.382012e+05 8.697585e+04 3.749703e+05 9.210154e+04 7.515231e+04 8.590885e+04 5.612787e+05 1.084127e+05 1.282368e+05 2.794948e+05 4.097534e+05 8.313204e+04 1.169995e+05 2.423361e+05 1.569461e+05 7.779483e+05 1.551527e+05 5.897447e+04 6.341296e+04 9.395283e+04 1.214147e+05 1.066287e+05 7.577683e+04 2.221100e+05 2.946900e+05 1.070306e+05 9.078502e+04 1.110694e+05 1.587377e+05 7.420807e+04 1.607420e+05 8.574175e+04 4.600057e+05 8.488284e+04 1.664330e+05 2.740291e+05 8.336534e+04 1.387910e+05 1.017436e+05 8.558254e+04 1.045259e+05 8.458110e+04 1.013813e+05 5.793710e+05 4.194562e+05 8.392812e+04 9.695489e+04 2.176299e+05 3.041178e+05 1.051506e+05 3.408033e+05 8.555335e+04 7.801596e+04 1.013590e+05 1.265465e+05 3.241326e+05 3.084911e+05 7.975347e+04 1.645022e+05 8.942517e+04 1.980426e+05 9.038485e+04 8.581874e+04 1.733044e+05 1.066915e+05 1.248451e+05 1.173003e+05 1.368527e+06 2.212865e+05 8.422722e+04 1.372361e+05 2.816412e+05 1.014320e+05 2.317588e+06 1.584005e+05 2.401606e+05 1.621607e+05 9.814847e+04 4.094038e+05 7.870335e+04 1.094325e+05 7.879510e+04 4.443671e+05 1.664436e+05 8.662272e+04 8.616529e+04 2.466707e+05 1.438312e+05 4.488230e+05 2.766242e+05 8.892052e+04 2.005938e+05 9.927917e+04 1.009960e+05 9.987783e+04 1.224139e+05 1.170166e+05 2.162741e+05 8.071909e+04 7.164964e+04 1.452557e+05 8.210840e+04 1.059934e+05 2.674898e+05 1.832578e+05 1.120134e+05 6.138091e+04 9.561361e+04 1.981849e+05 8.986746e+04 1.780891e+05 1.102254e+05 1.488763e+07 6.325637e+06 1.023063e+07 1.224410e+07 5.013298e+06 7.966203e+06 1.328629e+07 6.890446e+06 7.767863e+06 6.605725e+06 4.768176e+06 5.860299e+06 9.885142e+06 9.594226e+06 1.128927e+07 1.065250e+07 6.443524e+06 1.210682e+07 9.523918e+06 7.973340e+06 7.243534e+06 8.877597e+06 8.352234e+04 1.597271e+07 1.230099e+07 7.061993e+06 1.044163e+07 1.176806e+07 1.195876e+07 7.554367e+06 1.186882e+07 5.436020e+06 1.234040e+07 6.439916e+06 4.844846e+06 7.259206e+06 6.261556e+06 1.151872e+07 9.589631e+06 7.287079e+06 1.277227e+07 1.216607e+07 8.793693e+06 5.493071e+06 1.304186e+07 9.005458e+06 1.250220e+07 5.174600e+06 8.442364e+06 1.730655e+07 1.078468e+07 9.108699e+06 1.158942e+07 9.356768e+06 9.055669e+06 5.723513e+06 1.828474e+07 8.442838e+06 1.721160e+07 1.433975e+05 9.762343e+05 1.826609e+05 8.121328e+04 2.201928e+05 1.474604e+05 9.612296e+04 2.314218e+05 1.141967e+05 2.283498e+05 1.296923e+05 1.103903e+05 8.643914e+04 2.190600e+05 2.510185e+06 4.214776e+05 1.456550e+05 1.470901e+05 3.985184e+05 7.918822e+04 1.642013e+05 1.208129e+05 8.952881e+04 UROCANATE (Peak 2) 1.884209e+07 9.549419e+06 7.016952e+06 1.114528e+07 4.728866e+05 1.525622e+07 1.357035e+07 1.288870e+07 468400.99 1.078221e+07 1.097943e+07 1.449121e+07 254223.67 1.119682e+07 1.283038e+07 9.337611e+06 2.948338e+05 1.111998e+07 8.541253e+06 1.001356e+07 2.725470e+05 1.329958e+07 1.401159e+07 1.132457e+07 46108.385 1.226675e+07 1.161468e+07 1.099534e+07 4.795524e+04 1.168780e+07 1.248817e+07 1.080497e+07 198543.14 1.227194e+07 9.917246e+06 1.202669e+07 1.917252e+05 1.073161e+07 1.387270e+07 1.499229e+07 1.884885e+05 8.086117e+06 8.394198e+06 1.421778e+07 1.914646e+05 1.243092e+07 1.086397e+07 1.161145e+07 1.147885e+07 2.269111e+07 4.348790e+06 2.260337e+06 6.892614e+06 4.397013e+06 1.252999e+07 1.175298e+07 1.417166e+07 5.213987e+06 9.658586e+06 1.639142e+07 7.710234e+06 7.583550e+06 1.133661e+07 8.026158e+06 7.123614e+06 7.587543e+06 8.118200e+06 3.727432e+06 3.780122e+06 5.463469e+06 1.484314e+07 1.760493e+07 1.554763e+07 2.126244e+07 1.261812e+07 5.279577e+06 3.357926e+06 2.678579e+06 7.207832e+06 4.524287e+06 7.707675e+06 6.370712e+06 1.607076e+07 1.269714e+07 1.697957e+07 3.252993e+06 2.872979e+06 2.151702e+06 4.518449e+06 3.078563e+06 8.369915e+06 4.234766e+06 2.047062e+07 1.219388e+07 5.831939e+06 8.995458e+06 6.862431e+06 5.553318e+06 1.108458e+07 4.069161e+06 6.714718e+06 7.836728e+06 3.725323e+06 3.551403e+06 3.230066e+06 5.582927e+06 3.136826e+06 5.642089e+06 9.206280e+06 1.008519e+08 2.341297e+06 1.003440e+07 6.494616e+06 1.611407e+07 1.868078e+07 5.766647e+06 7.440849e+07 3.001800e+07 1.805004e+07 1.969595e+07 1.311818e+07 3.805931e+06 3.685437e+06 7.311465e+06 7.544804e+06 6.904113e+06 1.579218e+07 4.472232e+06 3.857378e+07 2.862120e+07 7.020549e+06 4.524653e+07 5.336084e+06 2.502908e+06 4.805170e+06 9.590300e+06 1.335785e+07 1.195155e+07 2.384140e+07 3.234648e+06 1.093570e+07 1.373826e+07 1.665072e+07 1.000889e+07 1.235158e+07 1.003466e+07 4.939390e+06 6.377563e+06 1.486283e+07 5.052535e+06 1.984112e+07 2.643701e+06 1.686929e+07 6.362984e+06 5.604125e+06 3.832799e+06 3.293143e+07 3.726716e+07 1.530089e+07 4.588735e+06 4.252465e+06 5.197605e+06 3.228175e+06 5.156340e+06 2.607997e+06 9.017853e+06 4.641280e+06 6.660207e+06 2.351082e+06 7.525739e+06 1.178485e+07 7.012298e+06 9.356253e+07 6.300508e+06 5.625157e+06 4.797065e+06 6.097842e+06 3.191679e+06 4.939008e+06 2.870624e+06 7.126510e+06 2.361016e+06 7.951959e+06 8.608699e+06 2.867198e+07 1.031535e+07 4.887154e+06 9.981391e+06 2.664729e+06 7.406941e+06 5.679148e+06 7.426226e+06 1.667446e+07 4.599429e+06 1.067072e+07 2.478886e+07 1.160924e+07 5.172235e+06 1.353985e+07 6.930691e+06 1.073776e+07 6.825189e+06 7.048288e+06 2.261197e+07 1.077567e+07 4.034943e+06 1.278147e+07 1.966066e+07 1.253505e+07 2.162875e+07 1.022193e+07 2.268038e+07 7.961130e+06 6.939227e+06 9.959991e+06 6.225140e+06 1.842612e+07 7.863093e+06 4.106595e+07 1.324525e+07 1.014095e+07 1.487842e+07 4.071292e+06 5.427045e+06 1.274694e+07 2.139806e+07 1.362694e+07 1.207678e+07 7.540177e+06 3.688624e+06 7.943307e+06 2.541092e+07 2.258852e+07 1.659189e+07 5.997761e+06 1.147891e+07 8.590474e+06 5.374698e+06 4.253826e+06 2.048575e+07 1.564617e+07 2.858749e+07 1.194241e+07 7.936486e+06 1.752432e+06 3.831029e+06 4.353224e+06 8.766066e+06 8.660340e+06 1.373396e+07 2.031619e+07 7.697850e+06 9.778322e+06 2.674025e+08 8.928843e+06 5.813970e+06 1.582401e+07 1.877642e+06 4.734407e+07 7.103946e+06 5.986084e+06 9.687947e+06 150.02036_7.046 1.654732e+05 3.015116e+06 3.044707e+06 3.359107e+06 3.304942e+05 3.251063e+06 3.932619e+06 3.027195e+06 262932.64 3.155563e+06 3.696542e+06 3.564518e+06 229240.57 3.027474e+06 3.908623e+06 2.791609e+06 2.687501e+05 3.516435e+06 2.924377e+06 2.714225e+06 2.877141e+05 2.936626e+06 4.192114e+06 3.130896e+06 43017.966 3.900562e+06 3.308227e+06 3.034045e+06 3.824448e+04 3.082449e+06 3.180328e+06 3.359480e+06 236802.35 3.286267e+06 3.919477e+06 3.114927e+06 2.297445e+05 3.321483e+06 2.980214e+06 3.999805e+06 2.390562e+05 2.765139e+06 2.687660e+06 3.765359e+06 2.568680e+05 3.352708e+06 3.939592e+06 2.785846e+06 1.280433e+05 9.001277e+04 4.757462e+05 1.554580e+05 1.106314e+05 9.577457e+04 2.233927e+05 4.641520e+05 6.723972e+05 7.407644e+05 4.282060e+05 2.979289e+05 1.439506e+05 2.330074e+05 8.591895e+04 2.196979e+05 4.513119e+05 9.676723e+04 1.687838e+05 1.275344e+05 1.746348e+05 9.009185e+04 2.341428e+05 9.447172e+04 1.004994e+05 1.302701e+05 1.058512e+05 9.664109e+04 2.593615e+05 1.712567e+05 1.176288e+05 2.005570e+05 1.868186e+05 2.786941e+05 9.131992e+04 2.132862e+05 1.055337e+05 1.037479e+05 9.428049e+04 1.222366e+05 8.765849e+04 8.198880e+04 1.306017e+05 8.049023e+04 9.188146e+04 1.309360e+05 8.869915e+04 1.293553e+05 1.216212e+05 1.007716e+05 1.602204e+05 1.352408e+05 7.813285e+04 1.496381e+05 8.731098e+04 1.969941e+05 9.027805e+04 8.872677e+04 1.014302e+05 1.559797e+05 8.667097e+04 9.857882e+04 1.253176e+05 9.742946e+04 1.949373e+05 1.430471e+05 8.531504e+04 9.619524e+04 1.215209e+05 1.033223e+05 9.032900e+04 9.709912e+04 9.861798e+04 1.162103e+05 1.696138e+05 1.684984e+05 9.775840e+04 1.780788e+05 1.203180e+05 1.188942e+05 8.141183e+04 1.130133e+05 1.020998e+05 1.067835e+05 1.640448e+05 8.558405e+04 1.187080e+05 2.920031e+05 2.247803e+05 8.651572e+04 1.044166e+05 9.524274e+04 9.822596e+04 3.735278e+05 8.635728e+04 1.280547e+05 1.041028e+05 1.157202e+05 3.255854e+05 1.175579e+05 9.401948e+04 8.951137e+04 1.966207e+05 1.607414e+05 1.649966e+05 1.393340e+05 1.437633e+05 1.193815e+05 3.789850e+05 1.395791e+05 8.981150e+04 1.395483e+05 8.622718e+04 1.668989e+05 1.261007e+05 1.496228e+05 9.733194e+04 9.096000e+04 1.167049e+05 1.006497e+05 1.132025e+05 1.707190e+05 7.738125e+04 2.155314e+05 1.139385e+05 1.349549e+05 9.490573e+04 8.246721e+04 1.155026e+05 1.688933e+05 1.478203e+05 9.879093e+04 5.641871e+06 4.941916e+06 4.386120e+06 4.199213e+06 4.528909e+06 3.389883e+06 4.790419e+06 4.702958e+06 4.245562e+06 4.489096e+06 5.376193e+06 4.000921e+06 2.963316e+06 4.717248e+06 5.689294e+06 2.655387e+06 5.586424e+06 5.143393e+06 5.661787e+06 4.187161e+06 5.028152e+06 5.596298e+06 8.350990e+04 2.778305e+06 4.493638e+06 3.056038e+06 5.225092e+06 5.068665e+06 5.100046e+06 5.735154e+06 5.733806e+06 3.248383e+06 4.577939e+06 5.334913e+06 4.678272e+06 4.636732e+06 4.586496e+06 5.345765e+06 4.137475e+06 4.807085e+06 4.828404e+06 3.488143e+06 2.915714e+06 4.599043e+06 5.095258e+06 3.999038e+06 5.624082e+06 5.498415e+06 4.237500e+06 6.410023e+06 5.125645e+06 3.980068e+06 4.831775e+06 5.343500e+06 4.390173e+06 5.818506e+06 5.264041e+06 5.063792e+06 5.125466e+06 1.045813e+05 1.446413e+05 1.677469e+05 8.887643e+04 1.005998e+05 1.372332e+05 1.461610e+05 1.663373e+05 1.320855e+05 1.985503e+05 9.476831e+04 1.474000e+05 1.007701e+05 9.207712e+04 4.135023e+05 1.282477e+05 8.991941e+04 1.221454e+05 9.163942e+04 1.065912e+05 1.447315e+05 1.640279e+05 1.464088e+05 C9 H18 N5 P3 S_7.046 1.975463e+05 2.803949e+06 2.455389e+06 2.884145e+06 4.864965e+05 2.812255e+06 2.822909e+06 2.752645e+06 331649.56 3.820324e+06 3.935807e+06 2.827988e+06 365370.06 2.304271e+06 2.785712e+06 2.803297e+06 3.570860e+05 2.916852e+06 2.809879e+06 2.665199e+06 3.910271e+05 3.638788e+06 3.080163e+06 2.569467e+06 67707.042 2.935370e+06 3.055155e+06 2.887123e+06 5.394290e+04 3.060106e+06 2.991242e+06 2.975444e+06 324417.17 3.037670e+06 2.904845e+06 3.063571e+06 2.989087e+05 2.336317e+06 3.683957e+06 3.212221e+06 3.013695e+05 2.403071e+06 3.218140e+06 3.386674e+06 3.619356e+05 2.222705e+06 2.846685e+06 3.191488e+06 1.462345e+05 9.980150e+04 6.898433e+05 1.563818e+05 1.295873e+05 1.337332e+05 1.742942e+05 2.899284e+05 5.832812e+05 7.475222e+05 2.988050e+05 2.129570e+05 1.461035e+05 2.376901e+05 1.189017e+05 1.459882e+05 1.580347e+05 1.431954e+05 1.510991e+05 1.326550e+05 1.847885e+05 1.451053e+05 1.870019e+05 1.861186e+05 1.579411e+05 1.662992e+05 2.955787e+05 1.418479e+05 1.762422e+05 1.665827e+05 1.574334e+05 1.727863e+05 1.300560e+05 1.098626e+05 1.158340e+05 1.793307e+05 1.411240e+05 1.196168e+05 1.391671e+05 1.127942e+05 1.312493e+05 1.242827e+05 1.384054e+05 1.036111e+05 1.633241e+05 1.074990e+05 1.213831e+05 1.610677e+05 2.655092e+05 1.312641e+05 2.116202e+05 1.060189e+05 1.039907e+05 1.420817e+05 1.406683e+05 2.842102e+05 1.095172e+05 1.277089e+05 1.681951e+05 1.374983e+05 1.288895e+05 1.411426e+05 1.903076e+05 1.916775e+05 1.864545e+05 1.404882e+05 1.053256e+05 1.326729e+05 4.328875e+05 1.338936e+05 2.604925e+05 1.559614e+05 1.267762e+05 1.289248e+05 1.164656e+05 2.447091e+05 3.241018e+05 1.514007e+05 1.797527e+05 1.345759e+05 1.015385e+05 1.003094e+05 2.302936e+05 1.413329e+05 2.792551e+05 1.182278e+05 1.403971e+05 1.449015e+05 1.835078e+05 1.307698e+05 1.942202e+05 1.416472e+05 1.289544e+05 3.622535e+05 1.203358e+05 1.769296e+05 1.248308e+05 1.289660e+05 1.393542e+05 2.008392e+05 1.151068e+05 2.407095e+05 1.505607e+05 1.474712e+05 1.335921e+05 1.792524e+05 1.537507e+05 1.311481e+05 3.364277e+05 1.669538e+05 1.340894e+05 1.074463e+05 1.180296e+05 1.535526e+05 1.418833e+05 2.291076e+05 1.680303e+05 1.202480e+05 1.328531e+05 1.422729e+05 1.489356e+05 1.423960e+05 1.632388e+05 1.620711e+05 1.374300e+05 1.358919e+05 1.486156e+05 9.944161e+04 1.458930e+05 1.347794e+05 1.736394e+05 1.138087e+05 4.427439e+06 4.641506e+06 4.046220e+06 3.250791e+06 3.222721e+06 4.394283e+06 3.508551e+06 4.223090e+06 3.292893e+06 4.531016e+06 6.079654e+06 3.134395e+06 5.021602e+06 3.679638e+06 4.168356e+06 3.096470e+06 4.114154e+06 5.599856e+06 4.280247e+06 3.631715e+06 4.231792e+06 4.329488e+06 1.151193e+05 3.748666e+06 3.675721e+06 3.344154e+06 5.770294e+06 3.930037e+06 3.569077e+06 4.375847e+06 4.406757e+06 4.004240e+06 4.024947e+06 4.236355e+06 4.009423e+06 4.166355e+06 4.016983e+06 5.732405e+06 3.602760e+06 4.105593e+06 3.559374e+06 3.645405e+06 4.021251e+06 4.852347e+06 4.431336e+06 3.364932e+06 5.260755e+06 4.563331e+06 3.643905e+06 3.740377e+06 3.763666e+06 4.335987e+06 4.161515e+06 5.366732e+06 3.819495e+06 3.254561e+06 4.458935e+06 4.527704e+06 4.341488e+06 1.402636e+05 1.570680e+05 1.684153e+05 1.416070e+05 1.284304e+05 1.365326e+05 2.167141e+05 1.814117e+05 1.810825e+05 1.992104e+05 1.297862e+05 1.231793e+05 1.461966e+05 1.220120e+05 2.560694e+05 1.308354e+05 1.192282e+05 1.447425e+05 1.150918e+05 1.449497e+05 1.150018e+05 1.334578e+05 1.208200e+05 C14 H18 N2 O4_7.047 3.191201e+05 2.456192e+06 2.584804e+06 2.752183e+06 2.686007e+05 2.555106e+06 3.084873e+06 2.720798e+06 192360.66 3.248087e+06 2.834153e+06 2.700211e+06 157459.74 2.648997e+06 2.943924e+06 2.187102e+06 1.755781e+05 3.325670e+06 2.486655e+06 2.575474e+06 1.818029e+05 2.681535e+06 2.963911e+06 3.163605e+06 26586.483 2.470625e+06 2.920599e+06 2.927037e+06 2.038847e+04 2.427147e+06 2.924515e+06 2.885195e+06 135827.95 2.682059e+06 2.616352e+06 2.923170e+06 1.321417e+05 2.409654e+06 2.995739e+06 3.310282e+06 1.278796e+05 2.095077e+06 2.832262e+06 3.417952e+06 1.353095e+05 2.380695e+06 2.509806e+06 2.882667e+06 4.218650e+05 3.334605e+06 2.553432e+06 4.437004e+06 7.529787e+05 2.206397e+06 2.931988e+06 2.562969e+06 4.186325e+06 3.941713e+06 1.968730e+06 4.174698e+06 1.567315e+06 1.286716e+06 1.608795e+06 3.524777e+06 2.637164e+06 1.953727e+06 1.917847e+06 8.539847e+05 1.371470e+06 2.323554e+06 2.412845e+06 3.042504e+06 1.449363e+06 2.016104e+06 2.687608e+06 1.382685e+06 2.476275e+06 5.503876e+05 1.194932e+06 2.193604e+06 3.448812e+05 2.821680e+06 6.633696e+04 1.684531e+06 3.226755e+06 4.150175e+06 1.651903e+05 3.587584e+06 4.623832e+06 6.484221e+05 3.115996e+06 1.484861e+06 1.124442e+06 1.515836e+06 1.423983e+06 6.385798e+06 1.915722e+06 1.175447e+06 2.027765e+06 9.401314e+05 9.591301e+05 2.992799e+06 1.829803e+06 6.457802e+05 9.669232e+05 1.237248e+06 1.042403e+06 3.448172e+06 3.924471e+05 1.926667e+06 8.315603e+05 1.198040e+06 1.511016e+06 1.195529e+06 9.166489e+05 1.812100e+06 1.190958e+06 7.142307e+05 2.258347e+06 3.290944e+06 1.611278e+06 1.880700e+06 1.044935e+06 1.697155e+06 1.284355e+06 2.426634e+06 1.803925e+06 3.677481e+05 2.606772e+05 4.546027e+05 7.027085e+05 2.377351e+06 1.067804e+06 9.564890e+05 4.758064e+06 1.121992e+06 1.142133e+06 2.312316e+06 2.583194e+06 6.856339e+06 5.541235e+05 1.959297e+06 2.395328e+06 2.699775e+06 2.330123e+06 7.774676e+05 1.841773e+06 7.326294e+05 2.018486e+06 5.233281e+05 2.173422e+06 1.574359e+06 1.852880e+06 3.603220e+06 2.852845e+06 8.093627e+06 2.778697e+06 1.486517e+06 3.245405e+06 1.612436e+06 1.798772e+06 4.601971e+06 8.707138e+06 1.495411e+06 2.948109e+06 5.522367e+06 1.669597e+06 2.203918e+06 2.408528e+06 1.551554e+06 4.583328e+06 5.569178e+06 1.876647e+06 6.784566e+05 1.778278e+06 1.813584e+06 2.599373e+06 2.376383e+06 2.054940e+06 1.379233e+06 1.925873e+05 8.816227e+05 9.939275e+05 3.488657e+05 2.244882e+06 9.167739e+05 5.937712e+06 4.740772e+06 1.422385e+06 1.225061e+07 2.198681e+06 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2.943420e+05 1.725378e+06 1.720202e+06 1.775094e+06 259279.42 2.045566e+06 1.504446e+06 2.134582e+06 207569.90 1.632498e+06 1.954149e+06 1.452740e+06 2.173250e+05 2.176623e+06 1.443147e+06 1.640260e+06 2.195074e+05 1.911935e+06 2.083645e+06 1.647489e+06 32690.468 1.881615e+06 1.730970e+06 1.641943e+06 2.449819e+04 1.750239e+06 1.693956e+06 2.707442e+06 155926.54 1.471036e+06 1.565606e+06 1.721171e+06 1.584978e+05 1.588542e+06 1.932769e+06 2.111857e+06 1.616978e+05 1.359314e+06 2.008447e+06 1.798218e+06 1.814292e+05 1.725300e+06 1.779031e+06 1.805951e+06 1.061756e+05 6.360765e+04 3.363348e+05 7.472408e+04 6.065722e+04 6.597671e+04 1.008345e+05 1.365581e+05 9.975709e+04 1.709251e+05 1.299786e+05 1.039605e+05 5.741710e+04 9.695944e+04 7.556464e+04 6.931465e+04 7.628565e+04 1.222112e+05 1.011196e+05 6.153169e+04 6.647444e+04 8.366235e+04 1.456781e+05 9.453700e+04 7.203819e+04 6.713545e+04 1.086224e+05 6.469842e+04 1.011381e+05 7.899109e+04 1.042194e+05 6.822633e+04 8.298202e+04 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1.128684e+05 1.473954e+05 8.935077e+04 1.122209e+05 1.201047e+05 1.987273e+05 2.010477e+05 1.604662e+05 19420.943 1.366249e+05 7.154421e+04 1.209624e+05 1.625949e+04 2.199172e+05 1.832682e+05 1.217589e+05 123348.17 1.031312e+05 2.021210e+05 1.014890e+05 1.385173e+05 1.553965e+05 1.380231e+05 1.940086e+05 1.331610e+05 1.276431e+05 1.280240e+05 9.750675e+04 1.118101e+05 2.008730e+05 1.205708e+05 1.665373e+05 4.023624e+04 2.764158e+04 1.961429e+05 6.303338e+04 5.123841e+04 5.403250e+04 4.895298e+04 7.030603e+04 9.226047e+04 6.472546e+04 1.206997e+05 4.241526e+04 4.451284e+04 8.305669e+04 3.628619e+04 6.999445e+04 6.336645e+04 3.986943e+04 3.787679e+04 5.259984e+04 3.538672e+04 3.802653e+04 7.534895e+04 3.750884e+04 3.756605e+04 3.709416e+04 4.737173e+04 3.730236e+04 4.933372e+04 4.321476e+04 4.090571e+04 5.875009e+04 3.102967e+04 3.450336e+04 5.102278e+04 7.019741e+04 4.446732e+04 4.110477e+04 3.895802e+04 3.145928e+04 3.675916e+04 3.529825e+04 3.967945e+04 3.108833e+04 4.185855e+04 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5.355686e+04 4.701399e+04 3.216838e+04 3.818633e+04 4.565845e+04 3.534245e+04 8.537142e+04 4.145184e+04 3.599728e+04 4.756169e+04 5.048018e+04 3.230688e+04 5.438220e+04 4.297011e+04 3.715626e+04 C12 H25 Cl O12 P2_7.048 1.860918e+05 4.205052e+06 4.742107e+06 4.809961e+06 4.564259e+05 5.173851e+06 4.947257e+06 5.210654e+06 301108.94 5.844890e+06 4.004311e+06 6.200844e+06 227220.56 4.166668e+06 5.482317e+06 3.973842e+06 2.426107e+05 5.720737e+06 4.011188e+06 4.182703e+06 2.322369e+05 5.672605e+06 5.936331e+06 5.005236e+06 35542.887 4.483801e+06 4.990672e+06 4.875577e+06 2.849115e+04 4.730334e+06 5.221413e+06 5.228362e+06 188077.33 4.674909e+06 5.078460e+06 4.929392e+06 1.776604e+05 4.066477e+06 5.806147e+06 6.143329e+06 1.794118e+05 3.343732e+06 5.216605e+06 6.024365e+06 2.167402e+05 4.085827e+06 4.465613e+06 5.256620e+06 8.912245e+04 7.406016e+04 4.215852e+05 8.216425e+04 7.200857e+04 7.620151e+04 1.091638e+05 1.832689e+05 9.055878e+04 1.311523e+05 1.060693e+05 1.000069e+05 6.961035e+04 1.173548e+05 8.198997e+04 8.179692e+04 8.862577e+04 8.449335e+04 7.329159e+04 7.771986e+04 1.162534e+05 7.398132e+04 1.837845e+05 7.675307e+04 9.145741e+04 7.115310e+04 8.449507e+04 6.339932e+04 1.076920e+05 8.350529e+04 9.581511e+04 7.466441e+04 9.502390e+04 6.899133e+04 6.558981e+04 7.812410e+04 8.596272e+04 6.721083e+04 8.188655e+04 7.649197e+04 7.081533e+04 6.726256e+04 6.943775e+04 9.124668e+04 7.343295e+04 1.008216e+05 7.176717e+04 9.458917e+04 7.501944e+04 7.524390e+04 1.365752e+05 7.825280e+04 7.352467e+04 7.260597e+04 6.906091e+04 8.267553e+04 5.893750e+04 6.968344e+04 7.236540e+04 7.746680e+04 6.701817e+04 7.750647e+04 9.288357e+04 7.942615e+04 9.451548e+04 7.823398e+04 9.093410e+04 1.180654e+05 9.912396e+04 7.691635e+04 7.113086e+04 7.663699e+04 7.365365e+04 7.659717e+04 6.526076e+04 7.981425e+04 7.466010e+04 7.075032e+04 1.295788e+05 8.452441e+04 8.594306e+04 8.469927e+04 7.365919e+04 8.144466e+04 8.025603e+04 6.717531e+04 7.626141e+04 7.500764e+04 9.950509e+04 7.123906e+04 8.586859e+04 7.791866e+04 7.589456e+04 1.105311e+05 8.063944e+04 6.893042e+04 1.193313e+05 7.388683e+04 7.887953e+04 7.212647e+04 1.029621e+05 7.045761e+04 9.724811e+04 7.162567e+04 7.067273e+04 7.824812e+04 7.361169e+04 1.291353e+05 8.631478e+04 1.202221e+05 7.357974e+04 8.499040e+04 6.866219e+04 8.980350e+04 8.315697e+04 1.331885e+05 7.648406e+04 8.885493e+04 7.003775e+04 8.003793e+04 7.356253e+04 7.247459e+04 8.542968e+04 8.230741e+04 7.950800e+04 7.212491e+04 8.608745e+04 8.992784e+04 7.016426e+04 8.043738e+04 9.042065e+04 7.455567e+04 1.554004e+07 8.701964e+06 8.558079e+06 9.046923e+06 6.886987e+06 1.157310e+07 1.116439e+07 1.457013e+07 1.259789e+07 1.354631e+07 1.332799e+07 1.016126e+07 1.968622e+07 8.259214e+06 1.469767e+07 9.283615e+06 1.804758e+07 1.583777e+07 1.286402e+07 8.450773e+06 2.044075e+07 1.520886e+07 6.379673e+04 1.192389e+07 8.446305e+06 5.646699e+06 1.119282e+07 1.162954e+07 1.324571e+07 1.118861e+07 1.191779e+07 1.207947e+07 1.345759e+07 1.026656e+07 1.153184e+07 1.077762e+07 1.152702e+07 1.188295e+07 9.254743e+06 1.311876e+07 1.128652e+07 1.150542e+07 1.192396e+07 1.078184e+07 1.175040e+07 8.215271e+06 1.380995e+07 1.913451e+07 8.966961e+06 1.393234e+07 1.231122e+07 1.190803e+07 1.266607e+07 1.265781e+07 1.144460e+07 9.669549e+06 1.533746e+07 1.244488e+07 1.165604e+07 1.376462e+05 7.530568e+04 1.084242e+05 6.928371e+04 1.265583e+05 1.002403e+05 1.306651e+05 6.803551e+04 1.045178e+05 7.006995e+04 7.465977e+04 1.032270e+05 7.909578e+04 1.031967e+05 1.832747e+05 1.287772e+05 7.971033e+04 1.391339e+05 6.868574e+04 6.969340e+04 6.863686e+04 7.159118e+04 7.855417e+04 C5 H8 N O3 P_7.049 1.239665e+05 3.434903e+06 3.331984e+06 4.090084e+06 3.312568e+05 3.996428e+06 4.021337e+06 3.663153e+06 273039.98 4.684920e+06 3.346728e+06 4.223540e+06 266179.72 3.522167e+06 4.059198e+06 3.231199e+06 2.611417e+05 4.340655e+06 3.624139e+06 3.366266e+06 2.707661e+05 4.235523e+06 4.021311e+06 3.569798e+06 44479.280 4.053774e+06 3.897807e+06 3.934857e+06 3.657140e+04 3.767859e+06 3.686012e+06 3.510992e+06 223704.98 3.608996e+06 4.764817e+06 4.311865e+06 2.134054e+05 3.241658e+06 3.580166e+06 4.274910e+06 2.275014e+05 3.193467e+06 4.074022e+06 4.398093e+06 2.534522e+05 3.460336e+06 2.942646e+06 4.522120e+06 9.928032e+04 7.631677e+04 4.664568e+05 1.078989e+05 8.474573e+04 1.594586e+05 1.164928e+05 3.114008e+05 6.835311e+05 7.838094e+05 4.174971e+05 1.603798e+05 8.368392e+04 3.122848e+05 8.657978e+04 1.237615e+05 1.718238e+05 1.912382e+05 8.313052e+04 1.756387e+05 1.304513e+05 8.924861e+04 2.076017e+05 8.834595e+04 9.607665e+04 1.374983e+05 1.019495e+05 8.015851e+04 1.212703e+05 1.348024e+05 1.810883e+05 9.421825e+04 1.386123e+05 7.533735e+04 8.084545e+04 1.771109e+05 9.858431e+04 8.508211e+04 9.300690e+04 8.309475e+04 1.075923e+05 8.146649e+04 9.568047e+04 8.412782e+04 1.749532e+05 9.549422e+04 8.671152e+04 1.041385e+05 1.265118e+05 9.649833e+04 1.508018e+05 8.289669e+04 7.811414e+04 8.784311e+04 8.699942e+04 2.080217e+05 6.919079e+04 8.425469e+04 8.809067e+04 9.369552e+04 8.197753e+04 1.193856e+05 1.122324e+05 2.208019e+05 1.139407e+05 1.168871e+05 9.023513e+04 9.213690e+04 2.011229e+05 1.025417e+05 8.806345e+04 9.011044e+04 9.454507e+04 9.514978e+04 1.104082e+05 1.598076e+05 1.722116e+05 8.811614e+04 1.118872e+05 8.739310e+04 8.596797e+04 8.439103e+04 8.881605e+04 9.904361e+04 1.514942e+05 8.133263e+04 7.835963e+04 1.555667e+05 2.362486e+05 8.598186e+04 1.067196e+05 1.455327e+05 9.453205e+04 2.979683e+05 8.419302e+04 9.873093e+04 9.677442e+04 8.912819e+04 1.722703e+05 1.551189e+05 9.946862e+04 1.568835e+05 1.135604e+05 1.013387e+05 8.783595e+04 2.029013e+05 9.586891e+04 1.106433e+05 1.047923e+05 1.060976e+05 8.908571e+04 9.642618e+04 8.121784e+04 1.238860e+05 9.606640e+04 1.817366e+05 9.028321e+04 1.244274e+05 8.934098e+04 9.784292e+04 9.294262e+04 8.986950e+04 1.253297e+05 9.691969e+04 1.005109e+05 1.284046e+05 1.293174e+05 9.038231e+04 9.021212e+04 1.012923e+05 1.446899e+05 1.850801e+05 6.175121e+06 5.438704e+06 4.446715e+06 4.929735e+06 4.168722e+06 6.916067e+06 5.661738e+06 5.129048e+06 5.419224e+06 6.162981e+06 5.456307e+06 5.404993e+06 4.171864e+06 4.633942e+06 5.449873e+06 4.488832e+06 5.341291e+06 5.868912e+06 5.500687e+06 4.931780e+06 6.409995e+06 5.296834e+06 7.776085e+04 5.363189e+06 5.231153e+06 4.295771e+06 5.327588e+06 5.893107e+06 4.992356e+06 5.747954e+06 5.033775e+06 5.164645e+06 4.703638e+06 5.444428e+06 5.333701e+06 5.044093e+06 4.899865e+06 5.536262e+06 4.508754e+06 4.756117e+06 5.338920e+06 5.319600e+06 5.613104e+06 5.115725e+06 5.166982e+06 4.766286e+06 5.968589e+06 5.426137e+06 4.556084e+06 6.785748e+06 5.198884e+06 5.599819e+06 5.234632e+06 5.289706e+06 6.506730e+06 6.714119e+06 6.719093e+06 5.157782e+06 5.386680e+06 1.062083e+05 1.634855e+05 9.432624e+04 1.155289e+05 1.029222e+05 1.035829e+05 1.425524e+05 1.182179e+05 1.251016e+05 1.126169e+05 7.849554e+04 1.036501e+05 9.572350e+04 1.105208e+05 4.914670e+05 1.026665e+05 8.639462e+04 1.172856e+05 9.417514e+04 8.775051e+04 1.350706e+05 8.667332e+04 8.897087e+04 C4 H4 O2_7.049 1.066671e+07 1.415958e+07 1.175460e+07 1.344835e+07 6.165957e+05 1.408401e+07 1.108368e+07 1.079854e+07 1026627.11 1.808631e+07 1.127680e+07 1.562408e+07 403452.05 1.167523e+07 1.493117e+07 1.273955e+07 4.453332e+05 1.443357e+07 1.175348e+07 1.199863e+07 4.775948e+05 1.135729e+07 1.597072e+07 1.221740e+07 246243.112 1.383981e+07 1.332397e+07 1.317920e+07 1.592396e+05 1.352967e+07 1.373863e+07 1.349761e+07 355630.87 1.226074e+07 1.286635e+07 1.414017e+07 4.642767e+05 1.274323e+07 1.365280e+07 1.570342e+07 3.359159e+05 9.923031e+06 1.291031e+07 1.433400e+07 3.686850e+05 1.340713e+07 1.288746e+07 1.326507e+07 5.673665e+06 3.747491e+06 8.010156e+06 7.902504e+06 5.503698e+06 5.638722e+06 8.803906e+06 8.073323e+06 1.068377e+07 9.492493e+06 7.949559e+06 1.059810e+07 4.877826e+06 7.193924e+06 6.014624e+06 9.733491e+06 8.823714e+06 5.402742e+06 3.502516e+06 6.729262e+06 4.110196e+06 6.230182e+06 1.164384e+07 6.524549e+06 7.295920e+06 5.629889e+06 6.972367e+06 4.367932e+06 8.473942e+06 7.799327e+06 6.472861e+06 5.039382e+06 5.938556e+06 4.300227e+06 4.707748e+06 5.080419e+06 6.004926e+06 4.649810e+06 3.833470e+06 2.002054e+06 6.491974e+06 5.336466e+06 3.992650e+06 4.871830e+06 6.644656e+06 4.964600e+06 5.372208e+06 7.544994e+06 5.076232e+06 5.715045e+06 7.038361e+06 6.315967e+06 4.482835e+06 4.747017e+06 5.465553e+06 7.219909e+06 4.498675e+06 5.595480e+06 5.891335e+06 5.772237e+06 5.150143e+06 5.175270e+06 3.717089e+06 5.529683e+06 8.134901e+06 5.148178e+06 4.073889e+06 4.888257e+06 5.350451e+06 4.646218e+06 5.294704e+06 5.610020e+06 4.797915e+06 6.522461e+06 3.396915e+06 6.094697e+06 6.346441e+06 6.243240e+06 7.343042e+06 5.114580e+06 4.196674e+06 4.674968e+06 6.554350e+06 5.900831e+06 4.178096e+06 2.552392e+06 5.005054e+06 5.938511e+06 7.385555e+06 4.769074e+06 5.860188e+06 6.081849e+06 5.174470e+06 7.127187e+06 3.870620e+06 4.195214e+06 6.391964e+06 6.335702e+06 5.430851e+06 4.847948e+06 5.555097e+06 3.417260e+06 4.478921e+06 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3.065130e+05 1.051726e+06 5.602297e+05 4.856273e+05 4.126769e+05 2.988418e+05 3.499893e+05 2.979780e+05 3.586284e+05 3.518845e+05 C19 H21 N O7 S2_7.053 1.462628e+05 9.567430e+05 1.044257e+06 9.211271e+05 2.590545e+05 9.291670e+05 1.157902e+06 1.153772e+06 171790.58 1.374070e+06 9.591568e+05 1.168473e+06 145686.65 8.554801e+05 1.248802e+06 8.197196e+05 1.616418e+05 1.064538e+06 1.017989e+06 8.601632e+05 1.570221e+05 1.214679e+06 1.338142e+06 8.585139e+05 23140.504 1.085300e+06 1.170166e+06 8.788133e+05 1.724013e+04 1.113311e+06 1.142663e+06 1.144535e+06 116385.57 1.058642e+06 1.035235e+06 1.057072e+06 1.267284e+05 1.062995e+06 1.005279e+06 1.192885e+06 1.279008e+05 7.549525e+05 1.227112e+06 1.237399e+06 1.191309e+05 9.393452e+05 9.294929e+05 1.162501e+06 8.422040e+04 4.561997e+04 2.234191e+05 8.728196e+04 4.755951e+04 6.107820e+04 7.229440e+04 2.238982e+05 8.034763e+05 8.376179e+05 5.394988e+05 6.628391e+04 6.617036e+04 2.326516e+05 5.565575e+04 5.595040e+04 1.486799e+05 4.539293e+04 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1.046359e+07 8.385615e+06 1.290076e+07 4.129831e+05 9.764023e+06 5.964550e+06 1.421251e+07 272390.31 1.385087e+07 7.746613e+06 1.256257e+07 251696.98 6.994911e+06 1.250541e+07 1.011815e+07 2.377035e+05 1.225351e+07 7.923926e+06 8.322848e+06 2.732064e+05 1.233822e+07 1.314088e+07 7.856498e+06 45749.040 8.398204e+06 1.471016e+07 7.694705e+06 3.310533e+04 1.034889e+07 1.232564e+07 1.197357e+07 214677.64 8.030460e+06 1.166810e+07 9.763135e+06 2.089072e+05 1.032268e+07 1.050288e+07 1.255142e+07 2.140889e+05 8.163766e+06 1.130951e+07 9.031963e+06 2.257784e+05 1.181619e+07 8.212307e+06 1.221813e+07 3.856487e+06 1.744455e+06 5.196505e+06 3.726302e+06 2.431785e+06 3.002582e+06 2.849711e+06 4.402999e+06 6.366244e+06 5.451448e+06 4.727206e+06 3.801773e+06 1.913695e+06 3.791227e+06 2.323941e+06 4.340054e+06 4.638237e+06 3.051226e+06 2.053632e+06 3.026979e+06 2.699799e+06 2.898754e+06 4.344481e+06 2.377674e+06 3.185941e+06 2.802744e+06 3.129343e+06 2.173114e+06 3.637931e+06 3.262907e+06 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8.051331e+04 1.211522e+05 9.156346e+04 1.349241e+05 8.509344e+04 1.057177e+05 1.266453e+05 8.244319e+04 1.059153e+05 8.894547e+04 1.025314e+05 9.287486e+04 9.713794e+04 1.303388e+05 9.300353e+04 7.411258e+04 8.785904e+04 9.388107e+04 1.317347e+05 1.699068e+05 3.329278e+06 4.675773e+06 5.047701e+06 4.833459e+06 4.422621e+06 3.520117e+06 4.826453e+06 4.604555e+06 2.663879e+06 4.034578e+06 6.866351e+06 4.279128e+06 4.523638e+06 5.618494e+06 6.345756e+06 5.466333e+06 5.161332e+06 4.937132e+06 6.847454e+06 4.133391e+06 3.672142e+06 4.078289e+06 7.995059e+04 5.173976e+06 5.442899e+06 5.282665e+06 6.834244e+06 6.069744e+06 5.943255e+06 4.405032e+06 6.162893e+06 7.508631e+06 4.502988e+06 4.006867e+06 3.781550e+06 5.446707e+06 4.246907e+06 3.629475e+06 4.645543e+06 4.538078e+06 5.463738e+06 5.116887e+06 6.432693e+06 4.945866e+06 6.048764e+06 4.778966e+06 7.332938e+06 3.368425e+06 2.072135e+06 6.441292e+06 5.383886e+06 5.414738e+06 5.522873e+06 8.494912e+06 6.888470e+06 5.229558e+06 4.422558e+06 6.259248e+06 4.000587e+06 8.401990e+04 1.738022e+05 7.659976e+04 1.191203e+05 1.170414e+05 8.692538e+04 1.051244e+05 9.740907e+04 1.253506e+05 1.233427e+05 6.708918e+04 8.567884e+04 1.165682e+05 9.016892e+04 5.225123e+05 8.349720e+04 7.281990e+04 9.525627e+04 1.051169e+05 7.208496e+04 1.274794e+05 9.112151e+04 7.860628e+04 C8 H6 N2 O4 S_7.069 4.123357e+06 1.599397e+06 1.327227e+06 1.553687e+06 3.073325e+05 1.530609e+06 1.628421e+06 1.460331e+06 236885.45 2.057377e+06 1.233414e+06 1.828765e+06 256478.45 1.281555e+06 1.699762e+06 1.270237e+06 2.117918e+05 2.058017e+06 1.431605e+06 1.232560e+06 2.423451e+05 1.615719e+06 1.730762e+06 1.486531e+06 39800.328 1.542398e+06 1.637953e+06 1.592497e+06 2.883174e+04 1.532345e+06 1.471524e+06 1.633536e+06 182291.09 1.623319e+06 1.626449e+06 1.701404e+06 1.989327e+05 1.557596e+06 1.454773e+06 1.521193e+06 2.036970e+05 1.288206e+06 1.574001e+06 1.693287e+06 1.752135e+05 1.505572e+06 1.586917e+06 1.598111e+06 2.048525e+06 1.746855e+06 2.606722e+06 3.231862e+06 2.474718e+06 2.233261e+06 2.606371e+06 2.548822e+06 3.694791e+06 2.718677e+06 3.054806e+06 3.212543e+06 2.351499e+06 2.025901e+06 2.183866e+06 3.716484e+06 3.896670e+06 1.894343e+06 1.829081e+06 2.540595e+06 2.194032e+06 2.506645e+06 3.878912e+06 2.231217e+06 2.059945e+06 2.316397e+06 2.679166e+06 1.731094e+06 3.052466e+06 2.738395e+06 2.359568e+06 2.395618e+06 2.075613e+06 1.674734e+06 2.041219e+06 1.790973e+06 2.192089e+06 1.668970e+06 1.503157e+06 1.194245e+06 2.296420e+06 1.957634e+06 1.695081e+06 1.809249e+06 2.824430e+06 1.863114e+06 1.982640e+06 2.686472e+06 2.419167e+06 2.295028e+06 2.534869e+06 2.063244e+06 1.545598e+06 2.071708e+06 2.305364e+06 2.948592e+06 1.905954e+06 2.141335e+06 2.508169e+06 2.368802e+06 2.038499e+06 2.206329e+06 1.726363e+06 2.255833e+06 2.684211e+06 2.406094e+06 1.582387e+06 1.834621e+06 2.225043e+06 2.407916e+06 1.939699e+06 2.148381e+06 2.078731e+06 2.547607e+06 1.388385e+06 2.461811e+06 2.676662e+06 2.394148e+06 3.136068e+06 1.522490e+06 2.022021e+06 1.896283e+06 2.653573e+06 2.619014e+06 1.561599e+06 1.186376e+06 1.618750e+06 2.094880e+06 2.146147e+06 1.992806e+06 2.260314e+06 2.492363e+06 2.234636e+06 2.750924e+06 1.596609e+06 1.805561e+06 2.230402e+06 2.653463e+06 2.171065e+06 1.902363e+06 1.866381e+06 1.487166e+06 2.080603e+06 2.628754e+06 2.309276e+06 2.674699e+06 2.400564e+06 3.453366e+06 2.045504e+06 2.961411e+06 2.937073e+06 2.065699e+06 1.660528e+06 2.917182e+06 2.585303e+06 1.744192e+06 2.463653e+06 2.328146e+06 2.385117e+06 2.253086e+06 2.511890e+06 2.884685e+06 1.667763e+06 2.680662e+06 2.355109e+06 2.740712e+06 1.964440e+06 1.808062e+06 2.047571e+06 2.804352e+06 2.047504e+06 1.661826e+06 7.331445e+05 1.340832e+06 1.127210e+06 1.007940e+06 8.859350e+05 9.687286e+05 8.123764e+05 6.001015e+05 3.814917e+05 1.368294e+06 8.524783e+05 5.411471e+05 3.662662e+06 1.341486e+06 4.345212e+05 5.677638e+05 6.747929e+05 9.837977e+05 7.122597e+05 6.620474e+05 1.144516e+06 8.554099e+05 2.250652e+06 1.187799e+06 8.661909e+05 8.462295e+05 8.452906e+05 6.979073e+05 8.812935e+05 7.759583e+05 1.075988e+06 7.745533e+05 9.049166e+05 9.442052e+05 4.867621e+05 8.367048e+05 6.459815e+05 9.004660e+05 5.608771e+05 8.858386e+05 8.523330e+05 9.563711e+05 6.586416e+05 6.144010e+05 8.500684e+05 7.260309e+05 1.284785e+06 7.061029e+05 6.848749e+05 1.250480e+06 7.749261e+05 8.584765e+05 8.838817e+05 8.230403e+05 6.923042e+05 8.831021e+05 9.867581e+05 1.025487e+06 9.029381e+05 2.582621e+06 2.045457e+06 2.919409e+06 2.363440e+06 2.812660e+06 2.180648e+06 2.156799e+06 2.209394e+06 2.310904e+06 2.093068e+06 1.892753e+06 3.131305e+06 2.536691e+06 1.950274e+06 3.214087e+06 2.668923e+06 2.155098e+06 2.951699e+06 1.631573e+06 1.827703e+06 2.141310e+06 2.192839e+06 1.935954e+06 478.08861_7.069 3.299957e+06 4.898798e+05 5.284727e+05 4.688117e+05 1.791616e+05 5.772266e+05 6.345467e+05 4.773581e+05 124987.84 7.978863e+05 3.590682e+05 6.964574e+05 120483.92 4.561895e+05 6.710421e+05 4.656966e+05 1.307985e+05 5.397349e+05 5.128150e+05 4.815565e+05 1.326542e+05 5.829309e+05 6.462158e+05 4.618821e+05 20732.025 5.540710e+05 6.825864e+05 4.002406e+05 1.429385e+04 5.892930e+05 5.574497e+05 5.598658e+05 86862.47 5.620837e+05 6.790367e+05 6.096106e+05 1.050822e+05 5.577971e+05 1.961396e+05 6.454427e+05 1.040052e+05 5.258197e+05 5.928877e+05 6.067018e+05 8.670612e+04 6.090960e+05 3.626820e+05 6.601900e+05 9.729841e+05 1.269684e+06 1.497245e+06 2.655627e+06 1.363433e+06 1.207583e+06 2.022403e+06 1.345601e+06 2.972859e+06 2.736292e+06 2.138227e+06 3.123214e+06 1.490442e+06 1.522528e+06 1.891886e+06 2.979506e+06 3.616894e+06 8.292160e+05 9.644621e+05 1.570792e+06 1.229862e+06 1.477402e+06 2.745922e+06 1.600694e+06 1.329928e+06 1.322105e+06 1.757492e+06 8.706966e+05 2.153881e+06 1.740148e+06 1.733687e+06 1.367852e+06 1.042628e+06 9.290284e+05 1.070848e+06 1.208086e+06 1.320453e+06 9.296365e+05 5.150793e+05 5.628345e+05 1.270867e+06 1.210386e+06 9.187865e+05 8.937987e+05 1.726864e+06 1.177855e+06 1.204851e+06 2.201063e+06 1.251131e+06 1.285745e+06 1.574069e+06 1.243322e+06 8.966813e+05 1.096410e+06 1.233893e+06 1.944310e+06 1.041485e+06 1.084629e+06 1.535841e+06 1.320171e+06 1.101874e+06 1.171703e+06 6.615033e+05 1.379988e+06 1.993148e+06 1.058825e+06 8.462585e+05 8.876523e+05 1.393081e+06 1.301180e+06 1.197985e+06 1.302682e+06 9.348339e+05 1.560675e+06 5.706334e+05 1.254067e+06 1.447617e+06 1.467858e+06 2.063552e+06 7.267334e+05 9.090707e+05 1.238452e+06 1.652160e+06 1.449496e+06 6.375108e+05 5.245648e+05 9.795100e+05 1.484089e+06 1.109832e+06 8.497508e+05 1.365927e+06 1.308168e+06 1.166689e+06 1.753901e+06 1.048659e+06 9.437421e+05 1.388195e+06 1.408653e+06 1.084428e+06 8.569654e+05 1.045778e+06 4.933342e+05 1.411032e+06 1.399396e+06 1.322619e+06 1.973887e+06 1.484154e+06 2.092976e+06 9.808871e+05 1.750790e+06 2.062667e+06 1.281136e+06 8.674108e+05 1.936621e+06 1.683444e+06 1.188580e+06 1.367707e+06 1.590174e+06 1.386188e+06 1.315838e+06 1.082077e+06 2.009971e+06 8.334071e+05 1.771354e+06 1.463293e+06 1.899504e+06 8.802956e+05 1.172181e+06 1.221043e+06 1.888853e+06 1.378518e+06 8.821380e+05 1.500768e+05 4.271565e+05 1.274580e+05 1.360840e+05 1.636632e+05 1.536745e+05 2.649022e+05 7.022933e+04 1.287103e+05 3.345530e+05 1.062326e+05 1.077122e+05 1.304792e+06 4.891986e+05 1.295020e+05 1.507956e+05 1.456338e+05 1.594202e+05 1.617946e+05 2.384896e+05 1.918472e+05 1.514735e+05 9.182664e+05 4.600069e+05 1.316890e+05 8.512106e+04 2.916816e+05 1.249397e+05 1.155069e+05 1.142168e+05 2.736927e+05 1.248104e+05 1.614706e+05 9.043537e+04 1.303048e+05 2.452181e+05 2.206336e+05 2.128280e+05 9.420356e+04 1.907018e+05 1.326670e+05 1.203677e+05 1.047473e+05 8.336848e+04 1.234431e+05 8.780523e+04 3.513155e+05 1.413857e+05 1.101664e+05 3.652972e+05 1.196508e+05 2.238788e+05 1.869016e+05 2.074730e+05 1.212908e+05 2.187802e+05 1.145114e+05 2.325970e+05 2.502909e+05 1.437205e+06 1.645612e+06 1.971369e+06 1.512832e+06 1.758473e+06 1.808844e+06 9.558780e+05 1.630773e+06 1.409508e+06 1.281666e+06 1.276099e+06 2.394467e+06 1.385065e+06 1.442643e+06 2.260937e+06 2.140430e+06 1.449127e+06 1.620886e+06 9.109043e+05 1.255311e+06 1.236021e+06 1.203598e+06 1.472879e+06 C8 H13 N O2_7.07 2.085100e+06 1.155496e+06 1.238392e+06 1.093465e+06 2.106842e+05 9.899025e+05 1.915654e+06 1.213469e+06 155352.51 1.160172e+06 1.173841e+06 1.628291e+06 157013.61 9.962147e+05 1.385056e+06 1.316926e+06 1.646934e+05 1.142955e+06 1.083417e+06 1.171539e+06 1.877552e+05 1.201323e+06 1.418155e+06 1.352568e+06 31577.827 1.218982e+06 1.261883e+06 1.259541e+06 2.068373e+04 1.198988e+06 1.181995e+06 1.674718e+06 127034.40 9.866002e+05 1.243849e+06 1.352210e+06 1.293029e+05 1.139643e+06 1.316010e+06 1.649464e+06 1.354411e+05 8.218498e+05 1.287785e+06 1.461536e+06 1.475562e+05 1.033918e+06 1.137708e+06 1.409589e+06 6.784304e+06 4.171565e+05 2.783457e+05 2.953344e+06 3.913653e+05 7.222335e+05 2.913125e+06 5.441525e+05 1.229502e+06 1.348534e+06 6.876713e+05 1.249078e+06 1.845561e+06 2.110410e+06 1.511061e+06 5.932779e+05 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4.886978e+06 3.126924e+06 3.441375e+06 5.135789e+06 2.167834e+06 3.431420e+06 3.032021e+06 2.627172e+06 2.200937e+06 3.210722e+06 2.404166e+06 5.139035e+06 3.635990e+06 2.071147e+06 1.798714e+06 4.401182e+06 2.243017e+06 2.138523e+06 3.352125e+06 C4 H10 N O6 P_7.073 1.712352e+05 2.200339e+06 1.481074e+06 1.962768e+06 2.511014e+05 1.645025e+06 1.802980e+06 1.989524e+06 149086.39 2.580850e+06 1.414155e+06 2.323841e+06 144707.36 1.674918e+06 2.408846e+06 1.467874e+06 1.338454e+05 1.833163e+06 1.637460e+06 1.872190e+06 1.209108e+05 2.166082e+06 1.889087e+06 2.168868e+06 19340.820 1.690741e+06 2.118249e+06 1.654541e+06 1.419861e+04 1.979091e+06 2.026406e+06 2.084737e+06 98306.43 1.738829e+06 2.108791e+06 1.470772e+06 1.140030e+05 2.290178e+06 1.611836e+06 2.064569e+06 1.201261e+05 1.910118e+06 2.039416e+06 2.323335e+06 1.211104e+05 1.310791e+06 1.545882e+06 2.337427e+06 5.753391e+04 3.748369e+04 2.179122e+05 5.804510e+04 6.038131e+04 5.942846e+04 1.122775e+05 4.816594e+05 1.253321e+06 1.181951e+06 9.537713e+05 1.506932e+05 5.086952e+04 5.364405e+05 8.922261e+04 1.326856e+05 1.021962e+05 5.815841e+04 8.070324e+04 1.083528e+05 6.559959e+04 7.047351e+04 9.830784e+04 7.166735e+04 4.292535e+04 6.755935e+04 5.360816e+04 3.283052e+04 5.351380e+04 4.432206e+04 1.440328e+05 5.089786e+04 5.085414e+04 9.542010e+04 5.269034e+04 2.737765e+05 6.670514e+04 4.387325e+04 4.236802e+04 4.260376e+04 4.648312e+04 3.605871e+04 7.148453e+04 4.946255e+04 3.837154e+04 5.433505e+04 4.649461e+04 5.378030e+04 7.870182e+04 5.074601e+04 5.949640e+04 4.440139e+04 1.010285e+05 1.101564e+05 4.647492e+04 5.161019e+04 3.630946e+04 3.752114e+04 5.446128e+04 4.064667e+04 3.518464e+04 4.375507e+04 5.561350e+04 7.854739e+04 7.341543e+04 5.968363e+04 4.437268e+04 6.107629e+04 1.044112e+05 5.262477e+04 6.027111e+04 6.745932e+04 4.808662e+04 4.943288e+04 6.207066e+04 4.336079e+04 1.253830e+05 4.632479e+04 1.263524e+05 3.856333e+04 7.621419e+04 8.062145e+04 5.905045e+04 6.063210e+04 7.695703e+04 3.451676e+04 5.985915e+04 1.758766e+05 1.181515e+05 5.623123e+04 4.598129e+04 3.943212e+04 4.923967e+04 4.138083e+05 4.408990e+04 8.376518e+04 6.248223e+04 4.015806e+04 5.426970e+04 3.933194e+04 7.968937e+04 4.903405e+04 5.368764e+04 4.446404e+04 4.027205e+04 8.340640e+04 4.906232e+04 6.782764e+04 6.370690e+04 6.410949e+04 4.784883e+04 4.698666e+04 4.415865e+04 8.163219e+04 7.348883e+04 5.873683e+04 4.645333e+04 7.005260e+04 4.849250e+04 5.612943e+04 4.919528e+04 7.295632e+04 4.467777e+04 5.294823e+04 5.442702e+04 6.297598e+04 4.098477e+04 4.397401e+04 3.881609e+04 9.295714e+04 5.847753e+04 4.246697e+04 8.635757e+05 2.053442e+06 9.541130e+05 1.445284e+06 9.019169e+05 1.407891e+06 1.094015e+06 8.521428e+05 9.755028e+05 1.623229e+06 8.648882e+05 7.465199e+05 1.529435e+07 1.914828e+06 4.863997e+05 6.164307e+05 1.574970e+06 1.259869e+06 7.763296e+05 1.196263e+06 1.736392e+06 1.043025e+06 4.520833e+04 1.634122e+06 9.425474e+05 1.182672e+06 1.120956e+06 8.965545e+05 1.000140e+06 8.352538e+05 1.268102e+06 1.144623e+06 1.005364e+06 1.131157e+06 1.055841e+06 9.836392e+05 1.061896e+06 1.654504e+06 8.272819e+05 1.221240e+06 1.345921e+06 1.398853e+06 7.128238e+05 1.014322e+06 7.842018e+05 8.320004e+05 1.804990e+06 7.768747e+05 1.239281e+06 2.568062e+06 7.854250e+05 1.510469e+06 1.296132e+06 1.128093e+06 9.158695e+05 1.440816e+06 1.961840e+06 1.225164e+06 1.464922e+06 7.136023e+04 2.988144e+05 9.066815e+04 8.820366e+04 6.550691e+04 5.566038e+04 5.731465e+04 3.617089e+04 5.804404e+04 1.059240e+05 8.013470e+04 5.652441e+04 4.234744e+04 5.547278e+04 6.711003e+05 6.870115e+04 4.247113e+04 7.132001e+04 9.059257e+04 4.591606e+04 4.668303e+04 7.434405e+04 4.726297e+04 C8 H15 Cl2 N6 O14 P3_7.073 2.495382e+05 4.665901e+06 4.634001e+06 4.875323e+06 6.530355e+05 4.765825e+06 4.545195e+06 4.282734e+06 451825.60 6.640756e+06 3.387726e+06 6.368501e+06 452368.48 4.294014e+06 5.527711e+06 3.731070e+06 3.635505e+05 5.649150e+06 3.790776e+06 3.539654e+06 3.612830e+05 5.648665e+06 6.618034e+06 3.780125e+06 55144.070 4.866069e+06 4.783912e+06 4.625167e+06 4.098447e+04 5.828678e+06 4.464164e+06 4.072240e+06 274221.69 5.097420e+06 5.268499e+06 5.151625e+06 2.743250e+05 4.789955e+06 5.175527e+06 4.556520e+06 2.839742e+05 3.286234e+06 5.415140e+06 5.478828e+06 2.863669e+05 5.129435e+06 4.383822e+06 4.886511e+06 1.114828e+05 1.048382e+05 5.240247e+05 1.685484e+05 1.143134e+05 1.149152e+05 1.688795e+05 2.139165e+05 1.394961e+05 1.644304e+05 1.943791e+05 1.541892e+05 1.257763e+05 1.497474e+05 1.374043e+05 1.435569e+05 1.520783e+05 1.244304e+05 1.147200e+05 1.178272e+05 1.820703e+05 1.071913e+05 2.720912e+05 1.289977e+05 1.242475e+05 1.089716e+05 1.257021e+05 9.273651e+04 1.578376e+05 1.497612e+05 1.943707e+05 1.267072e+05 1.428557e+05 1.075789e+05 1.018995e+05 1.686772e+05 1.343338e+05 9.973392e+04 1.412291e+05 1.159749e+05 1.089220e+05 1.020347e+05 1.195003e+05 1.388804e+05 1.094137e+05 1.519063e+05 1.143771e+05 1.478453e+05 1.232359e+05 1.188916e+05 1.696773e+05 1.208060e+05 1.129694e+05 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1.597316e+05 1.163578e+05 8.114916e+06 6.115989e+06 5.555697e+06 5.891335e+06 4.273762e+06 7.847302e+06 6.427050e+06 6.389795e+06 4.744977e+06 8.608482e+06 7.568947e+06 5.080608e+06 3.915746e+06 7.347777e+06 3.651439e+06 5.879132e+06 7.427846e+06 6.932720e+06 7.041996e+06 4.625827e+06 9.172959e+06 7.260188e+06 1.107100e+05 8.732357e+06 5.426047e+06 4.402148e+06 6.788855e+06 8.575480e+06 8.301113e+06 6.808806e+06 7.497312e+06 6.520236e+06 6.856755e+06 7.852304e+06 5.497142e+06 5.614446e+06 6.841269e+06 8.787668e+06 5.124516e+06 7.118825e+06 6.954962e+06 7.908236e+06 7.054214e+06 5.961738e+06 6.474269e+06 6.080252e+06 8.406972e+06 8.387834e+06 5.243762e+06 6.509680e+06 6.461696e+06 7.506299e+06 7.417686e+06 6.774813e+06 5.064757e+06 5.692188e+06 7.925775e+06 7.833136e+06 7.227528e+06 1.983164e+05 1.381833e+05 1.618595e+05 1.143825e+05 1.827474e+05 1.516900e+05 1.943688e+05 1.499286e+05 1.577118e+05 1.234586e+05 1.144053e+05 1.554893e+05 1.444102e+05 1.554067e+05 2.131932e+05 1.877684e+05 1.230418e+05 2.062822e+05 1.990709e+05 1.191280e+05 1.101768e+05 1.093960e+05 1.282359e+05 C4 H12 N2 O10_7.074 5.805982e+06 7.823728e+05 5.633237e+05 6.962814e+05 3.113727e+05 8.400470e+05 7.443257e+05 6.342612e+05 205065.39 1.151870e+06 5.437848e+05 9.089362e+05 220810.35 7.156617e+05 8.803641e+05 6.293446e+05 1.885954e+05 7.958643e+05 6.166274e+05 6.085624e+05 1.819882e+05 8.050914e+05 9.128642e+05 6.097391e+05 27288.543 9.966885e+05 6.879851e+05 6.961503e+05 2.066554e+04 8.632057e+05 6.920081e+05 7.608488e+05 136842.69 7.543386e+05 8.026022e+05 7.222158e+05 1.398073e+05 7.722797e+05 7.126593e+05 8.782249e+05 1.354590e+05 6.008038e+05 8.981234e+05 6.415426e+05 1.388732e+05 8.346672e+05 7.182668e+05 7.811364e+05 1.863682e+06 1.760879e+06 1.902620e+06 2.776257e+06 1.900357e+06 1.573642e+06 2.620599e+06 2.069770e+06 3.726657e+06 3.371060e+06 2.759646e+06 4.342659e+06 2.302590e+06 2.153720e+06 2.327457e+06 3.788585e+06 4.300554e+06 1.259389e+06 1.302187e+06 2.258087e+06 2.093337e+06 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1.261097e+06 1.252926e+06 1.736162e+06 7.580773e+05 1.872401e+06 2.124305e+06 1.782562e+06 2.324889e+06 2.028099e+06 2.991084e+06 1.381098e+06 2.780866e+06 2.760004e+06 1.542154e+06 1.399251e+06 2.782641e+06 2.172784e+06 1.694232e+06 1.620193e+06 2.692861e+06 1.641257e+06 1.906174e+06 1.211864e+06 2.364324e+06 1.531366e+06 2.561480e+06 1.380751e+06 2.519482e+06 1.470526e+06 1.615077e+06 1.787303e+06 1.944599e+06 1.856664e+06 1.256903e+06 1.873690e+05 7.325600e+05 1.720308e+05 3.056935e+05 1.948955e+05 1.694828e+05 3.429857e+05 1.229222e+05 2.921702e+05 3.082916e+05 1.798281e+05 1.604127e+05 6.188327e+06 5.961770e+05 1.706227e+05 1.379978e+05 2.184916e+05 2.728227e+05 2.582268e+05 2.694316e+05 3.830056e+05 2.034197e+05 9.011879e+05 2.879046e+05 1.807739e+05 1.891248e+05 3.303764e+05 2.094391e+05 2.699460e+05 1.947314e+05 4.248643e+05 2.538032e+05 2.222261e+05 2.571664e+05 1.207401e+05 1.969021e+05 1.654833e+05 2.364740e+05 1.241573e+05 3.495903e+05 2.332322e+05 2.252346e+05 1.337350e+05 1.573691e+05 1.745081e+05 1.293447e+05 4.627862e+05 1.857239e+05 1.569750e+05 4.782717e+05 1.983922e+05 1.905554e+05 2.556684e+05 3.340233e+05 1.683894e+05 1.325059e+05 3.975677e+05 3.965320e+05 4.267312e+05 2.358091e+06 1.892065e+06 3.381847e+06 1.982096e+06 2.548888e+06 2.429055e+06 1.332431e+06 1.883460e+06 1.991348e+06 1.802889e+06 2.216320e+06 3.549892e+06 1.957739e+06 1.778418e+06 3.616644e+06 2.914873e+06 1.994117e+06 2.367589e+06 1.064215e+06 1.627468e+06 1.449672e+06 1.573064e+06 2.035839e+06 C H4 N8 O5_7.075 2.375067e+06 3.664095e+06 4.251912e+06 5.191440e+06 2.072576e+05 5.294651e+06 3.990333e+06 4.784886e+06 167977.69 6.548943e+06 2.641173e+06 5.885296e+06 194861.61 3.712165e+06 6.313589e+06 3.011059e+06 1.642757e+05 5.211160e+06 4.431719e+06 4.355710e+06 2.122325e+05 3.173687e+06 6.855283e+06 4.995224e+06 26984.171 4.333356e+06 3.265516e+06 5.299583e+06 2.062178e+04 5.059929e+06 4.780903e+06 4.027242e+06 133721.74 4.254645e+06 5.393915e+06 4.490205e+06 1.325674e+05 4.753592e+06 4.549840e+06 5.250183e+06 1.297688e+05 4.022345e+06 4.663396e+06 4.892764e+06 1.292577e+05 4.622082e+06 3.325086e+06 5.646778e+06 1.380970e+06 9.245821e+05 1.769289e+06 2.194292e+06 1.190802e+06 1.336245e+06 1.774432e+06 2.393805e+06 5.613386e+06 5.580551e+06 4.121939e+06 2.902700e+06 1.691088e+06 2.513928e+06 1.448158e+06 2.486537e+06 3.223773e+06 1.482158e+06 9.994346e+05 1.588652e+06 1.228209e+06 1.622437e+06 2.262094e+06 1.594502e+06 1.616804e+06 1.260939e+06 2.390917e+06 7.930642e+05 2.031732e+06 1.635951e+06 1.331395e+06 1.183790e+06 9.432791e+05 9.981009e+05 1.006685e+06 1.658735e+06 1.019724e+06 1.032104e+06 7.154892e+05 3.937889e+05 1.154141e+06 9.957644e+05 9.261202e+05 6.881605e+05 1.848190e+06 7.816294e+05 1.001049e+06 1.726923e+06 1.196306e+06 1.238324e+06 1.626531e+06 1.121045e+06 1.029870e+06 1.204726e+06 9.506296e+05 2.221274e+06 9.941680e+05 1.192311e+06 1.311566e+06 1.191477e+06 9.924888e+05 1.171263e+06 6.891697e+05 1.102204e+06 1.881574e+06 1.068658e+06 6.516636e+05 6.610985e+05 1.269129e+06 1.014519e+06 2.236624e+06 1.243261e+06 8.237865e+05 1.467245e+06 5.946570e+05 1.422148e+06 1.562632e+06 1.436377e+06 1.472373e+06 8.336352e+05 7.054655e+05 1.058943e+06 1.596505e+06 1.314994e+06 7.900454e+05 4.761045e+05 8.742313e+05 1.557743e+06 1.497163e+06 7.624935e+05 1.328804e+06 1.631591e+06 9.356946e+05 2.955709e+06 8.052279e+05 9.438753e+05 9.173962e+05 1.469859e+06 1.317400e+06 9.394050e+05 1.198837e+06 4.911148e+05 1.170532e+06 1.541409e+06 1.096344e+06 1.846520e+06 1.370603e+06 1.566507e+06 9.959021e+05 1.312389e+06 1.863595e+06 9.583669e+05 8.815897e+05 1.790609e+06 1.510454e+06 1.276536e+06 1.277692e+06 1.244937e+06 1.201922e+06 1.228501e+06 1.020915e+06 1.659437e+06 9.898108e+05 1.657483e+06 9.703907e+05 1.781470e+06 1.005287e+06 7.364989e+05 1.330192e+06 1.412527e+06 1.149515e+06 7.988938e+05 1.921023e+06 5.549447e+06 2.343657e+06 1.741931e+06 2.711214e+06 3.411228e+06 2.788390e+06 1.578690e+06 1.822372e+06 4.030179e+06 3.206044e+06 1.865304e+06 3.707206e+07 4.870508e+06 1.312680e+06 2.008520e+06 3.017952e+06 3.256902e+06 3.007756e+06 2.279420e+06 4.521722e+06 2.085941e+06 6.777470e+05 3.687359e+06 2.630567e+06 1.911246e+06 2.787236e+06 2.313254e+06 3.215399e+06 2.488985e+06 2.503815e+06 3.806841e+06 2.047802e+06 3.299989e+06 1.742318e+06 1.880246e+06 2.395999e+06 2.582658e+06 1.741276e+06 2.958330e+06 1.764769e+06 3.264649e+06 2.483643e+06 2.142477e+06 3.089695e+06 1.978704e+06 3.307156e+06 1.790484e+06 1.777053e+06 3.130647e+06 2.143243e+06 2.228212e+06 3.478196e+06 2.658437e+06 2.436149e+06 1.733073e+06 3.655430e+06 3.308049e+06 2.821568e+06 1.270685e+06 2.260791e+06 1.560356e+06 1.523662e+06 1.329317e+06 1.524764e+06 9.480670e+05 1.469464e+06 1.514045e+06 1.405862e+06 1.180517e+06 2.333976e+06 1.749633e+06 9.509334e+05 3.071488e+06 1.600643e+06 1.230289e+06 1.219154e+06 1.038899e+06 9.933981e+05 1.005684e+06 1.161699e+06 1.231166e+06 C7 H4 N2 O3 S_7.075 2.028987e+07 1.199714e+07 1.053508e+07 9.222292e+06 3.649474e+05 1.406540e+07 1.107320e+07 3.751451e+06 733919.27 1.313797e+07 1.182626e+07 1.439106e+07 651643.70 8.874465e+06 1.333794e+07 9.512389e+06 2.150063e+05 1.139103e+07 1.025343e+07 8.933042e+06 2.175857e+05 1.099010e+07 1.132406e+07 1.338454e+07 33311.657 1.109545e+07 1.026922e+07 9.765884e+06 2.583272e+04 1.124008e+07 1.057925e+07 1.076570e+07 165940.15 1.166906e+07 1.190935e+07 1.021561e+07 3.426250e+05 1.165915e+07 9.862806e+06 1.290942e+07 6.000001e+05 8.454578e+06 9.130511e+06 1.323278e+07 5.914971e+05 1.274164e+07 9.572832e+06 1.078275e+07 1.261309e+07 7.795931e+06 2.143744e+07 1.503606e+07 1.091229e+07 1.002791e+07 1.373387e+07 1.942109e+07 1.491006e+07 1.567461e+07 1.375097e+07 1.679253e+07 9.152539e+06 1.153268e+07 1.167267e+07 1.758215e+07 2.048743e+07 1.149584e+07 7.533833e+06 1.178730e+07 2.992681e+06 3.935827e+06 2.098937e+07 1.000124e+07 1.420890e+07 9.595290e+06 1.161008e+07 7.200888e+06 1.443461e+07 1.111648e+07 1.227158e+07 1.149656e+07 9.722179e+06 8.261494e+06 9.355843e+06 9.214053e+06 9.728523e+06 8.784625e+06 7.110679e+06 1.121752e+06 9.642029e+06 8.298001e+06 3.031714e+06 1.030961e+07 1.164471e+07 1.110638e+07 9.342412e+06 1.251116e+07 8.748816e+06 1.089737e+07 1.077988e+07 9.839817e+06 2.078994e+06 9.177815e+06 9.156773e+06 1.240539e+07 8.926520e+06 9.515065e+06 1.067206e+07 1.053286e+07 7.643052e+06 9.501682e+06 7.961003e+06 8.614023e+06 1.209766e+07 1.139092e+07 5.188758e+06 1.196373e+07 8.922091e+06 1.064996e+07 9.357880e+06 1.015212e+07 7.939836e+06 1.266838e+07 7.683083e+06 9.475471e+06 1.151953e+07 1.029770e+07 1.995983e+07 9.791673e+06 8.651438e+06 9.444766e+06 1.055615e+07 1.149359e+07 9.368142e+06 5.418378e+06 7.662669e+06 2.531576e+06 1.451669e+07 8.135994e+06 9.020955e+06 1.086329e+07 1.118739e+07 1.175409e+07 8.057140e+06 8.579018e+06 1.342048e+07 1.129357e+07 1.063524e+07 8.065661e+06 1.089044e+07 5.932323e+06 1.110977e+06 1.144498e+07 8.910300e+06 1.270967e+07 1.041906e+07 1.815883e+07 8.863921e+06 1.700120e+07 1.229195e+07 2.544491e+06 8.184306e+06 1.280414e+07 1.280252e+07 1.466567e+07 1.050256e+07 1.705602e+07 9.952767e+06 1.136363e+07 1.153989e+07 1.249515e+07 1.041555e+07 1.085604e+07 1.045190e+07 1.087894e+07 1.162389e+07 9.835446e+06 9.251891e+06 1.170623e+07 9.535171e+06 2.159688e+06 7.239198e+06 1.125627e+07 6.861353e+06 1.027711e+07 9.083575e+06 1.169440e+07 5.016523e+06 9.811160e+06 7.349424e+06 9.086255e+06 1.139371e+07 7.694156e+06 1.987293e+07 8.775000e+06 5.573885e+06 7.813827e+06 8.797469e+06 7.231994e+06 7.329476e+06 4.846140e+06 9.640804e+06 6.200375e+06 7.219768e+06 1.587388e+07 1.160144e+07 9.555544e+06 1.428137e+07 4.517688e+06 5.516091e+06 9.188303e+06 9.811553e+06 2.632411e+06 6.916344e+06 7.247888e+06 8.147305e+06 1.087905e+07 8.071937e+06 1.116458e+07 5.050191e+06 1.084832e+07 1.115036e+07 1.012386e+07 9.048779e+06 6.322632e+06 1.568374e+06 5.561235e+06 9.581689e+06 6.195015e+06 5.404068e+06 9.853645e+06 6.143735e+06 8.933910e+06 1.003707e+07 7.810103e+06 5.643373e+06 8.364943e+06 1.106201e+07 7.895790e+06 1.521368e+07 1.172897e+07 1.006939e+07 1.584422e+07 1.076796e+07 1.786836e+07 1.138907e+07 1.108652e+07 9.965411e+06 1.021364e+07 9.136572e+06 1.015170e+07 1.733702e+07 9.862663e+06 1.272210e+07 2.094877e+07 1.603220e+07 8.599079e+06 1.823285e+07 7.989018e+06 8.704059e+06 8.971839e+06 1.022369e+07 6.500138e+06 C6 H6 O3_7.075 3.589836e+06 1.228037e+06 1.215803e+06 1.304950e+06 3.012551e+05 1.424468e+06 1.132141e+06 1.224309e+06 238221.45 1.535057e+06 1.166341e+06 1.573971e+06 253758.77 1.099182e+06 1.448139e+06 1.133853e+06 2.120935e+05 1.411558e+06 1.137007e+06 1.117128e+06 2.328536e+05 1.428270e+06 1.410392e+06 1.045508e+06 44949.809 1.523326e+06 1.353526e+06 1.118198e+06 4.483288e+04 1.250795e+06 1.387324e+06 1.386146e+06 171467.00 1.265795e+06 1.278582e+06 1.260834e+06 1.787712e+05 1.427099e+06 1.237616e+06 1.404424e+06 1.819485e+05 1.043781e+06 1.290670e+06 1.304087e+06 1.689799e+05 1.278022e+06 1.267525e+06 1.361025e+06 1.959657e+06 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2.758390e+06 1.324354e+06 1.972566e+06 1.622724e+06 2.495428e+06 2.079064e+06 1.326693e+06 9.370066e+05 1.499192e+06 1.928214e+06 1.421173e+06 1.602153e+06 2.091902e+06 1.949945e+06 1.938527e+06 2.552756e+06 1.328478e+06 1.608720e+06 2.053909e+06 2.365552e+06 1.747406e+06 1.598926e+06 1.558346e+06 1.129791e+06 1.910888e+06 2.204777e+06 1.987144e+06 2.524055e+06 2.116437e+06 2.908534e+06 1.584524e+06 2.518308e+06 2.680595e+06 1.663259e+06 1.631863e+06 2.573934e+06 2.247134e+06 1.986085e+06 2.173843e+06 2.180508e+06 2.318029e+06 1.905423e+06 1.717241e+06 2.435575e+06 1.505299e+06 2.627797e+06 1.661399e+06 2.462673e+06 1.464289e+06 1.588948e+06 1.848381e+06 2.213160e+06 1.678355e+06 1.372028e+06 4.567014e+05 1.128513e+06 6.628707e+05 8.587668e+05 7.469624e+05 7.240625e+05 1.552936e+06 5.056356e+05 4.500003e+05 9.234939e+05 6.534669e+05 7.170852e+05 5.861651e+06 9.200555e+05 4.720790e+05 4.443232e+05 6.109657e+05 7.703373e+05 5.014032e+05 6.361156e+05 9.068210e+05 9.444000e+05 1.247720e+06 9.042558e+05 7.570004e+05 6.625800e+05 8.266286e+05 6.395619e+05 8.426515e+05 8.223287e+05 7.471014e+05 6.676374e+05 7.701125e+05 9.039635e+05 4.071298e+05 6.307780e+05 6.434672e+05 7.280429e+05 4.538310e+05 7.632310e+05 6.360007e+05 6.602461e+05 5.347929e+05 4.235819e+05 6.110287e+05 4.946486e+05 9.998039e+05 3.490664e+05 4.286374e+05 1.075854e+06 6.711966e+05 8.343432e+05 6.347836e+05 7.845549e+05 6.175913e+05 7.256176e+05 7.897222e+05 1.218943e+06 7.563797e+05 1.921824e+06 2.572048e+06 2.349581e+06 2.271666e+06 2.922267e+06 2.294577e+06 1.896761e+06 1.878592e+06 2.112760e+06 1.760719e+06 1.882449e+06 3.385704e+06 2.198247e+06 1.742501e+06 3.031442e+06 2.463201e+06 1.938622e+06 2.777213e+06 1.453593e+06 1.705405e+06 1.793289e+06 1.955440e+06 1.722060e+06 C8 H17 N8 O8 P S_7.076 2.693309e+06 4.750969e+06 4.306697e+06 5.502998e+06 2.313255e+05 5.569392e+06 4.968091e+06 4.714237e+06 174683.55 6.452564e+06 4.176111e+06 7.040902e+06 198726.04 4.326634e+06 5.776104e+06 3.509742e+06 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2.325971e+06 2.221686e+06 2.499962e+06 1.854874e+06 2.768836e+06 2.514384e+06 2.739054e+06 2.266349e+06 1.973260e+06 2.299548e+06 2.543346e+06 3.307496e+06 2.108659e+06 2.159037e+06 3.804100e+06 2.684506e+06 2.554361e+06 2.701921e+06 2.546774e+06 2.485510e+06 2.631612e+06 3.670349e+06 3.384856e+06 2.237758e+06 1.994552e+06 2.136099e+06 2.267545e+06 2.525387e+06 2.239596e+06 2.234354e+06 1.843319e+06 2.096508e+06 2.094149e+06 2.269899e+06 2.136920e+06 3.012152e+06 2.199614e+06 1.813583e+06 3.039034e+06 2.553736e+06 2.034349e+06 2.486028e+06 1.626756e+06 1.739476e+06 1.988065e+06 2.048167e+06 1.939177e+06 C3 H8 N10 O7_7.077 1.239186e+07 1.103659e+06 1.426660e+06 1.206760e+06 3.450874e+05 1.186105e+06 1.154550e+06 1.281191e+06 204026.83 1.375746e+06 1.371844e+06 1.452287e+06 211207.38 1.100117e+06 1.468473e+06 1.049631e+06 1.739127e+05 1.263224e+06 1.098674e+06 1.198698e+06 1.629976e+05 1.358197e+06 1.433207e+06 1.193483e+06 26034.999 1.209127e+06 1.275358e+06 1.132052e+06 1.836922e+04 1.525669e+06 1.277942e+06 1.214768e+06 122727.52 1.337135e+06 1.300603e+06 1.222562e+06 1.337108e+05 1.134631e+06 1.180101e+06 1.537572e+06 1.230163e+05 1.035050e+06 1.272732e+06 1.502125e+06 1.165050e+05 1.180295e+06 1.108519e+06 1.359639e+06 3.298594e+06 4.327661e+06 4.111353e+06 7.464262e+06 3.867797e+06 3.392150e+06 6.945346e+06 4.678956e+06 1.131891e+07 9.572255e+06 7.808518e+06 1.354306e+07 6.716537e+06 4.667303e+06 6.945368e+06 9.259326e+06 1.213352e+07 2.140355e+06 2.851157e+06 5.427909e+06 3.663094e+06 4.415845e+06 1.009226e+07 6.742827e+06 5.386981e+06 3.617783e+06 5.935360e+06 2.198478e+06 6.697384e+06 5.609372e+06 5.304628e+06 3.085628e+06 3.675976e+06 2.843896e+06 2.868743e+06 3.537026e+06 3.337539e+06 2.912536e+06 1.478896e+06 1.369193e+06 3.204044e+06 3.024189e+06 2.885817e+06 2.792313e+06 5.582183e+06 3.968521e+06 3.531955e+06 6.687819e+06 3.407308e+06 3.925142e+06 4.738007e+06 5.195481e+06 2.555692e+06 2.952586e+06 3.097018e+06 6.219115e+06 3.826512e+06 2.948757e+06 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3.263587e+06 4.766037e+06 C13 H16 O12 S_7.077 6.923148e+06 1.018482e+06 6.256175e+05 8.837628e+05 3.675314e+05 7.497379e+05 7.422148e+05 6.620027e+05 211081.96 1.205820e+06 7.150009e+05 1.135133e+06 213198.84 6.764033e+05 9.097502e+05 7.048357e+05 1.734395e+05 9.407324e+05 6.462849e+05 6.607855e+05 1.656043e+05 1.062912e+06 9.820877e+05 6.953863e+05 27293.002 8.400584e+05 9.240909e+05 8.062888e+05 1.970594e+04 8.673100e+05 8.134874e+05 8.870232e+05 124604.51 7.205702e+05 9.619070e+05 9.052963e+05 1.300739e+05 8.862080e+05 7.487647e+05 8.296598e+05 1.311658e+05 6.668254e+05 9.402949e+05 9.073503e+05 1.166217e+05 7.349269e+05 8.302196e+05 8.913824e+05 1.857742e+06 1.503444e+06 2.345618e+06 3.947233e+06 1.995636e+06 1.690882e+06 3.187126e+06 2.184497e+06 4.275501e+06 3.887098e+06 3.136956e+06 5.261725e+06 2.181316e+06 2.057309e+06 2.645081e+06 4.437600e+06 4.742263e+06 1.196055e+06 1.264876e+06 2.400715e+06 1.769280e+06 2.175574e+06 4.316870e+06 2.625342e+06 2.194068e+06 1.949726e+06 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5.727646e+06 7.579321e+06 7.331035e+06 6.994882e+06 1.084029e+07 5.599920e+06 5.657039e+06 9.448107e+06 5.934777e+06 7.885672e+06 8.392052e+06 7.988685e+06 7.164497e+06 6.351698e+06 9.689397e+06 1.014968e+07 8.675940e+06 2.411520e+07 2.539667e+07 3.255256e+07 2.946586e+07 2.944099e+07 3.215575e+07 2.209041e+07 2.337908e+07 3.020762e+07 2.417592e+07 4.132649e+07 4.370660e+07 2.907005e+07 2.609020e+07 3.866150e+07 2.998744e+07 2.656187e+07 3.348356e+07 2.274149e+07 1.935871e+07 2.440255e+07 2.857956e+07 2.519143e+07 C6 H8 O4_7.079 1.070530e+07 3.062932e+06 3.137827e+06 3.579599e+06 5.903649e+05 3.135445e+06 3.127051e+06 2.972798e+06 456058.96 4.515324e+06 2.886552e+06 3.795264e+06 505548.88 2.866113e+06 3.709539e+06 2.697629e+06 4.174879e+05 3.502145e+06 2.958650e+06 3.380049e+06 4.152344e+05 3.512354e+06 3.575196e+06 2.824231e+06 76276.711 3.679911e+06 3.421550e+06 3.044615e+06 7.166805e+04 3.242362e+06 3.424426e+06 3.377861e+06 320560.40 3.065948e+06 3.058314e+06 4.486877e+06 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9.107790e+06 1.032818e+07 1.141496e+07 1.261178e+07 1.140902e+07 3.085693e+07 2.928402e+07 3.655683e+07 3.146925e+07 3.356975e+07 3.345273e+07 2.147551e+07 2.855383e+07 3.472126e+07 2.750262e+07 2.704570e+07 4.680961e+07 3.299795e+07 2.855257e+07 4.335580e+07 3.648236e+07 3.022733e+07 3.994476e+07 2.345459e+07 2.602797e+07 2.960380e+07 3.068005e+07 2.802288e+07 C30 H38 N4 O16 S2_7.079 6.441781e+06 5.182175e+05 3.369219e+05 4.322793e+05 2.469002e+05 5.111257e+05 3.926866e+05 6.027749e+05 141352.65 6.016758e+05 5.120810e+05 4.535101e+05 165024.46 3.933377e+05 6.421748e+05 3.456111e+05 1.262222e+05 4.733226e+05 4.236998e+05 4.077580e+05 1.306098e+05 4.850851e+05 6.590928e+05 4.584069e+05 20121.128 4.710723e+05 4.218154e+05 4.638216e+05 1.461968e+04 5.446834e+05 5.877022e+05 4.132797e+05 102873.45 4.934404e+05 5.237741e+05 3.153719e+05 1.134487e+05 5.343332e+05 4.341460e+05 5.155601e+05 9.602800e+04 4.158472e+05 6.520157e+05 4.951900e+05 9.426113e+04 4.813016e+05 3.384361e+05 5.574704e+05 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1.103521e+06 1.330553e+05 1.867145e+05 1.371064e+05 9.654922e+04 1.293088e+05 1.050514e+05 1.338254e+05 1.697761e+05 1.056445e+05 9.809931e+04 2.435427e+05 7.023524e+04 2.028220e+05 8.325480e+04 1.519383e+05 1.944259e+05 2.393739e+05 1.128445e+05 1.252077e+05 2.109746e+05 7.512186e+04 1.098066e+05 2.013943e+05 1.990939e+05 1.135620e+05 1.173862e+05 1.571199e+05 1.256973e+05 9.573144e+04 1.161011e+05 1.181669e+05 1.912118e+05 1.219828e+05 1.354717e+05 1.145797e+05 2.241768e+05 3.122991e+06 3.258648e+06 3.490323e+06 2.110261e+06 3.040442e+06 2.869157e+06 1.621034e+06 2.036906e+06 2.158360e+06 2.648082e+06 2.555320e+06 3.678375e+06 2.046230e+06 1.932054e+06 3.172199e+06 4.374043e+06 3.183824e+06 2.139626e+06 1.056100e+06 2.248067e+06 1.444767e+06 1.479635e+06 2.380384e+06 C11 H21 N4 O5 P3 S_7.08 1.079213e+07 9.477017e+05 8.195421e+05 8.022905e+05 3.794667e+05 1.205444e+06 1.010950e+06 9.583889e+05 204468.72 1.282174e+06 8.066454e+05 1.363132e+06 209879.16 8.057733e+05 1.203607e+06 8.428865e+05 1.750453e+05 9.857834e+05 7.987723e+05 7.833746e+05 1.656648e+05 1.244762e+06 1.318680e+06 8.645667e+05 27101.369 8.813436e+05 1.040767e+06 8.824149e+05 1.883749e+04 1.204538e+06 9.818781e+05 9.355706e+05 118873.55 1.037155e+06 1.151401e+06 1.120894e+06 1.631147e+05 1.058184e+06 7.793425e+05 1.030544e+06 1.416723e+05 6.045158e+05 1.190964e+06 1.100521e+06 1.203819e+05 1.095066e+06 8.183795e+05 1.110514e+06 2.404620e+06 2.464243e+06 3.035881e+06 5.589250e+06 3.149826e+06 2.111060e+06 3.840186e+06 2.321935e+06 6.293356e+06 5.926697e+06 4.254088e+06 7.811865e+06 2.968082e+06 2.429688e+06 3.718227e+06 5.847668e+06 6.946392e+06 1.604817e+06 1.873106e+06 3.865197e+06 2.592913e+06 2.981766e+06 6.880215e+06 3.338405e+06 3.043599e+06 3.015019e+06 3.580398e+06 1.624595e+06 4.446353e+06 3.728605e+06 3.354627e+06 2.526184e+06 2.713555e+06 2.056706e+06 2.414328e+06 2.293653e+06 2.486777e+06 1.952790e+06 9.801282e+05 9.168654e+05 4.211492e+06 2.202535e+06 1.683692e+06 2.037741e+06 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4.075004e+06 1.808786e+06 3.688050e+06 3.308932e+06 3.643191e+06 2.133422e+06 2.339313e+06 3.285146e+06 3.393329e+06 2.557914e+06 1.996686e+06 1.994668e+05 1.004879e+06 2.737216e+05 4.115936e+05 3.713781e+05 4.286795e+05 1.658253e+05 1.506864e+05 1.605131e+05 6.072044e+05 3.017770e+05 1.581207e+05 1.147523e+07 7.633599e+05 1.605035e+05 1.370005e+05 3.165712e+05 3.227343e+05 1.479543e+05 4.388496e+05 4.422183e+05 3.910165e+05 1.507939e+06 4.738707e+05 2.365338e+05 3.935853e+05 4.461062e+05 2.977009e+05 4.171985e+05 3.991954e+05 3.469085e+05 1.815081e+05 2.755393e+05 4.146855e+05 2.997225e+05 2.515223e+05 3.145285e+05 4.483072e+05 2.531981e+05 3.362740e+05 2.049893e+05 4.623633e+05 1.245248e+05 1.749632e+05 2.896527e+05 1.416379e+05 5.425925e+05 1.765056e+05 1.196968e+05 6.875621e+05 2.389922e+05 4.167163e+05 2.937056e+05 3.113417e+05 3.683459e+05 3.139191e+05 2.544340e+05 3.311384e+05 6.672882e+05 4.047471e+06 2.310760e+06 4.168128e+06 3.612151e+06 4.331030e+06 3.632677e+06 2.143403e+06 3.040118e+06 3.282066e+06 3.367668e+06 3.026709e+06 4.300336e+06 2.946361e+06 3.025020e+06 4.206958e+06 4.310327e+06 3.255467e+06 4.647297e+06 1.841030e+06 2.719948e+06 2.619213e+06 2.402872e+06 2.618906e+06 C3 H4 N6 O3 P2_7.08 2.987267e+06 7.411647e+05 5.137707e+05 6.806356e+05 2.566737e+05 6.446499e+05 6.681522e+05 6.027552e+05 187362.80 7.159524e+05 5.771566e+05 9.412218e+05 187549.26 5.523491e+05 5.644859e+05 5.700307e+05 1.505941e+05 9.088584e+05 3.074612e+05 5.862895e+05 1.563339e+05 7.999863e+05 9.228595e+05 3.153349e+05 25322.109 7.685767e+05 7.013787e+05 5.865654e+05 1.702176e+04 6.876004e+05 7.269336e+05 4.989210e+05 103570.67 7.356791e+05 7.417850e+05 6.384394e+05 1.150142e+05 7.578775e+05 5.203754e+05 8.765443e+05 1.207678e+05 5.983857e+05 5.385576e+05 6.368484e+05 9.463147e+04 5.393463e+05 4.733185e+05 8.651242e+05 8.940447e+05 9.303284e+05 1.549426e+06 2.060863e+06 1.425406e+06 1.252239e+06 2.023542e+06 1.032207e+06 2.646506e+06 1.745959e+06 1.680744e+06 2.416359e+06 1.450150e+06 7.465324e+05 1.972887e+06 1.880211e+06 2.926893e+06 9.504650e+05 1.018299e+06 1.122480e+06 1.216006e+06 1.290042e+06 2.639433e+06 1.680557e+06 8.773468e+05 1.730968e+06 1.530367e+06 1.103673e+06 2.192883e+06 1.977394e+06 1.221173e+06 1.130699e+06 1.349283e+06 7.617844e+05 9.927798e+05 1.378653e+06 1.357755e+06 9.526420e+05 7.130439e+05 5.860056e+05 1.275177e+06 1.112317e+06 9.715383e+05 1.192214e+06 1.919592e+06 9.425706e+05 1.270010e+06 2.014379e+06 1.406238e+06 1.394279e+06 1.660050e+06 1.563119e+06 9.341256e+05 1.259258e+06 1.317745e+06 1.808920e+06 1.196389e+06 1.182748e+06 1.344235e+06 1.320478e+06 1.147572e+06 1.447257e+06 8.218945e+05 1.508073e+06 1.794921e+06 1.253756e+06 7.273854e+05 1.410739e+06 1.640287e+06 9.276445e+05 8.334635e+05 1.254324e+06 1.217005e+06 1.686490e+06 6.851071e+05 1.286995e+06 1.181467e+06 1.309437e+06 2.563679e+06 6.475951e+05 1.395244e+06 1.421323e+06 1.221007e+06 1.498304e+06 5.796302e+05 6.834825e+05 1.100160e+06 1.579019e+06 1.066998e+06 9.605092e+05 1.329779e+06 1.285389e+06 1.410628e+06 1.350991e+06 1.133450e+06 1.232764e+06 2.175206e+06 1.380787e+06 1.104970e+06 8.739397e+05 1.037749e+06 5.691112e+05 1.441035e+06 1.399371e+06 1.456205e+06 1.511323e+06 1.573013e+06 2.348618e+06 1.261842e+06 2.102489e+06 2.082850e+06 1.548112e+06 9.929410e+05 1.523498e+06 2.023828e+06 8.939259e+05 1.221367e+06 1.329212e+06 1.032953e+06 1.255272e+06 8.012651e+05 1.543444e+06 1.309470e+06 1.659739e+06 1.294215e+06 1.683922e+06 7.767035e+05 9.655622e+05 1.163623e+06 1.307316e+06 1.397343e+06 1.298635e+06 1.432047e+05 2.977463e+05 1.986629e+05 4.022314e+05 2.449987e+05 2.599805e+05 3.563234e+05 6.912836e+04 1.794719e+05 4.784440e+05 1.823098e+05 1.496399e+05 2.915606e+06 2.319598e+05 1.233890e+05 1.108007e+05 1.177403e+05 1.585738e+05 2.427258e+05 1.784338e+05 2.580053e+05 1.778732e+05 7.918522e+05 3.082134e+05 1.807970e+05 3.919867e+05 2.592840e+05 1.729494e+05 1.644622e+05 2.988500e+05 2.812511e+05 2.658096e+05 1.453288e+05 1.687643e+05 1.141556e+05 1.799659e+05 1.993612e+05 1.173567e+05 2.390372e+05 1.986862e+05 2.136818e+05 3.190557e+05 1.097375e+05 9.337070e+04 2.586995e+05 2.224546e+05 2.969096e+05 1.631800e+05 1.363444e+05 3.721946e+05 2.348484e+05 1.037758e+05 2.394445e+05 2.474000e+05 1.463938e+05 1.451740e+05 2.039555e+05 3.577861e+05 4.568376e+05 1.400960e+06 1.359297e+06 1.522533e+06 1.643097e+06 1.209485e+06 1.533396e+06 9.744695e+05 1.791075e+06 1.524257e+06 1.590665e+06 1.788161e+06 2.526175e+06 1.396826e+06 1.759244e+06 2.078708e+06 2.017021e+06 1.576487e+06 2.230962e+06 1.055354e+06 1.629600e+06 1.389361e+06 1.410663e+06 1.277629e+06 D-(+)-Glucose (M+NH4)_7.08 4.648646e+07 5.667930e+06 4.904441e+06 5.469058e+06 5.591770e+05 4.993764e+06 4.184888e+06 5.432302e+06 383639.03 7.635657e+06 2.616742e+06 6.979882e+06 393786.01 5.120607e+06 5.805897e+06 5.145004e+06 2.666175e+05 5.329499e+06 4.220469e+06 3.003251e+06 2.811147e+05 7.618639e+06 6.441643e+06 2.803613e+06 43751.384 7.506303e+06 3.756134e+06 5.173159e+06 2.905016e+04 6.814209e+06 5.672230e+06 3.276368e+06 177419.60 5.588038e+06 5.462607e+06 5.627835e+06 1.822133e+05 7.162254e+06 5.958729e+06 3.823088e+06 2.282789e+05 3.322927e+06 4.154934e+06 4.389619e+06 2.205066e+05 8.121827e+06 5.341091e+06 5.001974e+06 1.106840e+07 1.134933e+07 8.738507e+06 1.511723e+07 1.214819e+07 1.009824e+07 9.988434e+06 3.234102e+06 2.213697e+07 1.715494e+07 7.274942e+06 2.744572e+07 7.373210e+06 6.010002e+06 7.122035e+06 2.302086e+07 2.313851e+07 1.180056e+07 5.036652e+06 1.749007e+07 5.720428e+06 1.515092e+07 2.052850e+07 8.061497e+06 1.604495e+07 9.611528e+06 6.721405e+06 8.872764e+06 1.130343e+07 1.509530e+07 5.746939e+06 1.001306e+07 8.504294e+06 5.440291e+06 1.290962e+07 9.817956e+06 1.311411e+07 9.382613e+06 8.671754e+06 3.867330e+06 6.990687e+06 1.104501e+07 6.471388e+06 5.236408e+06 1.772974e+07 4.027002e+06 1.071593e+07 1.397953e+07 7.880212e+06 1.486005e+07 1.667092e+07 7.857901e+06 6.710852e+06 6.903644e+06 8.306919e+06 1.851752e+07 7.557756e+06 1.071160e+07 1.048195e+07 9.794485e+06 1.168895e+07 4.623874e+06 5.204415e+06 1.301802e+07 1.294840e+07 8.767458e+06 4.980476e+06 6.963538e+06 5.354961e+06 6.499517e+06 8.342964e+06 9.023392e+06 1.013254e+07 1.779585e+07 8.461155e+06 1.080213e+07 2.136038e+07 1.633794e+07 1.875306e+07 1.401653e+07 4.949591e+06 5.081680e+06 9.538897e+06 1.101988e+07 9.616912e+06 3.102903e+06 7.841572e+06 8.602270e+06 1.437546e+07 9.038415e+06 9.763049e+06 1.131268e+07 1.483581e+07 1.065039e+07 4.602325e+06 6.227626e+06 9.299223e+06 1.564013e+07 8.848389e+06 8.046402e+06 9.103418e+06 5.885507e+06 9.599787e+06 1.549823e+07 9.067014e+06 1.011325e+07 1.338130e+07 1.449982e+07 8.734471e+06 1.792204e+07 1.752166e+07 1.078404e+07 8.017170e+06 7.026005e+06 1.620445e+07 8.636377e+06 1.408591e+07 1.263942e+07 1.325012e+07 1.560839e+07 1.642176e+07 1.618444e+07 6.120396e+06 1.719364e+07 6.223980e+06 1.695995e+07 1.360273e+07 1.007634e+07 6.439626e+06 1.669443e+07 6.909609e+06 7.616743e+06 1.471539e+06 4.318729e+06 2.351122e+06 2.767377e+06 1.850770e+06 4.028128e+06 4.202884e+06 1.245755e+06 1.278974e+06 5.359897e+06 2.424481e+06 8.907873e+05 3.089276e+07 4.154555e+06 9.545953e+05 9.303154e+05 1.200842e+06 2.149358e+06 1.634211e+06 2.501131e+06 4.073112e+06 3.153069e+06 6.568607e+06 2.771141e+06 2.043280e+06 2.098386e+06 3.104064e+06 2.781038e+06 2.574538e+06 2.963653e+06 2.983782e+06 1.782044e+06 2.776098e+06 3.508664e+06 2.145064e+06 2.284380e+06 3.247054e+06 4.552201e+06 8.224658e+05 1.313096e+06 1.828372e+06 1.436435e+06 1.428999e+06 2.075463e+06 2.208796e+06 1.928415e+06 5.027569e+06 1.389045e+06 1.799730e+06 5.046640e+06 1.319560e+06 4.248633e+06 2.452179e+06 2.125222e+06 9.692365e+05 1.513949e+06 1.831342e+06 1.678706e+06 5.221220e+06 1.382194e+07 4.410562e+06 2.738201e+07 1.578411e+07 1.365934e+07 1.324752e+07 8.647234e+06 6.021284e+06 1.442306e+07 9.347610e+06 9.477313e+06 2.094393e+07 8.651080e+06 9.590573e+06 1.190887e+07 1.757355e+07 9.397676e+06 1.993930e+07 9.584305e+06 8.268038e+06 1.556011e+07 8.647078e+06 6.293053e+06 C13 H9 N4 O4 P_7.08 4.071709e+07 1.725635e+07 1.131208e+07 1.831854e+07 3.146355e+05 1.434016e+07 1.525052e+07 1.389925e+07 266390.96 2.078222e+07 1.172137e+07 1.786072e+07 291390.20 1.364752e+07 1.761687e+07 1.351996e+07 2.362242e+05 1.864485e+07 1.385141e+07 1.248555e+07 2.599360e+05 1.726064e+07 1.724955e+07 1.301923e+07 53122.295 1.647502e+07 1.573450e+07 1.610763e+07 2.966009e+04 1.545750e+07 1.556743e+07 1.540185e+07 187763.02 1.595636e+07 1.632179e+07 1.594739e+07 2.006234e+05 1.692095e+07 1.384653e+07 1.725929e+07 2.042017e+05 1.286804e+07 1.669141e+07 1.515678e+07 1.649140e+05 1.311383e+07 1.340449e+07 1.867736e+07 1.918853e+07 2.221134e+07 3.461025e+07 3.815893e+07 2.613291e+07 2.509123e+07 3.234598e+07 2.052447e+07 4.015735e+07 4.278144e+07 3.548311e+07 4.527084e+07 2.549308e+07 2.201418e+07 2.737869e+07 4.781351e+07 4.725407e+07 1.683146e+07 2.108358e+07 3.774995e+07 2.260926e+07 2.821586e+07 3.796731e+07 2.438004e+07 1.854399e+07 3.150709e+07 3.197886e+07 2.066050e+07 3.812127e+07 3.125395e+07 3.130533e+07 3.060203e+07 2.512699e+07 1.957446e+07 2.762423e+07 2.008326e+07 2.770891e+07 1.726936e+07 1.618452e+07 1.463280e+07 1.838979e+07 2.227473e+07 2.024362e+07 2.202061e+07 3.191025e+07 2.082646e+07 2.406249e+07 3.663354e+07 2.649284e+07 3.045449e+07 3.076078e+07 2.683593e+07 1.952310e+07 2.945211e+07 2.663278e+07 3.076119e+07 1.736996e+07 2.380178e+07 2.917219e+07 2.953771e+07 2.547203e+07 2.392083e+07 1.956750e+07 2.587860e+07 3.343605e+07 2.572214e+07 2.040089e+07 2.153927e+07 3.071902e+07 2.497815e+07 2.556858e+07 3.082679e+07 2.493580e+07 2.807145e+07 1.467161e+07 2.756943e+07 2.762915e+07 3.133860e+07 3.707706e+07 1.632614e+07 2.272153e+07 2.627508e+07 3.485154e+07 2.880688e+07 1.494939e+07 1.294147e+07 1.967386e+07 2.873269e+07 2.145759e+07 2.244541e+07 2.690246e+07 3.162475e+07 2.816495e+07 2.900490e+07 2.170541e+07 2.146182e+07 2.456152e+07 2.829677e+07 2.623274e+07 2.099438e+07 1.880928e+07 1.657576e+07 2.481798e+07 2.730754e+07 2.949269e+07 3.112410e+07 3.179109e+07 3.876321e+07 2.420466e+07 3.597989e+07 3.154140e+07 2.598188e+07 1.800441e+07 3.236594e+07 3.238138e+07 2.156511e+07 2.659131e+07 2.765402e+07 3.027024e+07 2.708418e+07 2.540726e+07 3.321226e+07 2.249012e+07 3.212433e+07 2.804029e+07 2.940461e+07 1.594596e+07 2.626887e+07 1.729107e+07 3.128211e+07 2.738661e+07 1.945714e+07 6.389504e+06 1.160274e+07 6.467589e+06 8.594815e+06 7.611242e+06 8.247659e+06 8.902004e+06 4.682607e+06 4.365652e+06 1.017751e+07 7.273063e+06 4.067720e+06 4.340947e+07 1.217231e+07 4.733246e+06 5.111257e+06 7.040081e+06 8.586018e+06 7.125380e+06 9.356817e+06 1.080841e+07 7.097244e+06 1.744583e+07 1.119612e+07 7.661738e+06 8.394914e+06 9.202963e+06 8.075349e+06 8.017935e+06 6.155307e+06 1.021881e+07 8.401568e+06 7.678233e+06 7.942988e+06 3.645179e+06 6.447121e+06 7.059834e+06 8.614376e+06 6.106431e+06 8.495715e+06 7.975700e+06 1.087268e+07 6.153590e+06 5.243059e+06 8.004055e+06 4.900551e+06 1.087554e+07 5.765706e+06 5.839247e+06 9.381808e+06 7.269990e+06 7.549694e+06 8.602249e+06 8.892765e+06 6.327237e+06 6.649520e+06 9.249110e+06 9.684940e+06 9.116948e+06 2.524990e+07 3.095252e+07 3.468889e+07 2.907893e+07 4.566786e+07 2.953190e+07 2.002676e+07 2.353119e+07 2.686186e+07 2.375909e+07 2.449484e+07 4.115458e+07 3.100315e+07 3.057388e+07 4.165606e+07 3.379867e+07 2.480000e+07 3.685178e+07 1.955662e+07 2.311869e+07 2.289562e+07 2.920985e+07 2.376325e+07 C11 H15 N7 O7 P2_7.08 2.269074e+07 4.214252e+06 3.031748e+06 2.996974e+06 3.428608e+05 2.880779e+06 3.666341e+06 3.775771e+06 209161.00 4.622630e+06 2.864236e+06 4.364156e+06 230486.69 2.655934e+06 4.311301e+06 3.025043e+06 1.925404e+05 3.883838e+06 2.672380e+06 2.784810e+06 1.807065e+05 3.926957e+06 4.611638e+06 2.999424e+06 28200.017 3.604563e+06 3.796818e+06 3.408040e+06 2.022370e+04 3.497619e+06 3.676765e+06 3.455667e+06 128793.24 3.493880e+06 3.724148e+06 3.627144e+06 1.354955e+05 3.892235e+06 3.199731e+06 3.613648e+06 1.346772e+05 2.656426e+06 3.945583e+06 3.854609e+06 1.236116e+05 3.525129e+06 3.210422e+06 3.770719e+06 7.470155e+06 6.564935e+06 8.517334e+06 1.472285e+07 6.187010e+06 7.489316e+06 1.286433e+07 8.320805e+06 1.759409e+07 1.368755e+07 1.334914e+07 1.984341e+07 9.498476e+06 8.601342e+06 1.067786e+07 1.665852e+07 1.896667e+07 4.901177e+06 5.835879e+06 1.026100e+07 7.993282e+06 8.697630e+06 1.433232e+07 1.021653e+07 1.008863e+07 8.051623e+06 1.062323e+07 5.210304e+06 1.354390e+07 1.005577e+07 9.850847e+06 7.011117e+06 6.679751e+06 2.867794e+06 5.898655e+06 5.688306e+06 7.571503e+06 6.580585e+06 3.726133e+06 2.258864e+06 7.324535e+06 6.700628e+06 5.183369e+06 4.780101e+06 1.039533e+07 4.018229e+06 6.585901e+06 1.298446e+07 7.098209e+06 7.567568e+06 1.090701e+07 8.938172e+06 4.371586e+06 7.189519e+06 6.907441e+06 1.152584e+07 6.696386e+06 6.454748e+06 8.105184e+06 7.399410e+06 5.943044e+06 6.813967e+06 4.515428e+06 6.081583e+06 1.154197e+07 6.768629e+06 4.089767e+06 6.528760e+06 7.603458e+06 6.389865e+06 6.728496e+06 7.127468e+06 5.314403e+06 9.458003e+06 3.610451e+06 8.137573e+06 9.047021e+06 7.884403e+06 1.257893e+07 4.751896e+06 4.294935e+06 6.585708e+06 9.922586e+06 9.244703e+06 4.108946e+06 2.613333e+06 6.682723e+06 7.543246e+06 7.945762e+06 4.310362e+06 7.405316e+06 8.158405e+06 7.016166e+06 1.040131e+07 5.670090e+06 4.893057e+06 6.626802e+06 9.198166e+06 6.420341e+06 5.940901e+06 7.018476e+06 3.043949e+06 5.445169e+06 9.724093e+06 7.443420e+06 1.057065e+07 9.401725e+06 1.284225e+07 6.069303e+06 1.115578e+07 1.161567e+07 7.174213e+06 5.566627e+06 1.279743e+07 9.051515e+06 7.479915e+06 8.499011e+06 1.077842e+07 8.396622e+06 8.116519e+06 6.932184e+06 1.003970e+07 5.585442e+06 1.176421e+07 6.593556e+06 9.952638e+06 5.798685e+06 5.578201e+06 7.084045e+06 9.210524e+06 7.982831e+06 5.494707e+06 9.117563e+05 3.087464e+06 1.181793e+06 1.657288e+06 1.264974e+06 1.579061e+06 1.627143e+06 9.438215e+05 6.350647e+05 2.281547e+06 1.092302e+06 7.543280e+05 2.523320e+07 2.716037e+06 4.062770e+05 8.778130e+05 1.811631e+06 1.349528e+06 1.089329e+06 1.422622e+06 2.046442e+06 1.372061e+06 3.463176e+06 2.676642e+06 1.103476e+06 1.431002e+06 1.787020e+06 1.236806e+06 1.439478e+06 1.299017e+06 1.488064e+06 1.610661e+06 1.129574e+06 1.605715e+06 1.221762e+06 1.266332e+06 1.387957e+06 1.633896e+06 7.860668e+05 1.466038e+06 1.414205e+06 1.868896e+06 8.628755e+05 9.086123e+05 9.826511e+05 7.213086e+05 1.950585e+06 5.080123e+05 8.798519e+05 2.471911e+06 8.350639e+05 1.632736e+06 1.370291e+06 1.660489e+06 1.098104e+06 1.429346e+06 2.901279e+06 2.033787e+06 1.586101e+06 1.091019e+07 7.091404e+06 1.291608e+07 8.758755e+06 6.479755e+06 1.089067e+07 6.332864e+06 6.744355e+06 8.766956e+06 7.758437e+06 9.647450e+06 1.448374e+07 8.757461e+06 6.462978e+06 1.457018e+07 1.065524e+07 9.558093e+06 1.159360e+07 5.266318e+06 5.407325e+06 6.708931e+06 7.329305e+06 6.149812e+06 C3 H3 N8 O P_7.08 1.034505e+07 1.527854e+06 1.222330e+06 1.385676e+06 5.976874e+05 1.328289e+06 1.465138e+06 1.184716e+06 378184.02 2.070064e+06 1.092982e+06 1.872138e+06 403551.88 1.159685e+06 1.645649e+06 1.190543e+06 3.137936e+05 1.587684e+06 1.184975e+06 1.170277e+06 3.253926e+05 1.684177e+06 1.665554e+06 1.178533e+06 52718.132 1.451631e+06 1.626395e+06 1.367482e+06 3.739862e+04 1.472217e+06 1.394445e+06 1.473739e+06 237234.25 1.311915e+06 1.662580e+06 1.513242e+06 2.519375e+05 1.434280e+06 1.276708e+06 1.462519e+06 2.524025e+05 1.189272e+06 1.554882e+06 1.552126e+06 2.280292e+05 1.384542e+06 1.230206e+06 1.609482e+06 2.915748e+06 2.848166e+06 3.965880e+06 6.615167e+06 3.419914e+06 2.887170e+06 5.295792e+06 2.791058e+06 7.414670e+06 6.727383e+06 5.367639e+06 8.628707e+06 3.744348e+06 3.600818e+06 3.903754e+06 7.012681e+06 7.467536e+06 2.088536e+06 2.281650e+06 3.955918e+06 3.064685e+06 3.548554e+06 6.808889e+06 4.323443e+06 3.645297e+06 3.348993e+06 4.504219e+06 2.118568e+06 5.336741e+06 4.563622e+06 4.201140e+06 3.000974e+06 3.137069e+06 3.254854e+06 2.541246e+06 2.579388e+06 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5.994721e+06 7.408476e+06 7.352812e+06 4.559550e+06 4.892232e+06 5.487044e+06 3.777300e+06 8.765138e+06 3.928819e+06 4.117669e+06 1.185460e+07 6.337847e+06 6.931762e+06 6.591979e+06 6.193980e+06 5.826637e+06 5.374107e+06 7.048971e+06 6.268524e+06 6.413038e+06 2.061170e+07 1.574375e+07 2.196145e+07 1.977689e+07 2.480315e+07 1.196672e+07 1.684109e+07 1.484326e+07 1.932123e+07 1.804882e+07 1.168975e+07 2.738937e+07 1.855582e+07 2.042321e+07 2.809671e+07 1.337591e+07 1.964329e+07 2.596305e+07 1.321800e+07 1.347941e+07 1.659302e+07 1.810183e+07 1.702915e+07 C8 H14 N3 O17 P3 S_7.08 3.589918e+04 1.363972e+06 1.515182e+06 1.411902e+06 1.074577e+05 1.314886e+06 1.542770e+06 1.336312e+06 110278.57 1.637906e+06 9.914451e+05 1.304683e+06 136024.30 1.721371e+06 1.502700e+06 1.355729e+06 1.013299e+05 1.692329e+06 1.244830e+06 1.081912e+06 1.293623e+05 1.560380e+06 1.436754e+06 1.008556e+06 23184.406 2.023258e+06 1.255970e+06 1.574946e+06 1.880238e+04 1.496301e+06 1.543776e+06 1.207619e+06 138981.97 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3.552490e+05 6.120035e+05 3.818728e+05 5.477305e+05 1.259244e+06 2.382091e+05 1.112723e+06 1.469212e+07 1.111314e+05 1.310098e+06 6.630735e+06 1.412982e+05 4.078850e+05 1.308743e+05 8.808071e+06 4.617922e+05 4.717286e+05 1.224555e+06 2.593020e+06 1.677777e+06 2.516317e+05 4.030933e+05 1.366671e+06 1.287442e+06 3.904948e+05 1.578095e+05 9.091235e+05 1.318016e+06 4.442353e+05 4.786942e+06 1.451151e+05 1.275185e+06 6.331294e+05 5.624568e+05 8.855995e+05 1.109228e+05 2.259814e+05 2.587318e+06 8.105189e+05 7.671663e+05 8.360801e+05 7.638411e+05 8.522708e+05 1.111183e+06 1.496490e+06 1.034398e+06 1.156364e+06 1.497568e+05 1.127254e+06 6.764525e+05 7.411056e+05 1.827203e+05 3.539757e+05 2.151030e+05 2.206819e+06 6.478374e+06 5.255296e+05 2.074658e+06 4.247947e+06 6.102492e+05 2.445973e+05 3.791481e+05 2.104114e+06 1.908612e+06 1.991991e+05 1.468001e+06 9.537995e+04 1.124196e+06 3.355976e+05 2.131815e+05 2.234941e+05 2.155674e+05 5.253226e+06 1.127372e+06 7.037749e+05 C16 H22 N10 O10 P2_7.081 8.902708e+06 7.793264e+05 7.941755e+05 7.253795e+05 3.212980e+05 8.536032e+05 8.541216e+05 7.444523e+05 199283.41 1.040894e+06 7.624089e+05 1.159315e+06 217360.05 6.713088e+05 9.080673e+05 6.600025e+05 1.609949e+05 7.885720e+05 7.031982e+05 6.310106e+05 1.604745e+05 1.000963e+06 1.108935e+06 7.017370e+05 24246.985 8.104541e+05 8.229651e+05 7.915057e+05 1.648306e+04 8.125296e+05 9.725088e+05 8.591915e+05 103686.79 7.352805e+05 9.535734e+05 8.177788e+05 1.166677e+05 8.314716e+05 6.752016e+05 1.015461e+06 1.176705e+05 6.627470e+05 8.487638e+05 8.738958e+05 1.062392e+05 8.071686e+05 6.883793e+05 9.631367e+05 1.985903e+06 2.652903e+06 2.788430e+06 4.880073e+06 2.127057e+06 2.056585e+06 4.581087e+06 2.806279e+06 7.387188e+06 6.006345e+06 4.795184e+06 9.505146e+06 3.693656e+06 3.160944e+06 3.973573e+06 6.041673e+06 7.732772e+06 1.380820e+06 1.777781e+06 3.208419e+06 1.848219e+06 2.566626e+06 6.733727e+06 3.945776e+06 3.153549e+06 2.317766e+06 3.281272e+06 1.464848e+06 4.531246e+06 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2.996179e+05 1.549697e+05 2.159814e+05 1.386269e+05 1.713746e+05 3.018421e+05 3.271707e+05 3.061690e+05 3.655280e+06 2.715489e+06 5.165921e+06 2.656392e+06 4.227345e+06 4.142462e+06 1.796084e+06 3.026735e+06 2.718749e+06 2.501862e+06 3.211635e+06 5.298857e+06 1.850644e+06 2.775081e+06 5.187931e+06 5.697070e+06 3.385507e+06 3.440841e+06 1.560849e+06 2.767526e+06 1.869603e+06 1.991781e+06 2.346550e+06 C17 H20 N2 O11 S_7.081 7.596898e+06 1.161499e+06 1.118162e+06 9.834772e+05 3.216455e+05 1.362541e+06 1.026883e+06 1.230068e+06 212581.36 1.607742e+06 1.029670e+06 1.305596e+06 234781.58 1.023994e+06 1.336592e+06 1.227543e+06 1.920433e+05 1.198274e+06 9.643916e+05 9.665165e+05 1.830429e+05 1.315395e+06 1.433974e+06 9.722267e+05 29012.975 1.312532e+06 1.294705e+06 1.106930e+06 2.094508e+04 1.233131e+06 1.111159e+06 1.134280e+06 132873.83 1.333040e+06 1.241558e+06 1.222012e+06 1.423346e+05 1.263751e+06 1.085497e+06 1.214313e+06 1.444747e+05 8.759272e+05 1.274857e+06 1.389638e+06 1.352707e+05 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4.186962e+05 8.095979e+05 3.758545e+05 1.590481e+06 6.459650e+05 1.990125e+05 4.834917e+05 6.852987e+05 2.265906e+05 4.449587e+05 4.726801e+05 5.905611e+05 5.094622e+05 3.509903e+05 5.454331e+05 4.072703e+05 2.786862e+05 4.083217e+05 3.845840e+05 2.537906e+05 4.752092e+05 5.199190e+05 4.521164e+05 1.747783e+05 2.673895e+05 2.982170e+05 2.941984e+05 7.072523e+05 1.898153e+05 2.765613e+05 7.601068e+05 2.481270e+05 7.456702e+05 4.548789e+05 4.725669e+05 2.881266e+05 5.669060e+05 5.659220e+05 6.755353e+05 4.928882e+05 3.620947e+06 3.856859e+06 4.303337e+06 2.925145e+06 3.828500e+06 3.737792e+06 2.101343e+06 2.666814e+06 2.880422e+06 2.545635e+06 3.097639e+06 5.320338e+06 2.721919e+06 2.493197e+06 4.728420e+06 4.690021e+06 3.128017e+06 3.631154e+06 1.669185e+06 2.345969e+06 2.206115e+06 2.277852e+06 2.701412e+06 C7 H16 N7 O3 P3_7.081 5.908292e+07 2.446367e+07 7.068843e+06 2.596776e+07 3.453605e+05 1.986992e+07 2.306580e+07 1.866992e+07 252369.81 2.365823e+07 1.331774e+07 2.352991e+07 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3.267626e+07 3.002407e+07 2.944814e+07 3.707587e+07 2.954139e+07 4.369414e+07 2.869004e+07 3.699003e+07 2.030504e+07 2.565805e+07 2.207694e+07 3.324663e+07 3.040729e+07 2.521883e+07 8.608793e+06 1.521082e+07 1.207859e+07 1.573124e+07 1.033718e+07 1.248846e+07 5.133961e+06 7.534992e+06 6.519279e+06 1.598957e+07 8.838952e+06 7.106324e+06 4.338049e+07 1.811992e+07 6.053575e+06 7.599225e+06 1.003721e+07 1.136554e+07 9.796654e+06 1.549924e+07 1.562905e+07 1.226367e+07 3.153952e+07 1.927042e+07 1.320189e+07 1.130651e+07 1.387787e+07 2.222367e+07 1.535609e+07 1.129401e+07 1.393970e+07 1.253096e+07 1.343916e+07 1.299171e+07 6.758329e+06 9.818506e+06 9.454598e+06 1.135706e+07 1.341473e+06 3.151884e+06 2.879245e+06 1.142451e+07 9.962205e+06 8.157323e+06 1.023502e+07 1.109755e+07 1.751298e+07 7.096214e+06 7.728110e+06 1.780419e+07 1.063812e+07 1.315735e+07 1.279935e+07 1.400018e+07 9.044057e+06 9.345889e+06 1.330111e+07 1.329855e+07 1.556890e+07 3.717756e+07 3.273728e+07 4.122858e+07 3.488335e+07 4.360111e+07 3.455367e+07 2.543310e+07 2.847793e+07 3.654462e+07 3.140507e+07 2.941717e+07 5.152247e+07 3.385950e+07 3.247095e+07 4.640475e+07 4.194027e+07 3.127166e+07 4.821551e+07 2.195299e+07 2.607555e+07 2.993025e+07 3.154879e+07 2.878341e+07 C22 H20 N6 O4 S2_7.081 5.960749e+06 8.506802e+05 5.804961e+05 7.492104e+05 2.915480e+05 8.113341e+05 8.510474e+05 7.071341e+05 194924.93 1.164594e+06 5.783029e+05 8.238749e+05 220458.95 7.985451e+05 9.716699e+05 7.694220e+05 1.907557e+05 8.143143e+05 5.532493e+05 6.623800e+05 1.874701e+05 8.717696e+05 9.929520e+05 6.678532e+05 28921.541 8.551744e+05 8.051439e+05 7.083372e+05 2.013334e+04 9.333372e+05 8.066381e+05 8.390669e+05 130400.26 7.090238e+05 8.447930e+05 7.983133e+05 1.373067e+05 7.944982e+05 6.896871e+05 8.754885e+05 1.335131e+05 7.113091e+05 9.443605e+05 6.588437e+05 1.389838e+05 9.231864e+05 7.148988e+05 8.336780e+05 1.842957e+06 1.875422e+06 2.198936e+06 2.832750e+06 1.979091e+06 1.645368e+06 2.976103e+06 2.355218e+06 4.014309e+06 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2.674889e+05 2.310393e+05 2.584137e+05 1.213268e+05 2.038272e+05 1.639756e+05 2.366199e+05 1.221306e+05 3.706082e+05 2.179115e+05 2.113047e+05 1.320471e+05 1.551180e+05 1.845370e+05 1.254714e+05 4.547623e+05 1.848482e+05 1.517227e+05 4.613350e+05 1.737472e+05 1.941364e+05 2.417645e+05 3.241992e+05 1.674838e+05 1.238321e+05 3.491003e+05 3.761029e+05 4.010278e+05 2.129981e+06 2.289503e+06 3.215900e+06 2.264352e+06 2.709205e+06 2.622713e+06 1.585316e+06 2.170856e+06 2.111159e+06 2.025911e+06 2.516744e+06 2.943438e+06 2.073539e+06 2.119286e+06 4.098777e+06 3.152536e+06 2.284231e+06 2.547254e+06 1.139488e+06 2.572703e+06 1.627905e+06 1.686947e+06 2.027828e+06 C11 H19 N7 O9 P2_7.081 2.810830e+07 4.929281e+06 5.346428e+06 5.805402e+06 2.401230e+05 6.174310e+06 5.431607e+06 5.873322e+06 186647.98 6.562477e+06 4.660762e+06 6.999779e+06 213161.87 4.819780e+06 7.538431e+06 3.501659e+06 1.656402e+05 6.265557e+06 4.945752e+06 4.219063e+06 1.679550e+05 5.826836e+06 6.889084e+06 6.586956e+06 25684.066 5.694748e+06 5.140182e+06 5.322358e+06 1.976601e+04 5.881203e+06 5.717923e+06 5.676064e+06 132163.55 5.850210e+06 5.438114e+06 5.606950e+06 1.397948e+05 6.246414e+06 5.059168e+06 6.545744e+06 1.351260e+05 4.147857e+06 6.018500e+06 6.143301e+06 1.288727e+05 5.721111e+06 5.442772e+06 5.733159e+06 1.256064e+07 1.314945e+07 1.395700e+07 2.522473e+07 1.479608e+07 1.190422e+07 2.073275e+07 1.423670e+07 3.033091e+07 2.906488e+07 2.482106e+07 3.689344e+07 1.733945e+07 1.527758e+07 1.997575e+07 3.138387e+07 3.644996e+07 8.657888e+06 9.491204e+06 1.794659e+07 1.050258e+07 1.570518e+07 2.132824e+07 1.723865e+07 1.794441e+07 1.369430e+07 2.033865e+07 7.813172e+06 2.513911e+07 1.639779e+07 1.951142e+07 1.187389e+07 1.187639e+07 9.900306e+06 9.567802e+06 8.468201e+06 1.228603e+07 9.722488e+06 5.243411e+06 5.266863e+06 1.533044e+07 9.985761e+06 1.087479e+07 9.258595e+06 1.792618e+07 1.171508e+07 1.038369e+07 2.269690e+07 1.169971e+07 1.177689e+07 1.738199e+07 2.453410e+07 9.467405e+06 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1.500996e+06 1.407309e+06 1.534131e+06 1.529475e+06 1.126629e+06 5.893792e+05 2.022789e+06 1.252837e+06 5.145161e+05 2.649986e+07 2.633035e+06 5.007537e+05 5.220910e+05 1.704822e+06 1.430028e+06 1.133528e+06 1.466532e+06 2.380463e+06 1.401106e+06 4.471485e+06 2.056659e+06 1.109340e+06 1.618384e+06 1.755802e+06 9.904461e+05 1.623422e+06 1.285875e+06 1.579457e+06 1.370888e+06 1.330338e+06 1.598892e+06 1.139863e+06 1.142173e+06 1.305719e+06 1.636831e+06 8.193759e+05 1.629736e+06 1.156265e+06 1.309422e+06 8.905545e+05 9.793392e+05 1.115688e+06 7.523439e+05 1.982192e+06 7.365634e+05 7.091207e+05 2.690914e+06 1.068714e+06 1.451825e+06 1.396560e+06 1.638260e+06 1.206760e+06 1.277984e+06 1.551522e+06 1.796625e+06 1.560927e+06 9.370073e+06 9.059260e+06 1.249812e+07 9.897622e+06 1.120342e+07 9.833186e+06 6.348155e+06 8.896422e+06 8.860492e+06 8.123743e+06 7.778156e+06 1.427318e+07 9.175581e+06 7.129763e+06 1.402288e+07 1.264468e+07 9.294368e+06 1.070617e+07 4.943829e+06 7.232469e+06 6.586694e+06 7.246323e+06 6.942671e+06 C11 H10 N2 O6 S_7.082 1.225264e+08 4.773405e+07 2.474400e+07 4.861850e+07 1.081784e+06 3.868550e+07 4.566546e+07 3.734368e+07 775245.91 5.327114e+07 3.051286e+07 4.970792e+07 818385.24 4.081667e+07 4.555551e+07 3.457516e+07 6.911907e+05 4.989324e+07 4.188882e+07 2.335974e+07 7.571614e+05 4.652067e+07 4.651719e+07 4.165506e+07 118379.968 4.521736e+07 4.165742e+07 3.735863e+07 8.391458e+04 4.395193e+07 4.096778e+07 4.433262e+07 529961.97 4.185423e+07 4.399570e+07 4.330550e+07 5.611524e+05 4.341526e+07 3.948318e+07 4.986878e+07 5.821080e+05 2.671909e+07 4.528909e+07 4.062318e+07 4.865876e+05 3.943435e+07 3.581834e+07 4.902232e+07 5.197537e+07 5.035093e+07 8.713592e+07 9.596859e+07 6.999831e+07 6.352115e+07 8.705137e+07 4.853931e+07 1.079926e+08 9.745716e+07 8.397801e+07 1.053026e+08 6.105063e+07 5.799118e+07 7.371062e+07 1.019010e+08 1.192443e+08 5.138293e+07 5.528975e+07 7.372482e+07 5.626349e+07 7.106975e+07 1.145404e+08 6.802805e+07 5.323871e+07 7.143181e+07 8.742495e+07 5.103121e+07 9.481781e+07 7.938284e+07 7.645058e+07 6.789080e+07 7.006718e+07 4.181990e+07 5.964790e+07 5.830642e+07 7.301525e+07 4.812102e+07 4.019236e+07 3.600529e+07 6.955217e+07 6.397404e+07 4.882555e+07 5.803187e+07 7.951861e+07 5.909340e+07 5.363509e+07 8.312080e+07 6.818876e+07 6.636181e+07 7.852862e+07 6.120356e+07 5.000813e+07 5.987642e+07 6.358129e+07 8.292427e+07 5.116274e+07 6.214717e+07 6.744247e+07 6.400005e+07 5.876595e+07 6.080041e+07 4.593243e+07 6.487549e+07 8.175566e+07 6.522726e+07 4.956631e+07 5.412477e+07 7.076896e+07 6.478681e+07 6.325273e+07 6.357538e+07 5.610408e+07 7.268488e+07 3.892192e+07 6.588426e+07 6.963295e+07 7.015110e+07 9.601328e+07 4.275612e+07 5.634232e+07 6.332720e+07 7.385934e+07 7.789265e+07 4.195536e+07 2.175145e+07 2.832906e+07 5.389211e+07 5.761553e+07 5.364242e+07 6.438426e+07 7.216221e+07 6.729300e+07 7.810315e+07 5.136197e+07 5.388838e+07 7.183052e+07 6.840350e+07 6.456811e+07 5.481081e+07 6.044031e+07 4.244540e+07 6.611426e+07 7.274461e+07 7.243699e+07 7.345596e+07 7.511407e+07 1.000822e+08 6.091609e+07 8.981793e+07 8.696528e+07 5.808242e+07 4.908622e+07 7.987668e+07 8.366134e+07 5.624957e+07 6.930581e+07 6.689699e+07 6.942241e+07 6.574420e+07 6.614807e+07 8.472893e+07 5.632742e+07 8.589413e+07 6.276480e+07 7.632822e+07 4.386867e+07 5.345692e+07 3.200340e+07 7.313335e+07 5.867176e+07 5.375233e+07 1.839065e+07 3.110097e+07 2.286912e+07 2.865103e+07 2.180686e+07 2.614240e+07 1.717584e+07 1.501881e+07 1.282402e+07 3.303557e+07 1.950563e+07 1.412416e+07 9.372126e+07 3.792816e+07 1.422804e+07 1.648610e+07 2.151815e+07 2.492398e+07 2.073411e+07 2.807146e+07 3.235220e+07 2.302668e+07 4.721208e+07 3.648990e+07 2.388186e+07 2.393191e+07 2.761017e+07 3.873924e+07 2.748599e+07 2.115350e+07 2.936479e+07 2.602834e+07 2.633604e+07 2.512169e+07 1.305059e+07 2.074817e+07 1.961574e+07 2.586090e+07 1.007908e+07 1.608623e+07 1.389516e+07 2.504014e+07 1.926086e+07 1.742144e+07 2.067720e+07 1.835179e+07 3.392808e+07 1.480986e+07 1.608369e+07 3.350753e+07 2.187164e+07 2.582895e+07 2.489760e+07 2.751766e+07 1.820246e+07 2.123042e+07 2.872609e+07 2.681096e+07 3.104402e+07 6.324126e+07 6.862432e+07 7.627191e+07 7.428120e+07 8.571117e+07 7.148758e+07 5.283761e+07 5.770702e+07 7.358110e+07 6.552778e+07 5.874938e+07 1.019277e+08 6.974643e+07 6.452197e+07 9.598739e+07 8.629220e+07 6.571310e+07 9.675253e+07 4.936025e+07 3.694128e+07 6.291952e+07 6.368357e+07 6.062480e+07 C14 H6 N O15 P3_7.083 2.265256e+05 8.492643e+05 7.873378e+05 8.897388e+05 6.073640e+05 6.070862e+05 7.931188e+05 8.085219e+05 424782.23 1.074745e+06 5.277384e+05 1.027911e+06 427284.64 7.896571e+05 7.915131e+05 5.727839e+05 3.169031e+05 1.055060e+06 6.712279e+05 6.577973e+05 2.916651e+05 1.049014e+06 8.235768e+05 6.511262e+05 41450.296 9.104858e+05 7.572335e+05 8.078416e+05 2.811834e+04 9.274785e+05 8.664142e+05 7.070073e+05 184496.46 8.410836e+05 6.875769e+05 8.041798e+05 1.801393e+05 9.285651e+05 9.097048e+05 7.117842e+05 1.864125e+05 5.889283e+05 9.238036e+05 8.076005e+05 2.061515e+05 9.936047e+05 8.228406e+05 6.733340e+05 6.865159e+05 2.246925e+05 4.186429e+05 2.066070e+05 1.917819e+05 1.901080e+05 1.720813e+05 4.701799e+05 4.296652e+05 2.499458e+05 1.287817e+05 6.858258e+05 8.431586e+04 2.301001e+05 1.435954e+05 9.066695e+04 4.878148e+05 2.364133e+05 2.106946e+05 7.954641e+04 1.500931e+05 1.822543e+05 9.498091e+05 1.046978e+05 2.653327e+05 4.545199e+05 9.216703e+04 2.217277e+05 2.285297e+05 1.832686e+05 1.754286e+05 1.346664e+05 1.359683e+05 8.737552e+04 1.674296e+05 1.070889e+05 1.029090e+05 1.728822e+05 8.142077e+04 1.075551e+05 1.690880e+05 9.770596e+04 8.806582e+04 1.798481e+05 5.227581e+05 2.118900e+05 1.229697e+05 2.690755e+05 2.998531e+05 2.396676e+05 1.360254e+06 1.836940e+05 1.133578e+05 5.171726e+05 1.517977e+05 8.198062e+05 6.964311e+04 7.101229e+04 9.473501e+04 7.863140e+04 7.308681e+04 8.189115e+04 9.309092e+04 9.918819e+04 1.125277e+05 2.536843e+05 2.582600e+05 2.020661e+05 1.513602e+05 3.201926e+05 7.917060e+04 1.460312e+05 7.457477e+04 8.962639e+04 6.495605e+04 1.033027e+05 1.181773e+05 7.087157e+04 1.827712e+05 1.371404e+05 1.269818e+05 1.434906e+05 7.942926e+04 1.036095e+05 8.412980e+04 6.701166e+04 1.017435e+05 2.700456e+05 2.464237e+05 2.115941e+05 9.589526e+04 1.181198e+05 8.186530e+04 2.483465e+05 1.156569e+05 1.154162e+05 3.448413e+05 9.092330e+04 2.440295e+05 1.199405e+05 3.014018e+05 1.777061e+05 2.014325e+05 8.344707e+04 1.890943e+05 7.999811e+04 1.102215e+05 3.069023e+05 1.429600e+05 2.851215e+05 8.721374e+04 2.259812e+05 7.444692e+04 2.084055e+05 1.051193e+05 1.399135e+05 4.214328e+05 1.111639e+05 3.405872e+05 3.569558e+05 1.157251e+05 2.225745e+05 1.940682e+05 3.293062e+05 1.001910e+05 8.106523e+04 2.740561e+05 3.031033e+05 1.036155e+05 1.530364e+05 1.363015e+05 5.096175e+05 1.152823e+07 2.992881e+05 2.828996e+05 6.786322e+06 7.957120e+05 1.276450e+06 3.187823e+05 2.470721e+05 4.134017e+05 2.439806e+05 3.632072e+05 1.527259e+06 1.567230e+06 5.923324e+05 8.764368e+06 6.643922e+05 9.855490e+05 4.854403e+06 3.748875e+05 3.070671e+05 4.716899e+05 1.160220e+07 1.718860e+05 9.643506e+05 5.658960e+05 1.121576e+06 1.525491e+06 4.216139e+05 2.483627e+05 9.889390e+05 4.491938e+05 2.510039e+05 5.083079e+05 4.222856e+05 8.299512e+05 3.139253e+05 2.495341e+06 2.005192e+05 6.506649e+05 3.306396e+05 3.438541e+05 4.331863e+05 1.853060e+05 2.208443e+05 1.201319e+06 5.204793e+05 4.727037e+05 6.118082e+05 2.784506e+05 5.289623e+05 6.994143e+05 1.121710e+06 6.402558e+05 1.331069e+06 3.713250e+05 5.930943e+05 3.962299e+05 5.856859e+05 4.085688e+05 1.807646e+05 1.070479e+05 2.093920e+06 3.711790e+06 4.748561e+05 2.962319e+06 1.604945e+06 3.257360e+05 1.305948e+05 1.567178e+05 1.061236e+06 3.414711e+06 9.697950e+04 9.857982e+05 4.462141e+05 8.158014e+05 1.936998e+05 3.473123e+05 1.881793e+05 9.851378e+04 4.396050e+06 2.977637e+05 4.636472e+05 C5 H7 O11 P_7.083 5.621240e+05 3.693070e+07 2.935396e+07 3.943158e+07 3.217441e+05 3.921509e+07 3.531303e+07 3.624592e+07 220377.57 4.948159e+07 2.843148e+07 4.366358e+07 235643.23 2.712302e+07 5.344494e+07 2.945682e+07 1.936832e+05 3.949204e+07 3.275733e+07 2.590648e+07 1.975382e+05 3.787511e+07 5.380761e+07 3.430792e+07 34246.902 3.529452e+07 3.936903e+07 3.100044e+07 2.601833e+04 3.556287e+07 4.052928e+07 4.152712e+07 159901.82 3.490016e+07 3.899765e+07 3.977305e+07 1.568510e+05 3.273767e+07 3.325781e+07 4.808344e+07 1.488151e+05 3.010327e+07 3.696761e+07 3.976999e+07 1.498786e+05 3.460953e+07 3.734802e+07 3.796212e+07 1.771994e+05 1.040552e+05 2.788205e+05 6.914709e+05 3.025643e+05 1.570033e+06 5.351339e+05 7.182416e+06 1.143448e+07 1.394125e+07 1.055585e+07 1.324957e+06 6.582579e+05 7.237224e+06 4.184497e+05 5.827482e+05 1.735874e+06 2.260114e+06 8.295840e+05 4.412073e+05 6.343963e+05 5.964678e+05 1.529093e+06 6.263860e+05 4.249644e+05 6.525403e+05 2.004260e+06 4.185135e+05 5.088953e+05 7.436131e+05 1.078302e+06 3.249236e+05 4.400740e+05 1.076760e+06 3.055707e+05 3.262089e+06 1.036397e+05 5.371017e+04 8.611002e+04 6.031223e+04 7.026447e+04 1.622861e+05 4.406513e+05 7.073408e+04 1.137432e+06 2.113857e+05 1.624197e+05 3.237905e+05 7.500323e+05 6.427368e+04 9.998323e+04 1.187136e+05 1.828717e+06 5.010413e+05 1.271537e+05 1.486499e+06 1.920741e+05 7.460479e+04 1.550142e+05 3.124696e+05 6.622853e+04 9.909522e+04 4.105890e+05 1.266220e+06 1.142183e+06 2.255979e+05 6.358012e+04 8.219300e+04 1.119689e+06 1.401391e+05 1.635241e+06 4.718881e+05 8.120970e+04 1.596559e+05 4.779077e+05 8.891242e+05 9.004963e+05 3.714137e+05 3.835352e+05 5.197369e+04 3.343378e+05 2.610432e+05 6.986958e+05 2.171491e+05 6.443084e+05 1.287536e+05 3.807162e+05 2.975093e+06 1.058180e+06 3.296701e+05 3.226248e+05 1.163966e+06 1.855574e+05 6.158585e+06 1.103138e+05 7.849270e+05 8.529245e+04 3.133887e+05 1.556096e+06 6.090576e+05 3.812816e+05 4.668472e+05 8.723478e+05 2.504689e+05 2.479845e+05 8.132499e+05 1.946864e+05 3.080885e+05 1.247141e+06 1.756524e+05 3.881300e+05 4.614104e+05 1.997593e+05 8.221193e+05 3.771801e+05 4.533662e+05 1.171752e+05 3.472951e+05 2.042207e+05 2.667689e+05 1.714578e+05 3.655046e+05 8.232298e+05 6.151718e+05 5.185037e+05 3.737354e+05 7.942825e+04 8.991166e+04 9.039124e+05 3.702005e+05 5.939826e+05 6.009097e+05 2.408732e+07 4.540361e+07 1.239996e+07 3.681547e+07 2.657890e+07 2.269776e+07 3.061124e+07 2.987762e+07 2.952763e+07 2.180509e+07 8.038685e+07 1.831377e+07 5.846418e+07 4.886863e+07 1.123865e+07 3.779826e+07 3.629194e+07 2.216203e+07 2.349608e+07 2.874809e+07 5.420381e+07 1.827923e+07 6.615092e+04 5.963672e+07 3.218356e+07 3.477991e+07 1.876201e+07 2.220715e+07 1.810719e+07 4.063860e+07 2.490742e+07 2.418396e+07 1.022600e+07 6.707674e+06 2.480126e+07 2.163798e+07 1.266598e+07 5.656107e+07 1.265626e+07 4.673456e+07 2.559053e+07 5.487438e+07 5.929911e+07 4.671090e+07 2.115764e+07 1.848794e+07 2.194578e+07 2.697520e+07 3.524795e+07 7.476114e+06 2.408646e+07 2.196101e+07 1.687754e+07 2.358659e+07 4.722478e+07 4.473610e+07 4.374438e+07 1.432876e+07 5.671325e+07 4.139661e+05 4.711614e+06 5.194285e+05 4.391035e+05 1.730011e+05 2.814880e+05 7.409544e+04 1.113417e+06 9.454235e+04 1.148181e+06 3.440536e+05 3.489955e+05 1.861422e+05 4.906322e+05 1.029286e+07 1.559228e+05 6.310014e+04 2.037866e+05 1.776718e+06 2.982460e+05 1.803684e+05 5.718359e+05 3.381866e+05 C4 H14 N9 O P3_7.084 4.720392e+07 4.654243e+06 4.599170e+06 4.775922e+06 2.665398e+05 4.829079e+06 4.662544e+06 5.185544e+06 168740.42 5.784402e+06 4.663226e+06 5.696002e+06 184629.04 4.444972e+06 5.623388e+06 4.250628e+06 1.413819e+05 4.782588e+06 3.989152e+06 4.237861e+06 1.458185e+05 5.483168e+06 6.370756e+06 4.337118e+06 23910.364 5.026483e+06 4.871026e+06 4.524908e+06 1.761624e+04 5.101871e+06 4.965926e+06 4.939038e+06 109812.66 4.924577e+06 5.529527e+06 4.563166e+06 1.154889e+05 5.397420e+06 4.102980e+06 5.295235e+06 1.148358e+05 4.000298e+06 5.203819e+06 6.139857e+06 1.162788e+05 5.174565e+06 2.979980e+06 5.893635e+06 1.445609e+07 1.428058e+07 1.862172e+07 2.871890e+07 1.343912e+07 1.194797e+07 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1.512050e+06 1.599712e+06 1.991906e+06 1.337914e+06 1.278433e+06 1.043737e+06 1.354101e+06 1.502093e+06 1.511499e+06 1.566184e+06 8.606343e+05 1.712127e+06 1.608036e+06 1.404311e+06 9.250137e+05 1.222080e+06 1.135910e+06 9.914773e+05 2.877195e+06 4.975615e+05 8.156093e+05 3.590761e+06 9.779491e+05 1.977933e+06 1.358687e+06 1.607696e+06 1.265261e+06 1.454894e+06 2.127520e+06 1.942379e+06 1.956115e+06 2.206216e+07 2.187702e+07 2.764533e+07 1.743741e+07 2.298456e+07 2.292136e+07 9.507018e+06 2.135992e+07 1.709455e+07 1.921820e+07 1.818252e+07 2.775171e+07 1.673137e+07 1.556586e+07 2.849752e+07 2.929187e+07 2.013384e+07 1.630210e+07 8.805860e+06 1.509896e+07 1.248669e+07 1.196741e+07 1.624035e+07 C9 H12 N10 O4_7.084 2.440298e+06 1.037195e+06 1.180866e+06 9.177034e+05 1.417022e+05 1.188005e+06 1.130269e+06 1.286123e+06 131657.23 1.073023e+06 1.055039e+06 1.058227e+06 167088.92 1.173853e+06 1.060828e+06 1.031758e+06 1.295626e+05 1.115573e+06 1.133863e+06 1.084541e+06 1.422213e+05 9.721873e+05 1.224280e+06 1.366324e+06 25896.411 1.067086e+06 9.687966e+05 1.094383e+06 2.149887e+04 8.943937e+05 1.101592e+06 1.460309e+06 133220.22 1.028318e+06 9.806246e+05 1.019858e+06 1.308775e+05 1.033716e+06 1.183610e+06 1.326749e+06 1.255994e+05 9.527683e+05 1.134702e+06 1.148060e+06 1.496663e+05 1.062448e+06 1.073770e+06 1.090923e+06 1.561867e+06 1.884911e+06 1.794813e+06 2.501990e+06 1.304973e+06 1.424665e+06 1.963900e+06 2.755793e+06 3.381186e+06 2.386238e+06 1.621886e+06 3.773049e+06 2.491817e+06 2.032955e+06 2.257526e+06 3.000595e+06 3.080697e+06 1.187665e+06 1.390477e+06 2.039912e+06 1.157984e+06 1.547745e+06 2.319532e+06 2.447303e+06 1.946921e+06 1.571304e+06 2.320367e+06 1.207231e+06 1.899944e+06 1.575029e+06 1.844127e+06 1.285502e+06 1.582272e+06 1.460820e+06 1.233951e+06 1.630225e+06 1.194212e+06 1.454220e+06 9.420706e+05 7.275024e+05 1.874909e+06 1.184891e+06 1.664517e+06 1.090768e+06 2.226051e+06 1.428967e+06 1.589434e+06 1.827649e+06 1.528386e+06 1.340053e+06 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1.396215e+06 2.047416e+06 1.559240e+06 1.451502e+06 1.060178e+06 3.594647e+05 1.347349e+06 7.802079e+05 7.229833e+05 6.847655e+05 7.420467e+05 7.777284e+05 4.857174e+05 6.752245e+05 7.938301e+05 5.609952e+05 2.969614e+05 1.579417e+07 8.077980e+05 1.387227e+05 3.610461e+05 8.668264e+05 6.807418e+05 5.065944e+05 9.101613e+05 8.769255e+05 6.387588e+05 1.459056e+06 6.619548e+05 7.336995e+05 6.176193e+05 1.059294e+06 4.165774e+05 6.211974e+05 5.975688e+05 8.255270e+05 5.860045e+05 7.149604e+05 5.522698e+05 6.688010e+05 7.405213e+05 5.763443e+05 6.429678e+05 5.000086e+05 5.809716e+05 8.647212e+05 5.222283e+05 5.502535e+05 5.882699e+05 3.813720e+05 4.181203e+05 8.639769e+05 2.240575e+05 4.712014e+05 1.112866e+06 3.775862e+05 8.457299e+05 6.709495e+05 8.084476e+05 4.629033e+05 7.687372e+05 8.256376e+05 6.302084e+05 7.004296e+05 2.041054e+06 2.609553e+06 2.514454e+06 1.975767e+06 2.227427e+06 2.278048e+06 1.245515e+06 2.678629e+06 1.547016e+06 1.780015e+06 1.822240e+06 1.844476e+06 1.895218e+06 1.446559e+06 1.699730e+06 2.583497e+06 2.036745e+06 1.424520e+06 1.229698e+06 1.680981e+06 1.596762e+06 1.648079e+06 1.906717e+06 C8 H16 N2 O3_7.084 8.191322e+05 4.850589e+05 3.871587e+05 4.093600e+05 2.913331e+05 3.912426e+05 4.556568e+05 6.017481e+05 135812.41 4.826728e+05 4.864078e+05 5.925240e+05 145055.19 3.492924e+05 4.825512e+05 4.868149e+05 1.069188e+05 4.014813e+05 4.446799e+05 4.095156e+05 1.143924e+05 4.277478e+05 6.096265e+05 4.932293e+05 18109.286 4.087061e+05 4.695318e+05 5.035315e+05 1.350201e+04 4.826863e+05 4.668345e+05 4.392711e+05 90144.20 4.320009e+05 5.420205e+05 4.540082e+05 9.091791e+04 4.034217e+05 5.107457e+05 5.289574e+05 8.599248e+04 3.437014e+05 5.375778e+05 5.896514e+05 9.882762e+04 3.926176e+05 4.395641e+05 4.612261e+05 1.618341e+05 6.746102e+05 8.780136e+05 7.623501e+04 1.568346e+05 1.735257e+05 1.456026e+06 1.784909e+05 7.030927e+05 9.982947e+05 1.117114e+06 6.963041e+04 2.896300e+05 3.081751e+05 5.148539e+05 9.391850e+05 2.207180e+05 1.318977e+05 4.052816e+05 2.616830e+05 6.574625e+05 5.999286e+05 9.178239e+04 7.089609e+05 7.675490e+05 7.033106e+04 1.171361e+06 5.861986e+04 7.905991e+05 1.728306e+05 9.072640e+05 2.713526e+05 1.547689e+05 4.577278e+05 1.114713e+05 1.708523e+05 8.035975e+05 6.611116e+05 1.419906e+05 1.136125e+06 1.795134e+06 3.004222e+05 1.000791e+06 4.288969e+04 4.628798e+05 2.780950e+05 5.899609e+05 1.501641e+05 1.799544e+05 6.161942e+05 5.539429e+04 2.160620e+05 4.047545e+05 3.510286e+05 8.898038e+05 7.388518e+04 1.883447e+05 2.718923e+05 5.804010e+05 1.107597e+06 1.732637e+05 3.914212e+05 2.414143e+05 3.223818e+05 4.558488e+05 9.646495e+04 3.828852e+04 6.144435e+05 3.570172e+05 1.521075e+05 8.796050e+05 1.292657e+06 5.151050e+05 1.058679e+06 4.060205e+05 6.133299e+05 5.024514e+05 1.334656e+06 6.222745e+04 2.268676e+05 1.720539e+05 2.678890e+05 3.231064e+05 1.847907e+06 4.510055e+05 5.536883e+05 1.382173e+06 3.269772e+05 2.969333e+05 9.617804e+05 8.185107e+05 2.600632e+06 2.453161e+05 1.206735e+06 9.499931e+05 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4.257236e+06 3.711625e+06 3.525483e+06 5.247867e+05 3.696423e+06 4.696634e+06 4.049260e+06 399644.14 4.747190e+06 3.130257e+06 3.909866e+06 449210.52 3.879671e+06 5.078819e+06 3.603023e+06 3.486152e+05 4.209239e+06 3.404051e+06 3.543275e+06 3.654655e+05 4.300711e+06 4.570447e+06 3.591339e+06 61356.418 4.081377e+06 4.413069e+06 3.456520e+06 4.415867e+04 3.898668e+06 4.270431e+06 4.308002e+06 285178.99 4.194786e+06 4.201969e+06 3.447600e+06 3.208415e+05 4.359548e+06 3.899724e+06 4.691407e+06 3.355897e+05 2.958749e+06 3.929719e+06 4.261986e+06 2.967777e+05 3.528112e+06 4.118936e+06 4.262088e+06 3.183381e+06 2.624914e+06 6.400373e+06 5.219912e+06 3.394914e+06 3.441416e+06 4.165114e+06 3.230089e+06 5.817094e+06 5.374346e+06 4.958861e+06 5.775731e+06 2.744316e+06 3.538135e+06 3.180210e+06 5.596890e+06 6.503201e+06 2.738102e+06 2.600302e+06 4.073893e+06 2.788133e+06 3.839498e+06 5.521004e+06 3.168083e+06 3.139472e+06 3.460896e+06 3.545869e+06 2.562950e+06 4.644557e+06 3.473874e+06 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3.489591e+06 3.154026e+06 3.110630e+06 4.155084e+06 3.543550e+06 3.433929e+06 4.648041e+06 3.005851e+06 3.313590e+06 3.555282e+06 3.998670e+06 4.153012e+06 3.416734e+06 3.020600e+06 2.707561e+06 3.369968e+06 2.779982e+06 3.051056e+06 5.021886e+06 3.139060e+06 2.972228e+06 5.272441e+06 4.342461e+06 3.353220e+06 4.324680e+06 2.810323e+06 2.851116e+06 3.330762e+06 3.096277e+06 3.173292e+06 C6 H13 N O5_7.085 7.859320e+06 9.224287e+05 5.404023e+05 8.585714e+05 4.301706e+05 5.642301e+05 9.204649e+05 6.917708e+05 254140.03 1.085072e+06 6.070455e+05 9.614606e+05 269781.48 7.762727e+05 7.756260e+05 5.529296e+05 1.913421e+05 9.837084e+05 5.399506e+05 6.443596e+05 1.836822e+05 1.150385e+06 9.113795e+05 3.659860e+05 29602.103 1.083913e+06 7.095737e+05 7.070370e+05 2.056869e+04 9.551638e+05 8.773389e+05 5.435416e+05 130775.15 8.676360e+05 7.452283e+05 8.196244e+05 1.270729e+05 9.797592e+05 7.807487e+05 7.314334e+05 1.337561e+05 5.439719e+05 8.112602e+05 7.529762e+05 1.393921e+05 1.044879e+06 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4.317746e+05 3.360544e+05 9.396617e+05 2.114640e+05 2.278730e+05 1.864032e+05 6.595057e+05 3.066402e+05 3.092654e+05 2.351347e+05 3.821491e+05 1.558795e+05 3.991653e+05 4.605323e+05 3.267221e+05 2.889382e+05 4.869848e+05 4.813438e+05 1.311900e+05 1.708208e+05 3.272216e+05 2.134432e+05 1.283379e+05 2.687463e+05 2.471211e+05 1.375368e+05 6.635284e+05 1.672087e+05 2.464396e+05 6.488560e+05 1.636636e+05 5.370864e+05 3.326861e+05 2.284943e+05 1.721081e+05 3.227971e+05 2.677316e+05 3.477203e+05 5.823206e+05 1.791533e+06 7.149752e+05 2.793016e+06 1.985159e+06 1.708056e+06 1.734349e+06 1.706103e+06 1.006968e+06 2.118743e+06 1.305919e+06 1.167593e+06 2.701306e+06 1.152608e+06 1.168098e+06 1.492281e+06 2.405317e+06 1.601594e+06 2.557757e+06 1.245969e+06 1.135942e+06 2.000699e+06 1.504426e+06 1.105954e+06 C6 H9 N3 O2_7.086 8.330130e+06 4.772561e+06 4.048771e+06 3.321921e+06 3.886864e+05 4.688821e+06 4.396826e+06 4.186014e+06 321654.56 5.439806e+06 3.727955e+06 5.198829e+06 286216.94 4.051302e+06 4.667026e+06 3.579154e+06 2.473882e+05 4.869566e+06 3.696984e+06 3.331330e+06 1.975925e+05 4.821389e+06 5.090815e+06 4.646392e+06 41823.665 4.437747e+06 4.250777e+06 4.193170e+06 2.795201e+04 4.237012e+06 4.534679e+06 4.531361e+06 147754.55 4.382726e+06 4.690898e+06 3.819493e+06 1.511169e+05 3.480475e+06 5.378327e+06 5.609731e+06 1.425198e+05 2.205536e+06 4.712459e+06 5.193976e+06 1.499115e+05 4.459346e+06 3.798133e+06 4.382830e+06 5.349029e+05 7.637103e+04 2.933465e+05 8.171177e+04 4.757503e+05 8.303641e+05 1.318805e+06 2.512636e+05 1.050043e+05 1.117466e+06 1.986715e+06 6.044519e+06 2.312422e+05 8.823714e+04 3.655000e+05 1.088388e+05 8.072489e+06 2.525232e+05 5.651711e+05 9.980668e+04 1.538742e+05 5.662681e+04 1.616104e+05 9.917407e+05 1.357288e+07 1.001866e+05 1.799725e+06 2.029719e+06 1.886117e+05 1.657469e+05 9.688895e+05 2.509681e+06 8.499637e+05 1.779603e+05 1.944468e+06 3.950188e+05 5.849206e+06 2.623202e+05 2.929228e+05 7.570912e+05 4.099662e+05 6.626291e+04 2.227058e+05 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7.422240e+06 6.258477e+06 6.764647e+06 8.763150e+06 C8 H16 N2 O3 S_7.089 1.467018e+05 5.143690e+05 6.026882e+05 5.524943e+05 2.395971e+05 4.231424e+05 5.721683e+05 6.089788e+05 153980.63 6.745819e+05 4.583548e+05 6.857724e+05 171935.82 5.160743e+05 5.864098e+05 4.418812e+05 1.324416e+05 5.952921e+05 4.978884e+05 4.651354e+05 1.389482e+05 6.595468e+05 6.091698e+05 5.231016e+05 22572.163 5.560423e+05 6.465619e+05 4.791265e+05 1.665845e+04 5.735460e+05 5.219744e+05 6.437127e+05 106302.47 5.647191e+05 4.739184e+05 6.062561e+05 1.093419e+05 5.547241e+05 5.557477e+05 6.713017e+05 1.094001e+05 4.104528e+05 5.535550e+05 6.340446e+05 1.127772e+05 5.418044e+05 4.817725e+05 6.103807e+05 7.336568e+04 3.965670e+04 4.426962e+05 6.189005e+04 6.728095e+04 2.115721e+05 1.454894e+05 1.513887e+05 5.002086e+05 5.773148e+05 6.780799e+05 1.010443e+05 1.636166e+05 9.427573e+04 5.198504e+04 6.757141e+05 2.516096e+05 1.290721e+05 1.439882e+06 2.871133e+06 9.698421e+05 4.134648e+05 9.599706e+04 1.913972e+05 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5.949266e+06 4.937336e+06 5.603712e+06 4.974684e+06 6.616115e+06 5.323593e+06 4.664786e+06 5.897717e+06 3.330685e+06 4.893135e+06 5.098897e+06 5.267326e+06 4.854778e+06 5.640377e+06 6.289175e+06 6.693319e+06 4.312994e+06 3.714516e+06 4.926902e+06 3.809841e+06 6.861422e+06 3.297354e+06 3.670690e+06 7.079231e+06 5.042376e+06 6.084743e+06 5.845369e+06 5.746253e+06 4.616929e+06 4.111914e+06 6.015937e+06 5.246470e+06 5.951388e+06 1.766120e+07 1.680325e+07 2.289408e+07 1.863405e+07 2.218374e+07 1.820667e+07 1.204256e+07 1.208762e+07 1.804368e+07 1.606988e+07 1.717551e+07 2.447406e+07 1.931653e+07 1.769622e+07 2.895824e+07 2.046703e+07 1.720108e+07 2.283162e+07 1.274458e+07 1.463797e+07 1.979977e+07 1.624032e+07 1.564067e+07 C10 H15 Cl N10 O5 P2_7.095 3.926073e+05 4.835682e+06 5.496281e+06 4.204967e+06 3.551189e+05 5.544469e+06 5.326012e+06 5.944116e+06 173956.27 6.776526e+06 4.950070e+06 6.784023e+06 180325.14 4.650843e+06 6.134978e+06 5.620464e+06 1.324480e+05 5.192156e+06 3.347610e+06 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4.396554e+06 2.517927e+06 3.029519e+06 6.048133e+06 2.064640e+06 3.298282e+06 3.527786e+06 2.385001e+06 2.576058e+06 2.697428e+06 1.741064e+06 4.511691e+06 3.473862e+06 1.705303e+06 1.655215e+06 3.332260e+06 2.148665e+06 2.060783e+06 3.460234e+06 C8 H16 Cl2 N8 O10_7.107 3.676101e+05 1.048188e+06 2.738608e+06 5.509809e+05 6.034064e+05 1.691567e+06 1.258920e+06 2.054921e+06 195823.21 1.522970e+06 1.385281e+06 2.007857e+06 161897.02 1.074701e+06 2.084222e+06 1.337234e+06 1.053052e+05 1.912534e+06 1.205861e+06 9.316288e+05 9.696862e+04 1.487714e+06 2.237277e+06 2.158524e+06 14213.522 1.163202e+06 1.685930e+06 1.411564e+06 1.171757e+04 1.310190e+06 1.594694e+06 1.773844e+06 73590.31 1.523324e+06 1.698211e+06 1.937855e+06 6.894759e+04 1.025554e+06 1.672108e+06 1.986435e+06 6.626120e+04 9.298979e+05 1.828699e+06 2.158400e+06 6.591548e+04 1.124978e+06 1.188097e+06 1.860896e+06 2.646474e+04 3.106771e+04 4.764085e+04 8.825074e+04 3.803940e+04 1.093908e+05 9.185098e+04 1.899805e+06 3.596935e+05 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5.976372e+04 3.327181e+04 1.199995e+05 4.569396e+04 4.654522e+04 1.857752e+05 3.121240e+04 2.534272e+05 4.169425e+04 8.461962e+04 8.995232e+04 2.977587e+04 1.643960e+05 5.692107e+04 5.036025e+04 2.650734e+04 1.205525e+05 3.032705e+04 6.491668e+04 5.605659e+04 3.827303e+04 8.651359e+04 1.151429e+05 7.793397e+04 5.024094e+04 3.665528e+04 2.560603e+04 1.382193e+05 4.031099e+04 4.991982e+04 2.921969e+04 3.843656e+04 3.135664e+04 2.904740e+04 2.751543e+04 3.152269e+04 5.277687e+04 9.695857e+04 9.506368e+04 6.187085e+04 2.885017e+04 4.318515e+04 1.356106e+05 6.494220e+04 7.343705e+04 3.212669e+04 5.269233e+04 1.119595e+06 5.260000e+05 1.531865e+05 5.136626e+05 2.269354e+05 2.558192e+05 1.085821e+05 2.748241e+05 2.235722e+05 4.972132e+04 6.620347e+04 4.002343e+05 1.101585e+06 4.672991e+04 6.871082e+04 1.233971e+06 1.152250e+05 5.998467e+04 7.977906e+05 1.252269e+06 8.791156e+04 2.603073e+04 2.617748e+05 1.112212e+06 3.553338e+05 5.094710e+05 1.524549e+05 8.742673e+05 3.398849e+05 5.238556e+05 1.160501e+05 7.200080e+05 2.183139e+05 2.676688e+05 3.215305e+05 1.800293e+05 2.315617e+05 1.993127e+05 9.196948e+05 6.423959e+05 7.978229e+05 5.521059e+05 1.893546e+05 4.809754e+04 7.494338e+04 9.330789e+05 5.164088e+04 2.183604e+05 1.616317e+06 8.039448e+05 4.317943e+05 6.108287e+05 3.540677e+05 6.894448e+04 3.949443e+05 9.537691e+05 3.984224e+05 1.520978e+05 1.399006e+05 7.823616e+05 6.977117e+04 3.107221e+04 9.767102e+04 4.730664e+04 2.950627e+04 2.373965e+05 3.098134e+04 3.466658e+05 4.767723e+04 5.397609e+04 7.571716e+04 5.445215e+04 5.177119e+06 1.083557e+05 3.496284e+04 9.418096e+04 1.957988e+05 4.509592e+04 2.498056e+04 4.197848e+04 3.902765e+04 C4 H8 N6 O4_7.107 2.933022e+06 1.408656e+08 1.228210e+08 1.397400e+08 5.616571e+05 1.004939e+08 6.110491e+07 3.244498e+08 587980.10 9.349304e+07 1.160601e+08 9.777719e+07 909142.00 4.195027e+07 1.895020e+07 1.548337e+08 5.423160e+05 6.195087e+07 1.677722e+08 7.531369e+07 3.014254e+05 1.660024e+08 1.650986e+08 9.736095e+07 42807.432 1.243329e+08 1.786456e+08 7.929715e+07 3.220580e+04 1.347535e+08 1.201770e+08 1.162245e+08 196345.75 1.259656e+08 1.719982e+08 1.822713e+08 2.259835e+05 1.373210e+08 5.174460e+07 5.150443e+07 2.830173e+05 9.697187e+07 1.727499e+08 1.636167e+08 2.064647e+05 1.192538e+08 1.135167e+08 1.367470e+08 2.452697e+05 4.254779e+05 3.513150e+05 8.919737e+05 4.233834e+05 2.083819e+06 1.455319e+06 6.663065e+06 1.308259e+07 1.942052e+07 1.258857e+07 4.083045e+06 5.531654e+05 8.893831e+06 1.045629e+06 7.956129e+05 2.337714e+06 3.005380e+06 1.407581e+06 4.767002e+05 1.158358e+06 7.272609e+05 3.694836e+06 8.831004e+05 4.503703e+05 9.723843e+05 2.000263e+06 7.453804e+05 7.641596e+05 1.283475e+06 3.814562e+06 7.076003e+05 1.965517e+06 2.316991e+06 5.108168e+05 1.018472e+07 2.799135e+05 1.455394e+05 1.826095e+05 6.199280e+05 2.913590e+05 3.481446e+05 4.538332e+05 7.059436e+05 9.777154e+05 1.515669e+06 2.272413e+05 7.064097e+05 1.459541e+06 2.940059e+05 3.506781e+05 2.313041e+05 3.572320e+06 6.393757e+05 2.690558e+05 1.542524e+06 2.134742e+05 1.841416e+05 2.620753e+05 3.715822e+05 1.489077e+05 2.344415e+05 4.611056e+05 2.060375e+06 1.457059e+06 4.558637e+05 7.165426e+05 4.318907e+05 1.620339e+06 4.434375e+05 2.264341e+06 5.595101e+05 1.066030e+05 3.811208e+05 6.649878e+05 1.157735e+06 1.247406e+06 6.226806e+05 1.922701e+06 9.665239e+04 1.889312e+06 1.811381e+06 5.409237e+05 6.169751e+05 5.787047e+05 2.748974e+05 2.159541e+06 3.681731e+06 1.190520e+06 5.581362e+05 4.801241e+05 1.792965e+06 3.504745e+05 1.000489e+07 4.846369e+05 1.436809e+06 4.515264e+05 3.105884e+05 2.239005e+06 7.245262e+05 2.330529e+06 6.935929e+05 2.472781e+06 3.623008e+05 9.999668e+05 8.160124e+05 4.503566e+05 1.252214e+06 1.893081e+06 9.735692e+05 4.104786e+05 1.122722e+06 2.394201e+05 7.723518e+05 8.397314e+05 6.321528e+05 1.786450e+05 8.673325e+05 4.830550e+05 4.394509e+05 3.429689e+05 5.169427e+05 3.817252e+06 1.151193e+06 9.394439e+05 4.552573e+05 1.074876e+05 5.107322e+05 7.166028e+05 6.363160e+05 1.733470e+06 9.933129e+05 1.680685e+08 7.155083e+07 1.113075e+08 5.528465e+07 1.793475e+08 8.040081e+07 1.474317e+08 8.764117e+07 1.398588e+08 1.170880e+08 8.113735e+07 3.316521e+08 2.038663e+07 1.074564e+08 8.530915e+07 2.478685e+08 1.182019e+08 1.862543e+08 1.246989e+08 1.030138e+08 4.429531e+08 1.410440e+08 2.002586e+05 4.217413e+08 1.733011e+08 1.783649e+08 5.062802e+07 1.247602e+08 7.167613e+07 1.276986e+08 3.301481e+07 1.328008e+08 1.328113e+08 1.107418e+08 8.269006e+07 1.167255e+08 1.113780e+08 7.522651e+07 4.397750e+07 1.132517e+08 1.519814e+08 5.948315e+08 9.658595e+07 8.480940e+07 1.122327e+08 3.973369e+08 7.906747e+07 2.671754e+08 1.692663e+08 3.078594e+08 1.921081e+08 1.115871e+08 9.234105e+07 8.574812e+07 1.567973e+08 3.338209e+07 3.644046e+08 1.046732e+08 1.268300e+08 9.589006e+05 4.604018e+06 9.224790e+05 5.023790e+05 9.079035e+05 1.540013e+06 1.275293e+05 9.351283e+05 1.831575e+05 1.981599e+06 1.150254e+06 2.071442e+06 2.540723e+05 1.534857e+06 5.075306e+07 1.075686e+06 1.886999e+05 1.169235e+06 4.680398e+06 9.312360e+05 4.652369e+05 8.533594e+05 1.426868e+06 C11 H20 N2 O4_7.108 1.477290e+06 2.276698e+06 1.817600e+06 1.180080e+06 4.073985e+05 7.617716e+05 1.346564e+06 1.599255e+06 229616.03 1.812914e+06 1.373612e+06 2.028155e+06 217548.33 9.607661e+05 2.043709e+06 1.447618e+06 1.763604e+05 1.343205e+06 1.440553e+06 1.743783e+06 1.564437e+05 1.118139e+06 2.140944e+06 1.205914e+06 25628.220 1.378586e+06 1.543696e+06 1.520314e+06 1.717992e+04 1.638896e+06 1.457239e+06 1.712460e+06 103245.57 1.632512e+06 1.488556e+06 1.399844e+06 1.033045e+05 1.469067e+06 1.576700e+06 1.813396e+06 1.030409e+05 1.104963e+06 1.561216e+06 1.958682e+06 1.137822e+05 1.324501e+06 1.648805e+06 1.360247e+06 6.893002e+05 2.028120e+06 1.611591e+06 3.505671e+06 4.377218e+05 1.882110e+06 2.282299e+06 2.187773e+06 3.525643e+06 2.857108e+06 1.062915e+06 2.982326e+06 1.287766e+06 1.481492e+06 9.089796e+05 1.464050e+06 1.419978e+06 1.055401e+06 1.374660e+06 6.581349e+05 1.075825e+06 1.864905e+06 1.273134e+06 1.273464e+06 1.118798e+06 1.221176e+06 2.781053e+06 1.162193e+06 1.400314e+06 4.187548e+05 1.242648e+06 2.644182e+06 2.458217e+05 1.957242e+06 7.304388e+04 5.618808e+05 1.491914e+06 2.944247e+06 5.432762e+05 2.144901e+06 3.268673e+06 6.116098e+05 2.718929e+06 1.015469e+06 8.860169e+05 1.310071e+06 8.899083e+05 5.372646e+06 1.480698e+06 8.308569e+05 8.301739e+05 5.493003e+05 1.310684e+06 3.893762e+06 1.660199e+06 6.844749e+05 7.577954e+05 1.030104e+06 1.057420e+06 3.098724e+06 6.040145e+05 1.417583e+06 4.646322e+05 7.331349e+05 3.965722e+06 1.182240e+06 1.469846e+06 1.405386e+06 8.017130e+05 1.415905e+06 2.188448e+06 3.367267e+06 9.892674e+05 1.542589e+06 9.401768e+05 1.450951e+06 1.006464e+06 1.448608e+06 7.906622e+05 1.943959e+05 5.099491e+05 5.783032e+05 4.413832e+05 1.922968e+06 5.789235e+05 9.673400e+05 3.082945e+06 4.346075e+05 6.183438e+05 1.571130e+06 1.840340e+06 5.148263e+06 5.478558e+05 1.052939e+06 2.209073e+06 2.848397e+06 1.564742e+06 7.983100e+05 1.397899e+06 4.144572e+05 1.602956e+06 3.113551e+05 9.722508e+05 6.855838e+05 1.720889e+06 3.588741e+06 2.105966e+06 6.350837e+06 2.240179e+06 7.998452e+05 2.071053e+06 7.805946e+05 1.139796e+06 2.416376e+06 6.558722e+06 2.308450e+06 1.700938e+06 3.326156e+06 1.165131e+06 2.140645e+06 2.134731e+06 9.588058e+05 3.533401e+06 3.673705e+06 1.797749e+06 6.033140e+05 1.700465e+06 1.053191e+06 1.497098e+06 1.649697e+06 1.558397e+06 6.851445e+05 9.139386e+04 6.945217e+05 5.085241e+05 2.342969e+05 1.630971e+06 4.220420e+05 1.487844e+06 2.521708e+06 6.644828e+05 5.317491e+06 5.904219e+05 1.511980e+06 1.078920e+05 5.712707e+05 3.440514e+05 1.540594e+06 4.127466e+06 1.032645e+06 2.374236e+05 5.797901e+05 9.536102e+05 2.570030e+06 8.657935e+05 3.708725e+06 2.026257e+06 4.649147e+05 1.874540e+06 5.891122e+05 1.769436e+06 1.270569e+06 1.378020e+06 7.767810e+05 3.523773e+05 3.019337e+06 3.624846e+06 1.171884e+06 5.325888e+05 1.218806e+06 5.529336e+05 9.086943e+05 1.088632e+06 1.902890e+06 1.906423e+06 3.670274e+06 1.049438e+06 3.658779e+06 4.515268e+05 3.168603e+06 6.485928e+05 1.911292e+06 2.758914e+05 1.475631e+06 8.896747e+05 8.165639e+05 1.337408e+06 2.850252e+06 3.378812e+06 1.027201e+06 1.580811e+06 2.812679e+06 8.588953e+05 5.634539e+05 6.720474e+05 2.673543e+06 2.272537e+05 1.064714e+06 1.125780e+06 1.848842e+06 1.057208e+06 8.627682e+05 4.489112e+06 3.066080e+06 7.783488e+05 9.697815e+05 9.243229e+05 1.465438e+06 3.997878e+05 3.080608e+06 1.028674e+06 3.198850e+06 3.699481e+06 1.210936e+06 C4 H6 N6 O4_7.109 2.008553e+08 2.340068e+07 2.115687e+07 1.859298e+07 6.855860e+05 1.712965e+07 2.507803e+07 2.686040e+07 378181.83 3.071301e+07 1.987353e+07 2.788060e+07 448016.65 1.587171e+07 2.730873e+07 1.876531e+07 4.272934e+05 2.241286e+07 2.137207e+07 1.884616e+07 3.788243e+05 2.483027e+07 2.883202e+07 2.269752e+07 61348.616 2.104874e+07 2.516362e+07 2.519242e+07 4.688095e+04 1.916205e+07 2.294511e+07 2.440497e+07 303122.31 2.124605e+07 2.588535e+07 2.443688e+07 2.988002e+05 1.965363e+07 2.506671e+07 2.679125e+07 3.005241e+05 1.475802e+07 2.743042e+07 2.540160e+07 3.051203e+05 1.940601e+07 2.047662e+07 2.582358e+07 4.137598e+07 2.965168e+07 4.127315e+07 7.828448e+07 3.562245e+07 5.285971e+07 6.354774e+07 5.022365e+07 4.588457e+07 5.563730e+07 5.681934e+07 4.708413e+07 4.812227e+07 5.628748e+07 3.440891e+07 5.588214e+07 4.470903e+07 4.024718e+07 4.077946e+07 4.836589e+07 3.697662e+07 3.197852e+07 8.319268e+07 4.826492e+07 3.772518e+07 4.433827e+07 5.128038e+07 3.168666e+07 3.908895e+07 3.681100e+07 7.338853e+07 3.108487e+07 3.539752e+07 2.886752e+07 3.735210e+07 3.914484e+07 4.672259e+07 3.088559e+07 3.017788e+07 2.361211e+07 5.429843e+07 2.980195e+07 3.537270e+07 5.878949e+07 5.084141e+07 3.405731e+07 4.066229e+07 1.012195e+08 4.219388e+07 3.025123e+07 4.359456e+07 3.356041e+07 1.682360e+07 4.736339e+07 8.615297e+07 6.745653e+07 3.524489e+07 4.735633e+07 4.864023e+07 3.679016e+07 5.747969e+07 3.902551e+07 2.463166e+07 3.999259e+07 6.671551e+07 4.432191e+07 2.607534e+07 5.001430e+07 3.601088e+07 5.254283e+07 2.979095e+07 3.111487e+07 5.287238e+07 4.125825e+07 2.511413e+07 4.301103e+07 6.227773e+07 4.553015e+07 7.180014e+07 3.691950e+07 3.973154e+07 5.247115e+07 3.857212e+07 7.164901e+07 2.000048e+07 1.684860e+07 4.646147e+07 3.406324e+07 2.425444e+07 2.762989e+07 2.526662e+07 5.243259e+07 6.440464e+07 7.575925e+07 3.234996e+07 5.333105e+07 5.130633e+07 4.203687e+07 4.724351e+07 3.073807e+07 2.661327e+07 2.458725e+07 1.891454e+07 5.301452e+07 7.590816e+07 3.182743e+07 5.028668e+07 8.821454e+07 4.812844e+07 6.670209e+07 6.489554e+07 2.473258e+07 2.868629e+07 9.127832e+07 8.390310e+07 4.484047e+07 5.527744e+07 2.331996e+07 3.249291e+07 3.436402e+07 3.864009e+07 3.699187e+07 3.509658e+07 7.186807e+07 9.237676e+07 3.483631e+07 2.288802e+07 5.343498e+07 4.781550e+07 3.725965e+07 3.957011e+07 3.179834e+07 3.816855e+06 1.781188e+07 1.069196e+07 1.289434e+07 1.184502e+07 1.077405e+07 9.306217e+06 1.245796e+07 3.193869e+06 1.725981e+07 4.951589e+06 6.669064e+06 2.484552e+07 1.830449e+07 2.419155e+06 7.215230e+06 1.613752e+07 1.091973e+07 1.064995e+07 9.582182e+06 2.357286e+07 9.725718e+06 2.729595e+07 2.537334e+07 9.804272e+06 1.154705e+07 1.651965e+07 4.838248e+06 1.394222e+07 7.301439e+06 1.290563e+07 1.495501e+07 1.320032e+07 1.167212e+07 9.669433e+06 1.099219e+07 4.797643e+06 9.752280e+06 8.159239e+06 1.490000e+07 9.430932e+06 1.576907e+07 1.127676e+07 9.099573e+06 9.996149e+06 7.540598e+06 1.593613e+07 5.272138e+06 6.280826e+06 1.939115e+07 1.231047e+07 1.041201e+07 1.297809e+07 1.385574e+07 1.653267e+07 1.119561e+07 1.806456e+07 1.492590e+07 8.750107e+06 4.213293e+07 3.458354e+07 4.051119e+07 6.361923e+07 4.647442e+07 4.916374e+07 4.413671e+07 4.350814e+07 5.289257e+07 6.161618e+07 3.094974e+07 8.953902e+07 4.886032e+07 4.967964e+07 1.112815e+08 7.999515e+07 3.200645e+07 1.132786e+08 4.256302e+07 4.444659e+07 4.064359e+07 5.121533e+07 3.273058e+07 C10 H18 N2 O3_7.11 5.613205e+06 1.721948e+06 2.279292e+06 1.728018e+06 3.971423e+05 1.692973e+06 1.937400e+06 2.362967e+06 314518.07 2.128437e+06 1.743437e+06 2.203074e+06 382563.13 1.605153e+06 1.997339e+06 1.835437e+06 3.429943e+05 2.066738e+06 1.829788e+06 1.633777e+06 2.958943e+05 1.756736e+06 2.161240e+06 2.569228e+06 48220.092 1.656230e+06 1.872592e+06 1.967870e+06 3.858522e+04 2.006978e+06 1.895179e+06 1.780041e+06 261477.97 1.874428e+06 1.958495e+06 1.998297e+06 2.498233e+05 1.952811e+06 2.112135e+06 2.082144e+06 2.467846e+05 1.363385e+06 1.992564e+06 2.120655e+06 2.565169e+05 2.211407e+06 1.858291e+06 1.798639e+06 1.944562e+06 1.497660e+06 1.142571e+06 2.625368e+06 2.618670e+06 1.556979e+06 4.301719e+06 2.385652e+06 2.682101e+06 3.252952e+06 4.631696e+06 3.303354e+06 3.376781e+06 3.850280e+06 3.020891e+06 2.636510e+06 2.246342e+06 1.680224e+06 1.268841e+06 2.224192e+06 1.758796e+06 1.643314e+06 5.544384e+06 1.508376e+06 1.780580e+06 1.499827e+06 2.148837e+06 2.350419e+06 2.158302e+06 3.131897e+06 7.029858e+06 3.060038e+06 2.359053e+06 2.065491e+06 2.028570e+06 1.778836e+06 2.116890e+06 2.915163e+06 1.723997e+06 2.597502e+06 1.882573e+06 1.899659e+06 1.470165e+06 1.544319e+06 1.594258e+06 1.485367e+06 1.897474e+06 2.621201e+06 2.074342e+06 3.422287e+06 1.428535e+06 2.539194e+06 1.055607e+06 2.315094e+06 2.337100e+06 2.352189e+06 1.043826e+06 2.066875e+06 1.477867e+06 2.052561e+06 2.539984e+06 1.968911e+06 9.780214e+05 1.408543e+06 1.742724e+06 1.251798e+06 1.233388e+06 1.994995e+06 1.508351e+06 2.769204e+06 2.373545e+06 2.415569e+06 1.456182e+06 1.894236e+06 9.513142e+05 1.400736e+06 1.467987e+06 1.878101e+06 1.500457e+06 1.951612e+06 2.588243e+06 2.971083e+06 4.785713e+06 1.939050e+06 1.355844e+06 1.675022e+06 1.986357e+06 1.225349e+06 1.670962e+06 2.118154e+06 1.665443e+06 1.808892e+06 3.202712e+06 1.493894e+06 1.283761e+06 2.039160e+06 1.521989e+06 1.001585e+06 1.151022e+06 1.884623e+06 1.219651e+06 8.318714e+05 7.220613e+05 1.239145e+06 1.969314e+06 2.880901e+06 1.882713e+06 2.213750e+06 1.827747e+06 1.209180e+06 1.512674e+06 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2.071327e+06 1.227670e+06 1.730382e+06 1.604878e+06 2.571236e+06 1.984869e+06 1.399226e+06 2.509858e+06 2.557079e+06 1.268448e+06 1.685102e+06 2.062845e+06 3.630220e+06 1.851049e+06 2.217254e+06 2.732797e+06 1.651089e+06 2.382695e+06 2.468953e+06 1.673029e+06 2.812987e+06 3.168324e+06 3.085722e+06 1.482479e+06 3.098263e+06 2.386818e+06 C5 H14 Cl N5 O2_7.114 6.146312e+06 1.206171e+06 1.815071e+06 1.621947e+06 3.298741e+05 1.557105e+06 1.589809e+06 1.408559e+06 300260.82 2.062719e+06 1.566197e+06 1.794420e+06 210605.78 1.390432e+06 1.792430e+06 1.467507e+06 1.668391e+05 1.627822e+06 1.509154e+06 1.316883e+06 1.280327e+05 1.599213e+06 1.930674e+06 1.746226e+06 31152.520 1.580111e+06 1.642002e+06 1.577002e+06 2.321887e+04 1.378643e+06 1.724967e+06 1.665328e+06 100996.67 1.541114e+06 1.696843e+06 1.552889e+06 9.262271e+04 1.413341e+06 1.813447e+06 1.872630e+06 9.060631e+04 1.165731e+06 1.808868e+06 1.841005e+06 1.020264e+05 1.424119e+06 1.423885e+06 1.705154e+06 1.297926e+06 1.850728e+06 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6.876880e+06 5.751339e+06 5.478546e+06 1.793852e+05 6.725719e+06 7.786132e+06 7.751415e+06 20084.547 6.236672e+06 6.475328e+06 6.419148e+06 4.964692e+04 6.154394e+06 6.897502e+06 7.008545e+06 104742.60 6.497669e+06 6.567123e+06 6.242629e+06 9.913022e+04 6.404945e+06 7.445142e+06 7.624412e+06 9.863457e+04 4.751539e+06 7.014146e+06 7.621793e+06 1.091725e+05 6.429353e+06 5.931808e+06 6.848718e+06 7.835998e+06 7.179381e+06 8.251416e+06 1.040905e+07 7.373287e+06 6.842621e+06 1.135341e+07 1.061797e+07 1.214472e+07 1.291632e+07 1.334373e+07 1.316481e+07 1.007999e+07 1.228434e+07 9.331950e+06 1.036077e+07 7.652449e+06 5.467001e+06 6.462845e+06 6.762729e+06 3.931663e+06 6.986637e+06 1.122035e+07 7.033317e+06 1.314048e+07 5.221147e+06 9.091562e+06 6.648840e+06 7.374573e+06 6.902260e+06 1.009545e+07 6.799527e+06 6.094128e+06 5.311740e+06 6.319794e+06 4.830000e+06 5.596324e+06 6.554097e+06 5.093531e+06 3.767436e+06 7.953800e+06 4.820573e+06 7.158474e+06 5.197999e+06 6.075447e+06 3.732107e+06 5.655960e+06 7.648512e+06 7.627005e+06 6.951931e+06 5.418274e+06 4.363695e+06 3.483825e+06 5.519613e+06 6.394184e+06 6.413342e+06 3.925331e+06 5.800187e+06 5.629528e+06 6.801143e+06 8.527022e+06 7.636600e+06 3.387670e+06 6.286856e+06 6.155287e+06 7.574221e+06 3.830901e+06 4.496296e+06 7.876072e+06 6.841192e+06 6.030497e+06 1.025134e+07 4.948739e+06 5.092527e+06 3.137309e+06 5.204838e+06 6.104190e+06 7.293653e+06 7.171531e+06 5.710977e+06 5.115195e+06 4.788055e+06 9.500620e+06 9.328707e+06 5.394980e+06 4.476459e+06 6.893339e+06 4.342332e+06 6.267773e+06 6.222278e+06 6.769725e+06 6.850926e+06 7.735018e+06 7.551180e+06 5.265998e+06 6.304543e+06 7.672278e+06 6.889432e+06 6.535431e+06 6.494210e+06 4.145455e+06 3.153264e+06 4.293648e+06 5.331526e+06 5.523481e+06 8.231797e+06 5.620952e+06 8.557960e+06 6.452333e+06 7.011013e+06 4.773484e+06 4.600212e+06 6.309469e+06 7.248315e+06 7.464871e+06 6.253217e+06 5.676609e+06 8.436556e+06 7.505060e+06 8.544007e+06 7.099941e+06 7.530976e+06 8.251834e+06 8.105887e+06 5.939416e+06 8.292984e+06 8.411611e+06 4.818424e+06 6.832524e+06 6.162039e+06 8.454279e+06 3.759754e+06 3.868332e+06 4.972260e+06 4.740738e+06 4.210664e+06 5.016099e+06 8.805419e+06 4.572151e+06 7.051454e+06 5.620914e+06 7.939758e+06 4.549258e+06 4.742580e+06 4.113823e+06 6.319539e+06 3.147835e+06 4.539293e+06 1.016810e+07 6.773694e+06 6.596938e+06 6.221013e+06 1.209420e+07 8.624211e+06 4.284667e+06 9.030185e+06 5.210431e+06 4.421503e+06 6.780805e+06 5.815804e+06 6.621586e+06 4.846162e+06 7.564886e+06 7.693975e+06 8.051477e+06 5.938197e+06 7.876948e+06 6.782560e+06 4.673527e+06 5.365072e+06 5.103022e+06 6.347095e+06 5.517439e+06 5.478052e+06 7.894390e+06 4.626068e+06 8.445864e+06 4.017126e+06 5.659809e+06 6.082994e+06 5.064993e+06 8.392858e+06 7.502600e+06 6.418260e+06 7.450502e+06 5.870389e+06 7.090080e+06 4.181723e+06 7.132221e+06 6.253781e+06 7.227628e+06 8.239753e+06 1.064811e+07 5.171066e+06 7.931890e+06 9.389082e+06 5.580775e+06 7.733978e+06 6.172081e+06 6.176304e+06 6.406384e+06 6.050517e+06 1.063770e+07 8.580384e+06 6.346064e+06 1.131583e+07 7.786133e+06 7.455051e+06 5.712015e+06 6.857684e+06 7.498153e+06 5.865610e+06 7.545636e+06 8.553464e+06 C8 H18 N2 O_7.131 4.980967e+06 1.875963e+05 9.676645e+04 1.476889e+05 2.178341e+05 1.117785e+05 1.824229e+05 1.575142e+05 120415.97 1.692443e+05 9.799233e+04 1.937335e+05 122575.92 8.836676e+04 1.797983e+05 1.713033e+05 1.251555e+05 1.146856e+05 8.216013e+04 1.586132e+05 9.802147e+04 1.118913e+05 1.631711e+05 1.884491e+05 16337.113 1.055806e+05 1.831225e+05 1.258954e+05 1.389635e+04 1.049535e+05 1.556331e+05 1.570223e+05 104430.06 1.460764e+05 1.144096e+05 1.915900e+05 1.177601e+05 9.341041e+04 1.326423e+05 1.953162e+05 1.193747e+05 9.454362e+04 1.263505e+05 1.654508e+05 1.144981e+05 1.518632e+05 1.318873e+05 1.109618e+05 4.455850e+04 3.450543e+04 6.030042e+04 7.095227e+04 8.536213e+04 5.179404e+04 1.909512e+05 8.628793e+04 4.214983e+04 5.186671e+04 1.579245e+05 6.389011e+05 5.250455e+04 1.543476e+06 1.248295e+05 7.221809e+04 6.032403e+04 8.235184e+04 4.080736e+04 4.653153e+04 8.147832e+04 2.694237e+06 5.974043e+05 4.580709e+04 4.979954e+04 2.940855e+04 2.525716e+05 5.847966e+04 5.054315e+04 4.467200e+04 6.200112e+04 6.009711e+04 3.883852e+04 3.468942e+04 5.469292e+05 3.610533e+04 3.815937e+04 4.047511e+04 1.798015e+05 6.598292e+04 9.655570e+04 6.051695e+04 1.074565e+05 5.093640e+04 5.735282e+04 4.885512e+04 4.809012e+05 9.080536e+04 5.703141e+04 5.389093e+04 5.174531e+04 8.456417e+04 4.379906e+04 3.859184e+05 6.432835e+04 5.312968e+04 4.561855e+04 4.083053e+04 4.999017e+04 6.727371e+04 5.268509e+04 4.334208e+04 5.303079e+04 7.468795e+04 7.958176e+04 8.788108e+04 3.329459e+04 2.021540e+05 3.456035e+04 6.433283e+04 8.248516e+04 1.191014e+06 4.794915e+04 5.414499e+04 8.650259e+04 1.277404e+06 1.046703e+06 4.637098e+04 1.112235e+05 4.148786e+04 9.534599e+04 1.850546e+06 5.351945e+06 3.906769e+06 4.954691e+04 1.181800e+06 3.590966e+04 3.395128e+04 5.064666e+04 2.348345e+05 1.215276e+06 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9.205907e+05 6.833001e+05 9.857912e+05 8.343407e+05 1.197522e+06 1.264791e+06 6.498382e+06 9.950632e+05 1.118713e+06 7.556637e+05 1.457670e+05 1.873563e+05 1.591560e+06 1.151180e+06 3.233672e+05 1.086096e+06 1.311652e+06 1.029877e+06 1.167859e+06 2.559264e+06 2.456144e+05 1.740010e+06 1.464794e+06 3.314646e+05 1.016901e+05 1.582011e+06 1.465538e+05 1.646699e+05 3.370213e+05 3.193212e+05 2.797327e+06 3.719539e+05 4.271752e+05 5.687202e+05 1.526899e+06 1.813513e+05 2.882092e+05 5.053952e+05 1.568515e+06 1.740742e+06 1.723268e+06 7.001321e+06 1.924949e+06 1.278677e+06 2.387329e+06 1.893351e+06 1.489894e+05 1.465113e+06 1.393113e+06 1.602799e+06 1.887840e+05 1.728326e+06 1.425230e+05 2.129179e+06 2.410365e+06 3.246885e+05 2.101530e+06 1.814072e+06 3.446175e+05 3.121104e+05 2.264967e+05 2.375005e+06 2.665634e+05 3.232017e+05 1.955042e+05 2.056229e+05 2.595071e+05 2.062030e+06 3.496619e+05 3.282602e+05 4.371486e+05 7.066234e+04 1.502159e+05 8.263459e+04 1.571099e+05 3.110046e+05 5.333012e+05 1.119976e+05 1.552060e+05 2.020173e+05 1.728814e+05 9.630315e+04 8.568526e+04 1.875696e+05 5.381040e+04 1.203862e+05 2.046627e+05 2.415099e+05 2.533240e+05 1.595247e+06 9.670021e+04 1.494717e+05 3.898874e+06 4.772664e+05 2.782675e+05 1.834522e+05 6.766501e+04 2.500232e+06 C14 H27 O P S_7.149 2.005461e+05 8.860193e+05 1.145660e+06 9.949709e+05 3.498815e+05 1.101655e+06 1.461684e+06 1.109414e+06 221798.62 1.204065e+06 9.234599e+05 1.343430e+06 263167.93 9.505338e+05 1.173725e+06 1.149991e+06 2.625863e+05 1.129431e+06 9.462209e+05 9.520847e+05 2.027175e+05 1.069095e+06 1.239755e+06 1.305868e+06 33919.475 1.088365e+06 1.009182e+06 1.075337e+06 2.631471e+04 1.192662e+06 1.260760e+06 1.115766e+06 165008.60 1.013596e+06 9.736604e+05 1.039304e+06 1.643022e+05 1.152693e+06 1.300598e+06 1.279240e+06 1.630987e+05 7.715068e+05 1.144188e+06 1.287747e+06 1.818215e+05 1.164564e+06 9.128483e+05 1.169721e+06 4.730913e+05 1.056981e+06 1.326682e+06 1.611667e+06 9.876723e+05 1.279875e+06 1.885989e+06 1.534399e+06 1.981801e+06 1.339145e+06 3.358471e+06 4.354620e+05 2.149496e+06 3.493565e+06 2.551141e+06 3.337758e+06 1.015871e+06 8.285478e+05 7.522238e+05 1.465595e+06 1.095713e+06 1.148191e+06 6.758080e+05 1.554943e+06 2.328659e+06 9.169960e+05 1.949576e+06 5.687713e+05 1.112400e+06 7.286648e+05 2.561840e+05 1.007993e+06 6.493437e+05 9.361641e+05 1.164355e+06 8.948386e+05 5.696251e+05 8.186990e+05 6.729341e+05 2.369664e+05 1.058502e+06 7.947820e+05 1.379220e+06 9.215797e+05 2.938124e+06 1.266761e+06 1.230772e+06 6.000088e+05 9.950984e+05 5.334403e+05 2.128657e+05 7.496367e+05 8.355685e+05 5.109485e+05 4.323826e+05 9.527952e+05 8.688930e+05 1.407651e+06 7.042982e+05 1.877573e+06 3.550905e+05 4.572605e+05 3.245091e+05 1.712709e+06 1.100228e+06 7.443806e+05 3.073480e+05 6.907075e+05 1.001465e+06 4.971991e+05 5.693499e+05 1.065284e+06 6.716694e+05 9.419407e+05 2.092806e+05 8.517442e+04 7.045532e+05 8.324820e+05 1.689792e+06 6.547545e+05 8.363454e+05 8.797615e+05 1.144986e+06 1.940706e+05 6.630859e+05 3.858215e+05 6.529964e+05 5.695953e+05 8.391885e+05 5.836813e+05 6.813897e+05 1.421862e+06 5.453338e+05 1.710657e+05 1.128914e+06 4.607069e+05 5.942916e+05 3.609727e+05 2.517794e+05 4.066982e+05 1.119680e+05 1.242781e+06 6.995436e+05 2.434346e+06 1.190158e+06 2.208718e+06 7.526636e+05 1.853995e+06 4.130746e+06 5.567761e+06 3.480170e+06 5.784724e+05 1.083875e+06 1.353281e+06 8.729405e+05 7.292691e+05 1.219242e+06 9.984504e+05 4.567179e+05 7.353220e+05 1.166279e+06 1.071666e+06 4.456375e+05 9.443853e+05 1.252991e+06 1.065529e+06 9.590152e+05 5.186933e+05 9.637970e+05 7.282665e+05 2.696809e+06 2.501696e+05 1.342361e+05 3.487778e+05 1.251351e+06 1.018935e+06 2.249333e+05 4.966637e+05 1.553856e+06 1.221129e+06 1.066812e+06 1.684764e+06 8.613667e+05 1.187772e+05 1.814953e+06 2.878679e+06 1.147071e+05 1.133534e+06 7.835039e+05 3.431044e+05 1.427733e+06 2.198856e+06 3.195437e+06 1.231252e+06 1.110110e+06 2.024521e+06 1.166484e+06 1.099573e+05 1.989996e+06 8.378888e+05 3.386684e+06 1.222525e+06 1.607646e+06 2.310815e+06 1.238648e+06 1.198353e+06 2.003737e+05 2.033568e+06 2.464024e+06 3.480222e+06 5.326456e+05 1.497635e+06 3.335559e+06 1.444606e+06 1.393933e+06 1.070058e+06 1.143699e+06 1.373069e+06 3.534595e+06 6.201123e+05 8.040929e+05 2.682097e+06 1.651017e+06 2.028317e+05 3.252588e+05 4.763822e+05 3.500997e+06 1.353389e+06 2.185749e+06 3.113873e+05 1.567867e+06 1.004691e+06 1.033750e+06 9.870164e+05 1.058031e+06 2.375280e+06 1.462056e+06 1.489597e+06 2.482658e+06 1.350778e+06 1.463402e+06 2.234240e+06 1.255181e+06 9.670527e+05 8.686654e+05 2.183449e+06 4.285801e+06 8.110485e+04 1.237877e+06 3.848429e+05 9.494795e+04 7.992926e+04 1.884582e+06 2.302358e+06 Piperidine (2)_7.18 1.110857e+07 5.283183e+08 6.012069e+08 2.798402e+08 1.298536e+06 6.057066e+08 5.477526e+08 6.291962e+08 1294390.51 6.522254e+08 1.564233e+08 6.664852e+08 300894.01 4.737655e+08 5.770412e+08 5.567095e+08 9.321042e+05 5.118104e+08 5.041668e+08 4.400714e+08 1.188273e+06 5.144472e+08 5.653774e+08 5.791715e+08 1132793.417 5.001148e+08 5.088790e+08 5.049722e+08 2.125134e+06 5.013231e+08 5.294118e+08 5.361599e+08 1229661.71 5.211202e+08 5.204043e+08 5.011689e+08 1.063345e+06 5.095811e+08 5.534668e+08 5.931508e+08 1.041803e+06 3.736694e+08 5.674608e+08 5.670374e+08 1.106239e+06 5.012829e+08 4.754387e+08 5.427352e+08 6.209340e+08 5.236165e+08 1.105489e+08 3.735186e+08 3.011524e+08 4.221528e+08 4.612040e+08 4.864923e+08 5.509366e+08 4.348675e+08 5.306498e+08 8.745390e+08 3.458189e+08 5.221194e+08 4.015351e+08 5.144103e+08 3.985604e+08 3.039146e+08 5.096416e+08 3.424764e+08 3.926223e+08 4.504120e+08 5.817471e+08 1.300980e+08 3.801608e+08 5.725226e+08 4.475912e+08 3.096801e+08 4.646960e+08 4.489596e+08 1.390460e+07 4.447544e+08 3.145671e+08 3.513641e+08 4.001965e+08 2.835820e+08 3.865812e+08 2.657368e+08 3.841131e+08 2.039055e+08 3.648361e+08 3.261157e+08 5.095011e+08 2.787776e+08 4.945674e+08 5.381520e+08 5.306738e+08 5.353561e+08 5.607299e+08 3.477272e+08 3.772774e+08 3.392270e+08 1.406831e+08 5.721383e+08 2.859182e+08 5.086500e+08 4.854507e+08 4.878707e+08 3.860913e+08 5.832298e+08 3.744590e+08 2.942968e+08 4.286625e+08 6.291117e+08 4.962067e+08 4.790873e+08 4.090838e+08 3.530988e+08 4.594253e+08 3.609551e+08 3.492519e+08 7.123922e+08 3.391490e+08 3.959194e+08 3.085727e+08 4.540660e+08 4.074141e+08 3.265859e+08 9.128042e+08 4.293972e+08 5.852897e+08 1.760846e+08 4.171011e+08 2.440562e+07 5.348893e+08 4.842302e+08 5.516583e+08 1.122248e+08 6.535218e+08 6.743820e+08 4.640243e+08 6.780484e+08 4.170461e+08 9.309406e+08 1.426081e+08 3.974422e+08 1.364181e+08 6.032657e+08 5.215194e+08 4.948099e+08 5.686026e+08 8.380802e+08 6.257768e+08 8.575242e+08 6.034348e+08 3.544472e+08 3.354695e+08 4.613277e+08 4.634959e+08 7.511181e+08 7.484998e+08 2.986351e+08 4.987643e+08 4.055125e+08 4.839765e+08 3.034097e+08 5.142361e+08 2.909094e+08 5.185677e+08 3.720637e+08 3.191183e+08 3.858499e+08 2.949445e+08 6.024177e+08 4.972412e+08 3.853621e+08 4.182528e+08 3.871394e+08 2.749025e+08 3.891756e+08 6.108778e+08 2.702170e+08 1.531858e+09 4.044863e+08 3.277457e+08 1.663899e+09 3.795804e+08 5.240612e+08 4.872289e+08 4.740623e+08 1.348588e+09 4.063770e+08 1.443206e+09 1.148293e+08 4.459677e+08 5.061189e+08 1.308593e+09 4.582516e+08 1.099263e+09 1.349514e+09 5.061670e+08 6.948963e+08 2.055975e+09 1.383877e+09 3.739096e+08 6.823175e+08 1.475428e+08 3.219816e+08 3.757034e+08 3.364180e+08 8.143343e+08 5.621030e+08 4.327960e+08 4.168682e+08 4.075714e+08 4.294094e+08 3.389679e+08 5.000665e+08 1.687594e+09 5.621851e+08 4.660702e+08 4.481455e+08 6.771823e+08 5.107633e+08 4.084836e+08 4.781033e+08 6.417214e+08 8.741254e+08 6.422866e+08 6.181866e+08 3.937782e+08 4.682779e+08 4.951198e+08 7.043218e+08 4.506670e+08 7.528212e+08 6.881155e+08 1.591485e+08 7.503139e+08 4.575793e+08 8.719185e+08 4.111366e+08 3.716865e+08 3.738064e+08 4.626525e+08 4.924229e+08 3.739374e+08 3.228451e+08 3.051486e+08 3.609182e+08 3.163645e+08 4.801235e+08 5.501709e+08 4.646130e+08 3.833391e+08 6.402458e+08 5.685818e+08 2.276520e+08 5.455830e+08 4.304688e+08 2.817715e+08 4.365657e+08 4.796352e+08 4.020078e+08 C22 H5 N7 O10 P2_7.184 1.103554e+05 4.020936e+05 7.641522e+05 5.767910e+05 1.687361e+05 5.057798e+05 4.689646e+05 6.009683e+05 194411.39 7.234558e+05 3.472657e+05 7.009399e+05 188711.81 4.981531e+05 5.661982e+05 3.815399e+05 1.804061e+05 7.979615e+05 4.508784e+05 5.697588e+05 1.632362e+05 4.897485e+05 6.484127e+05 5.964870e+05 34664.379 5.523310e+05 5.766701e+05 6.502219e+05 3.028707e+04 4.407673e+05 5.957396e+05 5.271164e+05 197167.12 4.380936e+05 5.006539e+05 6.286003e+05 1.880436e+05 5.381806e+05 7.143062e+05 6.331568e+05 1.829399e+05 3.784612e+05 5.730783e+05 7.395694e+05 2.429922e+05 4.318600e+05 4.560896e+05 6.089382e+05 3.226342e+05 7.884397e+04 1.542376e+05 1.308581e+05 2.136240e+05 1.149215e+05 1.630593e+05 2.808542e+05 9.426726e+04 9.609506e+04 1.852623e+05 1.421139e+05 1.541428e+05 1.648717e+05 1.832183e+05 1.161054e+05 1.071894e+05 1.730412e+05 8.680942e+04 1.049579e+05 9.966493e+04 1.395186e+05 1.191780e+05 1.749404e+05 1.671078e+05 1.514468e+05 1.423191e+05 1.335995e+05 1.349402e+05 1.319890e+05 1.082969e+05 1.101505e+05 1.066806e+05 1.141443e+05 9.422098e+04 8.871375e+04 8.698886e+04 1.152699e+05 1.459997e+05 9.253339e+04 8.433408e+04 7.964211e+04 1.804917e+05 1.124835e+05 8.882700e+04 1.071774e+05 1.190349e+05 1.057692e+05 1.157658e+05 1.251051e+05 3.653939e+05 1.331279e+05 1.167983e+05 3.847471e+05 8.433423e+04 3.002461e+05 1.068331e+05 1.428806e+05 1.193787e+05 1.117785e+05 8.959788e+04 1.075155e+05 1.147346e+05 8.890736e+04 1.339469e+05 1.575247e+05 8.660569e+04 1.012928e+05 1.081861e+05 1.606009e+05 1.905554e+05 1.379875e+05 1.049732e+05 1.231375e+05 9.876798e+04 1.691688e+05 1.137659e+05 9.435681e+04 1.206647e+05 1.774542e+05 1.628597e+05 2.588325e+05 9.711851e+04 1.063309e+05 1.526406e+05 1.444172e+05 1.252186e+05 1.109207e+05 1.776395e+05 1.483620e+05 1.086487e+05 1.337232e+05 1.195294e+05 1.160307e+05 1.641525e+05 1.249519e+05 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6.555436e+05 9.464876e+04 1.310957e+05 1.844950e+06 4.743359e+05 4.602698e+05 1.260250e+06 3.885805e+05 2.636511e+05 1.250411e+06 1.664864e+06 7.198118e+05 1.618218e+06 2.443086e+05 8.315884e+05 5.026902e+05 5.667051e+05 1.940040e+05 1.404268e+05 1.815267e+05 5.712224e+05 1.761030e+06 1.023052e+05 9.401863e+05 5.593789e+05 9.262995e+04 1.376126e+05 1.122438e+05 5.408471e+05 9.353495e+05 1.610053e+05 5.168156e+05 1.687254e+05 3.316920e+05 1.239264e+05 1.204031e+05 1.022862e+05 1.126551e+05 1.622143e+06 1.520133e+05 1.803847e+05 C10 H23 Cl N2_7.186 5.564239e+04 5.734191e+06 5.686832e+06 6.891434e+06 8.866187e+04 4.229709e+06 6.039686e+06 6.373725e+06 98415.10 5.886214e+06 5.082009e+06 6.715407e+06 100840.18 5.801274e+06 5.611258e+06 5.329737e+06 1.137839e+05 6.106624e+06 5.397246e+06 4.996871e+06 1.120981e+05 6.707993e+06 5.452145e+06 5.545712e+06 23580.333 6.170905e+06 5.801696e+06 5.653059e+06 1.796510e+04 6.136547e+06 6.117987e+06 5.337858e+06 101426.45 5.770442e+06 5.821369e+06 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5.299161e+07 3.499870e+07 4.073502e+07 4.996648e+07 8.796974e+07 4.078248e+07 6.533546e+07 5.059429e+07 3.838723e+07 6.538457e+07 3.265450e+07 4.375402e+07 4.513935e+07 2.989047e+07 8.942550e+07 6.812897e+07 4.133722e+07 4.143444e+07 5.026121e+07 6.296452e+07 5.114662e+07 7.974414e+07 4.810990e+07 2.891646e+07 4.699230e+07 6.145752e+07 3.361619e+07 3.792092e+07 6.818401e+07 7.360858e+07 4.199601e+07 5.187169e+07 4.880165e+07 6.372523e+07 4.650295e+07 4.769257e+07 6.663549e+07 5.791990e+07 7.588481e+07 5.960581e+07 3.122052e+07 7.168809e+07 6.383089e+07 3.947536e+07 3.365905e+07 6.143497e+07 4.906731e+07 C6 H8 N2 O2_7.218 1.934646e+07 3.017103e+06 2.891620e+06 3.608037e+06 1.884581e+05 3.569413e+06 5.610070e+06 2.951967e+06 180318.55 4.137411e+06 2.915615e+06 4.788329e+06 177899.53 2.786859e+06 3.500395e+06 3.157111e+06 1.704073e+05 3.767396e+06 3.335777e+06 3.759712e+06 1.411056e+05 3.706767e+06 3.916145e+06 4.032111e+06 28885.030 3.292237e+06 3.541910e+06 3.731445e+06 2.197923e+04 3.422557e+06 3.447385e+06 3.979655e+06 146246.80 3.541931e+06 3.519634e+06 3.631659e+06 1.375231e+05 3.194446e+06 4.224220e+06 3.972650e+06 1.242067e+05 2.987876e+06 3.469085e+06 4.698921e+06 1.429809e+05 3.134780e+06 2.978801e+06 3.937326e+06 2.624651e+06 3.856390e+06 1.134429e+06 1.395848e+07 4.987710e+06 1.353955e+06 2.327749e+07 3.627777e+06 6.076247e+06 4.084143e+06 1.032911e+07 7.273840e+06 9.210076e+05 2.650793e+06 9.272529e+06 5.140604e+06 3.779288e+06 5.111372e+06 1.135142e+06 2.268831e+06 3.782164e+06 5.897342e+06 2.691827e+06 1.074051e+06 7.654010e+06 1.323425e+06 4.768328e+06 1.124138e+07 2.642646e+06 5.324268e+05 4.573173e+07 8.100181e+06 6.210115e+06 2.135260e+06 5.425241e+06 2.388141e+06 2.411612e+06 1.696943e+06 3.407439e+06 2.834458e+06 1.280534e+06 2.876510e+05 5.039783e+06 4.574741e+06 6.754655e+06 5.935045e+05 2.089495e+06 1.448715e+06 4.003654e+06 3.778632e+06 3.560042e+06 7.490614e+05 7.769739e+05 3.361671e+06 1.695756e+06 4.785041e+06 1.712582e+06 7.397969e+06 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1.608538e+06 5.617067e+06 4.813558e+05 1.179634e+06 1.225650e+06 3.530669e+06 8.238537e+06 2.087755e+06 7.287850e+05 5.287729e+06 5.010023e+06 9.786074e+04 1.383382e+06 4.475603e+06 7.389973e+05 6.457894e+05 1.869499e+07 2.288784e+06 2.103705e+06 4.248085e+06 3.443474e+06 2.054670e+06 5.748064e+06 6.265563e+06 1.049155e+06 3.222401e+06 4.257810e+05 5.438260e+06 7.564436e+05 2.242140e+06 1.114982e+06 1.049793e+06 2.688947e+06 1.010903e+06 3.694709e+06 1.175377e+06 8.757115e+06 6.543229e+06 3.409642e+06 8.657849e+06 1.042939e+06 8.377370e+05 1.273127e+06 2.437887e+06 1.245895e+06 3.132471e+06 3.031190e+06 1.472332e+07 2.575568e+06 3.976569e+06 7.555662e+06 2.528516e+06 6.891390e+05 3.434821e+06 2.854155e+06 8.552204e+05 1.608144e+06 3.095910e+06 4.450182e+06 1.153493e+06 3.962129e+06 1.271364e+07 1.565193e+06 3.908655e+06 3.161451e+06 2.369194e+06 1.746924e+06 3.702117e+06 6.219072e+06 3.281927e+06 2.781422e+06 6.277742e+06 1.790038e+06 3.704477e+06 4.873562e+06 2.936409e+06 2.258494e+06 8.909193e+06 3.698730e+06 C8 H9 Cl N2 O3 S_7.222 4.634576e+07 2.392532e+07 3.033532e+07 1.682887e+07 2.770189e+05 2.700294e+07 1.860256e+07 1.411079e+07 297561.75 3.576174e+07 1.543921e+07 3.048160e+07 243415.41 2.182358e+07 2.709950e+07 2.371701e+07 2.191572e+05 2.083354e+07 2.392195e+07 2.006989e+07 1.995685e+05 2.341876e+07 2.829808e+07 2.783751e+07 43526.476 1.931547e+07 1.947759e+07 2.064396e+07 3.244189e+04 2.900613e+07 2.213756e+07 2.593827e+07 212504.25 2.287771e+07 2.290864e+07 2.318021e+07 2.358605e+05 2.585041e+07 2.364841e+07 2.696098e+07 1.919916e+05 1.316278e+07 2.465134e+07 2.485653e+07 1.870732e+05 2.798278e+07 2.243966e+07 2.235221e+07 2.475307e+07 1.382524e+07 2.103265e+07 3.008828e+07 2.807990e+07 2.612785e+07 3.210631e+07 2.803167e+07 2.195282e+07 2.221090e+07 3.227493e+07 2.053037e+07 1.658836e+07 3.071144e+07 3.233812e+07 2.720290e+07 2.379124e+07 2.489908e+07 1.531585e+07 1.847046e+07 2.337084e+07 2.578358e+07 2.907142e+07 2.158954e+07 1.744820e+07 1.925499e+07 2.441602e+07 2.268220e+07 2.065011e+07 2.090189e+07 4.365995e+07 1.912866e+07 1.483758e+07 2.546377e+07 2.142955e+07 1.658871e+07 1.849799e+07 1.944067e+07 2.460800e+07 2.725683e+07 1.964077e+07 2.336374e+07 2.490526e+07 2.480221e+07 1.735118e+07 1.700016e+07 1.865550e+07 3.124237e+07 3.291975e+07 1.804151e+07 1.555087e+07 1.520366e+07 2.458338e+07 3.319575e+07 2.539487e+07 2.141455e+07 8.798929e+06 1.702036e+07 2.749463e+07 2.066457e+07 2.121109e+07 2.311406e+07 1.976908e+07 2.101260e+07 3.258483e+07 2.610836e+07 1.776989e+07 2.627555e+07 2.717776e+07 2.890621e+07 2.628403e+07 2.435988e+07 2.348088e+07 2.692977e+07 1.602025e+07 2.290317e+07 1.982574e+07 2.043834e+07 2.834629e+07 1.798723e+07 3.189812e+07 3.260368e+07 2.063031e+07 2.432865e+07 1.650840e+07 2.648341e+07 1.881950e+07 1.389576e+07 1.593634e+07 1.657755e+07 2.306010e+07 2.980635e+07 2.885991e+07 2.326039e+07 2.527900e+07 2.690178e+07 2.299726e+07 1.798703e+07 2.056918e+07 2.770216e+07 2.304954e+07 2.291749e+07 2.185210e+07 2.377256e+07 3.261543e+07 2.291283e+07 3.022917e+07 4.195816e+07 2.632591e+07 3.125869e+07 2.672569e+07 1.609407e+07 2.027636e+07 2.055638e+07 1.985046e+07 2.604781e+07 2.081982e+07 9.323605e+06 2.340302e+07 2.490735e+07 2.191164e+07 2.629809e+07 1.928357e+07 1.755001e+07 3.647850e+07 2.461439e+07 2.096768e+07 2.036713e+07 1.952309e+07 2.488311e+07 3.020437e+07 1.533556e+07 1.135706e+07 1.561893e+07 1.293064e+07 2.238661e+07 1.934911e+07 1.792451e+07 1.552838e+07 2.813972e+07 1.544556e+07 2.282585e+07 1.303951e+07 1.876416e+07 5.818120e+06 3.146121e+07 1.231642e+07 1.198050e+07 2.815595e+07 2.151485e+07 2.481609e+07 1.963290e+07 2.814657e+07 1.961495e+07 2.455570e+07 2.707416e+07 1.400507e+07 2.365132e+07 1.872763e+07 1.341698e+07 2.471237e+07 1.186674e+07 2.142654e+07 1.666298e+07 2.426258e+07 1.243040e+07 1.697174e+07 2.310413e+07 1.840411e+07 1.852655e+07 1.488246e+07 2.989638e+07 2.391607e+07 2.507813e+07 2.528544e+07 1.476242e+07 2.353939e+07 1.084080e+07 2.293688e+07 2.150903e+07 8.503208e+06 2.124182e+07 2.448752e+07 1.892708e+07 2.358069e+07 1.963366e+07 3.092452e+07 2.150105e+07 3.998784e+07 2.298271e+07 1.571228e+07 2.100161e+07 2.045835e+07 1.792902e+07 1.859928e+07 2.188311e+07 3.043520e+07 2.154685e+07 2.963326e+07 2.266813e+07 2.129783e+07 1.628064e+07 2.870825e+07 3.433788e+07 3.881653e+07 4.423289e+07 2.075182e+07 9.840805e+06 4.544345e+07 2.636153e+07 1.757523e+07 1.802816e+07 2.804984e+07 2.883110e+07 VALINE 1.802582e+09 8.727922e+08 9.343976e+08 9.281907e+08 2.507480e+05 9.788089e+08 9.377379e+08 8.757234e+08 373216.83 1.201591e+09 7.521495e+08 1.214441e+09 333292.75 7.523717e+08 9.388135e+08 9.929779e+08 2.983716e+05 9.008882e+08 9.045038e+08 8.867236e+08 1.931597e+05 9.760366e+08 1.030922e+09 1.022240e+09 41830.834 8.345416e+08 9.586027e+08 9.176298e+08 2.973716e+05 9.072769e+08 9.321882e+08 1.001106e+09 209441.98 9.658382e+08 9.433347e+08 9.325952e+08 2.395086e+05 9.832481e+08 9.838955e+08 9.591179e+08 2.781870e+05 7.925897e+08 9.611708e+08 9.419129e+08 2.123525e+05 9.640607e+08 8.535994e+08 1.035821e+09 8.022459e+08 1.498390e+08 8.152783e+08 1.309466e+09 9.150019e+08 8.515640e+08 1.304781e+09 1.276805e+09 8.890064e+08 8.781786e+08 1.482510e+09 9.766496e+08 6.190959e+08 1.275765e+09 1.164060e+09 9.541875e+08 1.084977e+09 9.402669e+08 7.633856e+08 7.781604e+08 1.387562e+09 9.536972e+08 9.217135e+08 3.871478e+08 8.277604e+08 7.165358e+08 9.578741e+08 9.315005e+08 1.158261e+09 8.322520e+08 1.735990e+09 9.588939e+08 1.147061e+09 9.426453e+08 7.855102e+08 8.029588e+08 6.305243e+08 8.614047e+08 9.134618e+08 1.087885e+09 9.273071e+08 8.805339e+08 9.053194e+08 1.410487e+09 6.554054e+08 1.050648e+09 1.119174e+09 1.400365e+09 1.402573e+09 1.157411e+09 6.854109e+08 7.652592e+08 9.132090e+08 1.076279e+09 1.023708e+09 9.187488e+08 3.313793e+08 9.596238e+08 1.263013e+09 9.078884e+08 7.697361e+08 9.303280e+08 6.618651e+08 7.207922e+08 1.133741e+09 1.001367e+09 5.821025e+08 4.809767e+08 1.007966e+09 1.408809e+09 1.096144e+09 1.093486e+09 9.667634e+08 1.191158e+09 6.010447e+08 8.962210e+08 8.233196e+08 8.332941e+08 7.990234e+08 8.057746e+08 1.074607e+09 9.007648e+08 8.100160e+08 1.025338e+09 5.314678e+08 8.874188e+08 1.177987e+09 4.831417e+08 4.713303e+08 9.494083e+08 1.021526e+09 9.710518e+08 1.006238e+09 8.346789e+08 9.196707e+08 1.217608e+09 9.617791e+08 6.313195e+08 9.298034e+08 8.970595e+08 1.001006e+09 7.928641e+08 7.450564e+08 9.453912e+08 1.247893e+09 9.252112e+08 1.147296e+09 1.252384e+09 8.906398e+08 8.269456e+08 8.389305e+08 5.933437e+08 7.607092e+08 9.766224e+08 8.333274e+08 1.005290e+09 7.795626e+08 6.018526e+08 1.205689e+09 1.081777e+09 7.653845e+08 1.139383e+09 8.578349e+08 9.538504e+08 1.402729e+09 1.027177e+09 9.503593e+08 7.777949e+08 9.367273e+08 1.155610e+09 1.176222e+09 7.413125e+08 4.587202e+08 7.355825e+08 8.948864e+08 7.895908e+08 7.998291e+08 7.129134e+08 5.906014e+08 1.116398e+09 4.048407e+08 1.027890e+09 5.027952e+08 9.424934e+08 5.029674e+08 1.229074e+09 4.902815e+08 9.793056e+08 1.560830e+09 9.113701e+08 8.221234e+08 1.122635e+09 1.293700e+09 9.100237e+08 9.837226e+08 1.318326e+09 1.131031e+09 9.000718e+08 8.410570e+08 4.171568e+08 7.859797e+08 2.237889e+08 8.996278e+08 6.917644e+08 1.128478e+09 8.020722e+08 6.690007e+08 1.114256e+09 7.683551e+08 8.036119e+08 9.274431e+08 9.313415e+08 8.843055e+08 1.345637e+09 7.951183e+08 7.828228e+08 1.001542e+09 4.940990e+08 8.669168e+08 9.720977e+08 5.548392e+08 1.571041e+09 1.055415e+09 8.564130e+08 8.348136e+08 1.210040e+09 1.146073e+09 7.628466e+07 1.571599e+09 1.047144e+09 5.819793e+08 3.613707e+08 1.166031e+09 8.566333e+08 7.020220e+08 1.828218e+08 1.432602e+09 8.843594e+08 1.047455e+09 9.738071e+08 8.432584e+08 5.744932e+08 9.199373e+08 1.166783e+09 1.157230e+09 1.345814e+09 4.841219e+08 2.175278e+08 1.374381e+09 1.166449e+09 7.339270e+08 6.893531e+08 9.426443e+08 8.826442e+08 3-Buten-1-amine_7.223 3.395901e+08 1.592056e+08 6.180812e+07 1.556335e+08 1.877771e+06 2.175003e+08 1.729017e+08 4.571303e+07 1581896.55 2.055041e+08 9.763882e+07 1.977956e+08 1574535.38 1.255779e+08 1.540320e+08 1.573898e+08 7.358424e+05 1.384079e+08 1.371708e+08 1.431974e+08 7.771253e+05 1.328954e+08 1.662254e+08 1.381188e+08 709528.508 1.535501e+08 1.441817e+08 1.321252e+08 6.330360e+05 1.343641e+08 1.409885e+08 1.827143e+08 630051.76 1.378384e+08 1.386806e+08 1.381639e+08 7.753582e+05 1.335685e+08 1.553832e+08 1.764283e+08 6.183364e+05 1.117173e+08 1.465719e+08 1.539061e+08 7.040619e+05 1.324791e+08 1.484684e+08 1.454293e+08 1.371025e+08 2.087922e+07 1.411529e+08 2.013820e+08 1.401072e+08 1.305687e+08 2.079498e+08 2.318279e+08 1.226741e+08 1.423503e+08 2.144145e+08 1.588209e+08 9.821256e+07 2.020405e+08 8.046439e+07 1.601917e+08 1.552001e+08 1.670665e+08 2.254622e+07 1.133596e+08 1.823795e+08 1.176786e+08 1.941318e+08 1.531878e+08 1.484486e+08 1.018985e+08 1.512721e+08 1.203884e+08 1.478928e+08 1.381083e+08 2.677096e+08 1.777101e+08 1.634484e+08 1.469629e+08 1.164381e+08 1.112024e+08 1.021750e+08 1.363317e+08 1.474593e+08 1.823603e+08 1.492281e+08 1.324853e+08 1.460229e+08 2.086977e+08 1.027756e+08 2.104140e+08 1.181059e+08 1.973075e+08 1.938591e+08 1.399727e+08 1.108693e+08 1.770168e+08 1.221711e+08 1.719271e+08 1.630703e+08 1.467556e+08 9.021198e+07 1.421133e+08 1.536521e+08 1.562195e+08 1.145940e+08 1.427505e+08 1.008340e+08 1.047910e+08 1.764066e+08 1.589248e+08 1.070853e+08 1.075042e+08 1.419113e+08 1.633997e+08 1.684481e+08 1.510548e+08 1.493565e+08 1.861796e+08 2.405024e+07 1.321923e+08 1.282928e+08 1.278676e+08 1.573883e+08 1.472811e+08 1.742409e+08 1.633968e+08 1.240494e+08 1.678907e+08 8.973922e+07 1.375704e+08 1.736055e+08 7.914124e+07 1.594140e+08 1.510269e+08 1.344750e+08 1.509791e+08 1.742442e+08 1.593370e+08 3.024106e+07 1.377276e+08 2.308079e+08 1.032017e+08 1.501286e+08 1.705723e+08 1.788813e+08 1.151227e+08 1.226029e+08 1.184957e+08 2.353168e+08 1.430964e+08 1.742580e+08 2.438693e+08 1.436456e+08 1.605445e+08 1.405527e+08 1.000108e+08 1.118777e+08 1.277449e+08 1.265415e+08 1.448344e+08 1.106893e+08 9.413424e+07 1.481224e+08 2.272595e+08 1.197577e+08 1.636838e+08 1.657674e+08 1.475207e+08 1.865630e+08 1.495567e+08 1.464036e+08 1.556541e+08 1.388199e+08 1.351162e+08 2.043107e+08 2.051397e+07 6.352669e+07 1.423605e+08 3.356549e+07 1.494789e+08 1.198946e+08 1.069475e+08 1.325556e+08 2.080621e+08 7.188747e+07 1.497551e+08 7.306602e+07 4.392401e+07 7.552000e+07 1.852589e+08 6.773412e+07 2.414411e+08 2.484832e+08 1.252738e+08 1.283129e+08 1.718470e+08 2.269433e+08 1.111286e+08 3.941322e+07 2.506010e+08 2.072225e+08 1.383198e+08 1.103313e+08 7.817103e+07 1.479944e+08 4.444271e+07 1.358711e+08 1.002138e+08 1.301375e+08 1.233204e+08 2.956088e+07 1.264950e+08 1.159032e+08 1.137144e+08 1.382354e+08 1.387183e+08 1.603283e+08 2.102878e+08 1.152269e+08 1.179643e+08 1.476200e+08 1.126729e+08 1.557201e+08 1.556044e+08 8.509641e+07 2.190638e+08 1.599735e+08 1.349002e+08 1.640824e+08 1.473498e+08 1.532910e+08 1.335712e+08 2.967343e+08 1.399738e+08 1.116399e+08 5.604974e+07 1.615182e+08 5.298096e+07 1.049178e+08 2.680348e+07 2.059566e+08 1.417750e+08 1.573297e+08 1.307884e+08 1.710959e+08 9.897787e+07 1.742119e+08 1.893893e+08 1.973443e+08 3.014631e+08 8.917872e+07 9.485755e+07 2.667902e+08 1.668803e+08 1.436790e+08 9.677965e+07 1.174356e+08 1.836788e+08 C6 H6 Cl N O3 S_7.225 5.393758e+07 2.719348e+07 3.367230e+07 2.034615e+07 5.880524e+05 3.075393e+07 2.253319e+07 1.744424e+07 605604.41 3.995192e+07 1.867208e+07 3.462435e+07 499686.43 2.461393e+07 3.120712e+07 2.742375e+07 4.525912e+05 2.395459e+07 2.744962e+07 2.339239e+07 4.118642e+05 2.648727e+07 3.266654e+07 3.200158e+07 89535.771 2.234455e+07 2.297460e+07 2.383056e+07 6.717330e+04 3.269972e+07 2.549639e+07 2.974694e+07 450611.45 2.660032e+07 2.653916e+07 2.700933e+07 4.904132e+05 2.886215e+07 2.721365e+07 3.116057e+07 4.033793e+05 1.553185e+07 2.843039e+07 2.862829e+07 3.920031e+05 3.188927e+07 2.642974e+07 2.527147e+07 2.747529e+07 1.560897e+07 2.430412e+07 3.412626e+07 3.110908e+07 2.989310e+07 3.730124e+07 3.319088e+07 2.518678e+07 2.618492e+07 3.679759e+07 2.361536e+07 1.858911e+07 3.610547e+07 3.614434e+07 3.140278e+07 2.639751e+07 2.845106e+07 1.853946e+07 2.132235e+07 2.603617e+07 2.920827e+07 3.284062e+07 2.526988e+07 2.097647e+07 2.202129e+07 2.900715e+07 2.633327e+07 2.466069e+07 2.393553e+07 4.926751e+07 2.325831e+07 1.819883e+07 2.924782e+07 2.447804e+07 1.961147e+07 2.122730e+07 2.244415e+07 2.865220e+07 3.158683e+07 2.367914e+07 2.674601e+07 2.871068e+07 3.110560e+07 1.984307e+07 1.833816e+07 2.168291e+07 3.537260e+07 3.607781e+07 2.203980e+07 1.869351e+07 1.758217e+07 2.769039e+07 3.728421e+07 2.914871e+07 2.500621e+07 1.145631e+07 2.085391e+07 3.158046e+07 2.286787e+07 2.457999e+07 2.837959e+07 2.286060e+07 2.393098e+07 3.810672e+07 2.986998e+07 1.997707e+07 3.057324e+07 3.081610e+07 3.237391e+07 2.841012e+07 2.883078e+07 2.735061e+07 3.129027e+07 1.858822e+07 2.659021e+07 2.300501e+07 2.369884e+07 3.169715e+07 2.182106e+07 3.635323e+07 3.681270e+07 2.443320e+07 2.652146e+07 1.911466e+07 2.881839e+07 2.247129e+07 1.557012e+07 1.940444e+07 2.048163e+07 2.673526e+07 3.268712e+07 3.271860e+07 2.684816e+07 2.894506e+07 2.910274e+07 2.678960e+07 2.080522e+07 2.425058e+07 3.140320e+07 2.642871e+07 2.651744e+07 2.484711e+07 2.755904e+07 3.803277e+07 2.629731e+07 3.442121e+07 4.734280e+07 3.051501e+07 3.481482e+07 2.978113e+07 1.825281e+07 2.339696e+07 2.389303e+07 2.312609e+07 2.945379e+07 2.395959e+07 1.116997e+07 2.740126e+07 2.845673e+07 2.516380e+07 3.024066e+07 2.258213e+07 2.125730e+07 4.115540e+07 2.865112e+07 2.453364e+07 2.308742e+07 2.249652e+07 2.883047e+07 3.428075e+07 1.801422e+07 1.290572e+07 1.847152e+07 1.544507e+07 2.510311e+07 2.205654e+07 2.063784e+07 1.746143e+07 3.322043e+07 1.936414e+07 2.627521e+07 1.512394e+07 2.183384e+07 6.735409e+06 3.551592e+07 1.419031e+07 1.494692e+07 3.314975e+07 2.475224e+07 2.838531e+07 2.367565e+07 3.348010e+07 2.250423e+07 2.787794e+07 3.166956e+07 1.675209e+07 2.682120e+07 2.151280e+07 1.506581e+07 2.776357e+07 1.388346e+07 2.461971e+07 1.890862e+07 2.732865e+07 1.544747e+07 1.966787e+07 2.654347e+07 2.087041e+07 2.155841e+07 1.848637e+07 3.384258e+07 2.657949e+07 2.906292e+07 2.865918e+07 1.741313e+07 2.706605e+07 1.299140e+07 2.565048e+07 2.510427e+07 1.008524e+07 2.424598e+07 2.865664e+07 2.186867e+07 2.729278e+07 2.288541e+07 3.287231e+07 2.413677e+07 4.508308e+07 2.695128e+07 1.751032e+07 2.534186e+07 2.379465e+07 2.019622e+07 2.124193e+07 2.604824e+07 3.527808e+07 2.456573e+07 3.307752e+07 2.601667e+07 2.552459e+07 1.918614e+07 3.206833e+07 3.840412e+07 4.278138e+07 4.968319e+07 2.435150e+07 1.184111e+07 5.125217e+07 2.975680e+07 2.039108e+07 2.049052e+07 3.222935e+07 3.245949e+07 2-(Diethylamino)ethanol_7.231 1.579359e+07 1.100693e+07 2.911441e+07 2.653812e+07 3.288911e+05 3.135865e+07 1.340169e+07 4.554766e+06 1466488.36 3.514238e+07 2.542935e+07 2.877305e+07 1609125.23 1.474733e+07 2.241973e+07 2.773861e+07 1.732417e+05 1.851790e+07 2.133745e+07 2.035544e+07 1.565013e+05 2.650290e+07 2.041350e+07 2.047960e+07 1801615.494 2.435418e+07 2.248156e+07 1.988406e+07 2.829251e+04 2.129648e+07 2.709962e+07 1.992228e+07 1815619.81 1.983331e+07 2.243240e+07 2.580950e+07 2.273888e+06 2.372079e+07 2.296038e+07 3.286317e+07 2.529910e+06 4.173404e+06 2.229116e+07 2.248295e+07 2.258400e+06 2.341337e+07 2.029113e+07 2.465575e+07 2.109335e+07 1.071734e+07 3.037318e+07 1.083294e+07 1.421460e+07 1.594502e+07 1.391525e+07 1.141912e+07 3.608418e+07 1.433657e+07 2.091655e+07 1.652887e+06 7.579859e+06 3.292530e+07 9.267889e+06 1.376737e+07 4.279297e+06 1.836948e+07 7.657388e+06 2.624068e+07 2.093896e+07 1.941627e+07 3.095760e+07 5.456784e+07 2.421304e+07 2.027550e+07 1.021545e+07 2.226167e+07 1.044081e+07 1.118411e+07 1.130767e+07 2.436879e+07 1.706125e+07 2.660097e+06 2.095758e+07 8.138587e+06 1.282744e+07 1.330354e+07 2.382575e+07 2.239944e+07 7.512295e+06 1.130826e+07 1.347789e+07 6.544421e+06 1.133077e+07 1.125803e+07 5.169322e+06 4.861135e+06 1.707080e+07 2.992058e+07 1.043689e+07 3.237806e+06 7.198737e+06 8.816680e+06 7.397695e+06 1.074745e+07 1.143453e+07 1.876020e+07 1.153981e+07 8.385313e+06 1.546588e+07 9.230132e+06 7.931900e+06 1.477068e+07 1.153982e+07 1.522363e+07 2.240675e+06 1.134577e+07 8.953388e+06 1.417931e+07 1.870253e+07 1.256893e+07 1.795267e+07 1.213478e+07 1.752363e+07 1.055686e+07 2.640354e+07 2.515579e+07 1.515546e+07 1.098692e+07 1.210114e+07 6.807698e+06 1.065593e+07 2.227692e+07 1.928580e+07 7.645399e+06 9.439290e+06 1.102543e+07 2.874915e+07 9.257264e+06 9.364131e+06 8.133525e+06 1.587275e+07 1.121278e+07 4.232692e+06 1.231386e+07 1.732838e+07 1.293059e+07 1.698038e+07 1.236020e+07 7.601684e+06 1.635087e+07 1.001840e+07 9.925805e+06 6.855945e+06 2.048975e+07 1.367557e+07 2.766271e+07 2.233138e+07 5.151947e+07 3.496023e+07 1.247636e+07 1.788263e+08 2.183313e+07 1.764911e+07 5.669227e+07 1.791978e+07 1.822399e+07 1.349327e+07 5.257959e+07 2.559192e+07 1.768118e+07 8.880645e+06 1.022276e+07 1.549915e+07 2.268073e+07 2.366374e+07 6.924132e+06 4.827087e+06 2.378909e+07 1.733366e+08 1.847525e+07 3.550478e+07 1.500658e+07 1.075443e+07 7.435242e+06 2.175003e+07 2.455445e+07 2.649925e+07 2.921199e+07 6.470024e+06 2.180835e+07 1.740025e+07 2.923362e+07 2.100072e+07 1.418004e+07 7.719364e+07 1.738563e+07 9.652640e+06 1.191011e+07 2.115490e+07 9.419626e+06 1.244246e+07 2.587517e+06 9.119002e+06 1.522754e+07 5.682051e+06 1.120943e+07 1.257320e+07 3.217951e+07 1.052015e+07 3.710774e+06 1.450240e+07 1.408357e+07 1.146282e+07 1.396561e+07 1.255242e+07 1.412923e+07 2.112347e+07 2.138603e+07 8.402208e+06 1.414173e+07 1.215713e+07 1.725594e+07 1.288866e+07 1.854304e+07 9.152011e+06 1.386627e+07 3.006856e+07 1.896444e+07 8.030841e+06 1.276268e+07 1.409538e+06 2.142547e+07 1.208334e+07 1.341639e+07 1.296994e+07 2.612444e+07 1.887128e+07 1.739074e+07 1.840112e+07 2.963769e+07 4.741798e+06 2.585131e+07 2.672452e+07 2.408688e+07 2.768275e+06 1.730710e+07 8.112153e+06 1.170348e+07 6.120167e+06 4.387968e+06 2.315430e+07 8.313051e+06 2.663316e+07 1.407865e+07 1.710684e+07 1.620715e+07 2.382390e+07 1.930555e+07 3.373959e+06 1.853547e+07 1.549646e+07 1.824510e+07 C9 H17 N O3_7.252 1.221520e+07 8.594114e+05 1.032161e+06 1.229154e+06 2.178981e+05 9.295293e+05 1.066828e+06 8.278211e+05 189498.07 1.284685e+06 1.020150e+06 1.130738e+06 195534.38 7.597558e+05 1.252704e+06 1.060708e+06 1.720650e+05 9.415804e+05 9.831226e+05 9.158836e+05 1.624308e+05 1.015188e+06 1.127162e+06 1.171581e+06 35612.014 9.748284e+05 9.990655e+05 9.837920e+05 2.872077e+04 9.784918e+05 1.036509e+06 1.127784e+06 195649.21 9.875056e+05 9.730331e+05 9.819376e+05 2.017008e+05 1.067554e+06 1.081601e+06 1.039463e+06 1.648882e+05 9.305652e+05 1.057109e+06 1.189761e+06 1.772247e+05 9.822649e+05 8.926437e+05 1.074274e+06 9.861291e+05 7.433254e+05 1.113269e+05 2.445091e+06 1.500399e+06 1.033050e+06 2.221944e+06 1.016447e+06 1.007570e+06 1.260340e+06 2.773986e+06 1.095812e+06 2.011611e+06 2.572046e+06 2.343999e+06 1.117983e+06 6.157366e+05 6.816021e+05 7.832495e+05 7.389830e+05 1.522839e+06 1.159487e+06 9.274375e+05 9.159971e+05 1.210645e+06 1.190679e+06 8.287984e+05 1.245546e+06 1.030443e+06 1.226679e+06 1.219466e+06 5.172993e+05 2.724329e+05 1.245112e+06 1.066067e+06 3.760710e+05 4.896954e+05 5.279589e+05 1.523563e+06 4.536643e+05 2.078357e+06 7.210700e+05 1.022814e+06 9.311395e+05 1.152170e+06 2.033193e+05 4.832059e+05 6.034369e+05 2.356443e+05 9.273680e+05 1.132438e+06 6.841775e+05 8.333518e+05 8.788929e+05 7.120537e+05 5.038739e+05 7.419150e+05 1.100220e+06 1.199713e+06 5.015656e+05 1.130936e+06 1.083015e+06 5.815598e+05 8.486998e+05 1.173950e+06 6.488426e+05 5.750469e+05 7.645382e+05 5.611158e+05 1.218920e+06 1.735791e+06 4.999754e+05 4.393631e+05 9.792391e+05 1.407567e+05 7.357414e+05 1.110073e+06 4.046332e+05 6.770105e+05 6.841164e+05 1.771884e+06 1.399424e+06 1.761642e+06 1.752474e+06 2.344503e+05 8.587188e+05 1.015201e+06 3.597623e+05 6.421533e+05 7.191070e+05 7.160124e+05 6.810365e+05 1.847850e+06 3.387424e+05 3.361616e+05 1.104703e+06 2.868244e+06 1.438223e+06 1.193522e+06 9.521313e+05 7.469759e+05 3.477990e+05 4.572601e+05 7.639509e+05 8.196578e+05 2.604533e+06 9.854613e+05 7.553938e+05 1.272097e+06 1.136372e+06 1.202337e+06 8.030231e+05 1.285199e+05 1.169587e+06 1.282602e+06 1.186768e+06 1.144817e+06 6.870645e+05 6.904207e+05 1.501362e+06 4.574527e+05 4.162940e+05 7.580372e+05 9.808330e+05 6.712765e+05 1.527022e+06 1.764645e+06 1.613687e+06 1.231337e+06 1.674035e+06 2.521836e+05 6.428518e+05 1.155272e+06 4.960542e+05 1.379285e+06 7.243743e+05 1.062919e+06 1.667317e+06 6.257571e+05 8.617910e+05 6.596285e+05 7.903898e+05 4.958927e+05 9.597646e+05 7.189960e+05 1.186977e+06 4.050638e+05 3.388545e+06 2.393240e+06 3.122361e+06 1.553274e+06 1.218146e+06 1.359703e+06 1.364830e+06 5.900680e+05 1.578159e+06 6.510054e+05 3.847027e+05 2.068231e+06 1.215592e+06 8.966365e+05 9.906369e+05 7.983979e+05 6.809649e+05 1.391520e+06 1.443500e+06 1.407172e+06 7.415959e+05 4.607148e+05 1.330761e+06 2.828548e+05 1.954647e+06 7.986958e+05 1.325334e+06 1.897695e+06 1.917413e+06 1.032022e+06 8.379701e+05 7.943364e+05 1.119394e+06 5.588124e+05 1.501206e+06 2.006538e+06 1.294764e+06 8.780911e+05 1.552872e+06 9.298965e+05 1.432668e+06 1.391308e+06 2.034579e+06 7.243206e+05 8.029839e+05 1.755603e+06 1.048108e+06 9.311188e+05 2.774809e+06 4.701823e+05 1.357130e+06 1.201511e+06 1.421591e+06 1.209714e+06 8.541678e+05 8.693741e+05 2.579621e+06 6.139520e+05 8.255529e+05 8.346748e+05 6.902533e+05 2.817442e+06 9.140308e+05 8.769395e+05 8.390179e+05 6.819762e+05 9.306467e+05 C8 H15 N O2_7.268 2.036324e+07 4.870134e+06 7.998940e+06 7.160644e+06 3.034972e+05 3.385144e+06 6.861707e+06 6.063078e+06 214980.30 7.407121e+06 5.677388e+06 7.401192e+06 216877.19 4.914257e+06 6.393613e+06 6.121685e+06 1.888008e+05 6.016344e+06 6.061914e+06 6.001499e+06 1.818183e+05 5.778372e+06 6.572704e+06 7.472031e+06 38588.223 5.635441e+06 6.236566e+06 5.940631e+06 3.055428e+04 5.831199e+06 5.836687e+06 6.433479e+06 212861.16 6.388566e+06 6.337783e+06 5.908097e+06 2.245289e+05 5.853402e+06 6.876573e+06 7.264706e+06 1.880158e+05 4.524532e+06 6.868025e+06 6.379009e+06 1.988371e+05 5.870243e+06 5.108252e+06 7.044160e+06 1.772794e+06 2.723531e+06 1.271039e+07 5.617144e+06 4.038843e+06 1.252965e+07 2.620669e+06 1.852109e+07 1.114489e+07 1.023380e+07 6.337384e+06 4.595599e+06 6.905358e+06 1.404562e+07 1.702813e+06 4.358574e+06 4.813695e+06 1.411376e+06 7.567101e+06 1.007905e+07 1.074915e+07 8.701072e+06 6.637457e+06 6.767166e+06 5.665615e+06 3.717670e+06 5.017959e+06 4.445007e+06 8.464882e+06 3.784753e+06 6.753731e+06 4.795269e+06 2.936241e+06 4.604398e+06 3.724009e+06 2.497230e+06 5.484707e+06 7.222092e+06 4.179260e+06 2.269777e+06 3.075501e+06 7.128498e+06 2.952550e+06 2.282401e+06 1.230239e+07 1.745995e+06 2.567060e+06 5.989345e+06 5.329819e+06 4.093235e+06 4.017820e+06 8.063312e+05 9.000471e+06 3.597591e+06 1.074391e+06 2.828140e+06 1.850524e+06 2.257069e+06 8.823344e+06 4.830659e+06 1.044390e+07 8.132262e+06 5.240965e+06 1.834455e+07 1.658481e+07 7.139795e+06 1.627955e+06 1.824511e+06 1.125789e+07 3.088821e+06 2.557170e+07 6.154719e+06 3.142577e+06 1.531995e+06 2.737863e+06 5.935654e+06 4.300268e+06 2.596573e+06 2.972629e+06 9.125572e+05 4.713340e+06 1.507865e+06 2.418843e+06 9.924971e+06 2.652957e+06 1.077349e+07 2.964819e+06 2.549628e+06 8.244380e+06 4.781224e+06 1.250149e+07 9.459781e+06 1.809617e+06 1.221005e+07 1.202718e+06 2.236051e+06 1.625283e+07 6.676899e+06 2.928600e+06 4.151607e+06 4.771580e+06 3.082255e+06 3.485761e+06 2.814023e+06 6.814320e+06 3.768299e+06 6.065483e+06 5.893061e+06 6.215385e+06 8.550986e+05 5.364800e+06 2.085593e+06 4.926415e+06 1.099426e+07 4.707554e+06 6.408591e+06 6.658830e+06 7.317090e+06 4.459343e+06 7.130709e+06 6.132948e+06 4.701174e+06 6.098423e+06 9.559955e+06 2.730293e+06 3.201886e+06 1.845864e+06 3.515723e+06 2.691949e+06 4.452493e+06 5.590967e+06 1.169099e+07 1.368530e+06 6.865584e+06 4.183250e+06 3.464835e+06 7.625445e+06 2.702579e+06 1.508922e+06 3.998755e+06 4.653017e+06 7.152662e+06 6.835205e+06 5.574189e+06 1.902604e+07 7.599928e+06 2.295701e+06 7.251811e+06 6.069657e+06 1.304525e+07 4.892023e+06 8.760638e+06 8.161235e+06 1.757017e+07 8.894653e+06 2.617236e+07 9.810788e+06 5.354034e+06 5.251123e+06 2.798131e+07 1.135039e+07 9.593867e+06 2.864142e+07 9.824817e+06 6.030926e+06 1.434762e+07 2.312456e+06 8.990190e+06 3.553454e+06 6.477894e+06 6.220723e+06 7.195498e+06 3.767574e+06 7.411292e+06 1.566555e+06 4.250384e+06 4.590819e+06 9.107693e+06 9.863589e+06 4.634216e+06 1.127030e+07 6.434777e+06 2.468307e+06 6.628409e+06 6.550065e+06 6.025869e+06 4.962775e+06 3.242540e+06 1.214086e+07 5.984515e+06 6.088720e+06 1.295140e+07 3.843289e+06 3.724412e+06 3.995360e+06 8.929873e+06 2.585731e+06 3.589582e+06 3.252982e+06 9.593707e+06 3.976451e+06 3.991593e+06 1.688847e+07 3.523867e+06 7.798177e+06 1.084916e+07 4.384864e+06 1.381987e+06 3.010074e+06 1.674147e+07 8.420385e+06 1.031960e+07 4.402592e+06 1.041346e+07 DEOXYCARNITINE 1.725075e+08 4.786774e+07 7.533591e+07 7.504810e+07 2.110064e+05 5.985191e+07 7.258192e+07 6.184690e+07 159012.34 7.551751e+07 7.225202e+07 7.725416e+07 168386.83 5.159565e+07 6.585022e+07 6.940286e+07 1.481757e+05 6.488213e+07 6.648826e+07 6.609533e+07 1.903872e+05 6.077008e+07 7.307831e+07 7.903822e+07 30545.154 5.985802e+07 6.469963e+07 6.495902e+07 2.300535e+04 6.686682e+07 6.524972e+07 7.123664e+07 163061.97 6.625815e+07 6.692306e+07 6.586053e+07 1.756560e+05 6.525482e+07 7.272970e+07 7.239886e+07 1.466549e+05 5.075319e+07 7.335114e+07 7.289393e+07 1.487525e+05 6.444650e+07 6.019185e+07 7.109390e+07 7.390873e+07 5.609645e+07 6.828622e+07 8.428819e+07 7.199337e+07 7.202438e+07 1.134820e+08 6.661556e+07 7.977019e+07 8.555641e+07 1.037719e+08 8.255819e+07 1.050487e+08 1.221572e+08 6.554534e+07 9.158629e+07 7.084635e+07 5.105831e+07 7.486810e+07 8.732690e+07 7.583699e+07 7.136705e+07 1.026344e+08 5.990309e+07 7.827063e+07 6.723751e+07 9.615456e+07 7.736350e+07 7.170612e+07 8.759367e+07 1.533006e+08 1.049710e+08 5.648450e+07 6.145300e+07 5.443105e+07 3.697778e+07 6.595875e+07 6.948934e+07 6.661967e+07 4.987813e+07 7.445778e+07 6.609123e+07 8.556477e+07 5.818226e+07 7.355298e+07 6.201492e+07 4.222874e+07 8.049881e+07 7.330315e+07 9.417628e+07 6.828086e+07 6.273051e+07 4.250577e+07 7.573674e+07 8.049140e+07 7.948741e+07 4.782515e+07 6.415199e+07 6.908893e+07 7.204458e+07 9.853011e+07 7.283964e+07 4.442083e+07 9.471528e+06 8.097857e+07 5.336371e+07 4.736125e+07 5.639259e+07 5.728733e+07 9.203167e+07 7.303592e+07 6.043899e+07 4.519462e+07 7.165286e+07 4.159050e+07 6.161251e+07 6.288067e+07 4.730487e+07 6.842627e+07 7.858318e+07 6.840270e+07 7.928628e+07 1.527277e+08 8.444765e+07 3.818014e+07 6.871593e+07 9.424284e+07 4.959787e+07 5.590523e+07 8.012992e+07 5.797645e+07 1.044685e+08 9.099063e+07 6.111126e+07 4.538635e+07 6.164448e+07 2.805048e+07 6.867850e+07 6.851754e+07 6.909997e+07 4.671947e+07 5.617104e+07 4.649033e+07 5.590043e+07 4.984587e+07 8.445123e+07 6.102911e+07 9.953969e+07 6.744467e+07 5.936495e+07 5.298957e+07 7.010757e+07 5.701206e+07 1.033358e+08 4.841393e+07 5.437343e+07 8.896944e+07 7.885821e+07 1.355393e+08 6.764724e+07 6.610226e+07 5.437423e+07 7.851310e+07 6.013300e+07 5.537042e+07 7.643975e+07 8.477342e+07 5.234430e+07 9.119217e+07 1.020450e+08 6.031098e+07 5.341591e+06 4.135704e+07 5.196812e+07 7.144552e+07 3.761177e+07 5.022175e+07 5.175099e+07 3.955424e+07 4.539084e+07 2.622426e+07 1.061702e+08 7.003719e+07 5.018290e+07 3.956409e+07 8.364707e+07 3.449462e+07 4.700106e+07 8.247329e+07 5.366394e+07 5.758587e+07 8.088617e+07 8.486379e+07 5.219331e+07 8.084012e+07 8.584738e+07 5.071159e+07 6.326700e+07 6.730147e+07 7.701014e+07 1.108035e+08 5.457807e+07 7.385352e+07 3.378455e+07 6.518901e+07 6.063541e+07 6.887326e+07 6.419386e+07 5.065314e+07 5.562783e+07 7.885270e+07 9.260366e+07 5.492449e+07 5.491392e+07 8.166807e+07 5.524565e+07 8.263992e+07 6.852670e+07 6.943201e+07 7.283513e+07 5.322399e+07 9.614328e+07 6.447013e+07 6.349538e+07 9.084706e+07 5.413048e+07 5.818232e+07 7.408277e+07 7.493027e+07 6.114700e+07 4.970501e+07 8.826938e+07 7.075630e+07 6.170481e+07 4.046678e+07 7.680117e+07 8.565955e+07 4.714509e+07 6.323190e+07 6.594982e+07 7.254011e+07 6.056753e+07 6.519308e+07 9.543600e+07 6.072527e+07 8.337367e+07 1.002819e+08 4.775389e+07 1.004520e+08 5.746392e+07 7.900251e+07 4.838516e+07 1.302351e+08 9.290169e+07 C5 H2 N3 O5 P_7.322 1.273325e+08 6.237843e+07 5.260959e+07 5.425775e+07 1.996618e+06 5.776984e+07 3.052106e+07 2.708977e+07 1129141.58 1.342471e+08 3.030674e+07 6.719289e+07 1199079.54 5.716964e+07 7.986840e+07 3.640625e+07 1.439948e+06 6.640479e+07 5.006390e+07 4.822264e+07 2.058760e+06 3.141367e+07 5.617798e+07 1.034971e+08 866208.029 5.495607e+07 6.429320e+07 1.467722e+07 1.436781e+06 8.094063e+07 4.982533e+07 7.288232e+07 2879486.92 4.560756e+07 1.921439e+06 1.702680e+06 2.497291e+06 6.035067e+07 5.476014e+07 8.941110e+07 2.130023e+06 3.866706e+07 5.214916e+07 4.824663e+07 1.723945e+06 1.323839e+06 6.830004e+07 5.569101e+07 8.368846e+07 1.775049e+07 1.064664e+08 7.104044e+07 1.593598e+07 3.424443e+06 6.716063e+07 6.887938e+07 8.478430e+06 7.608847e+07 9.421720e+07 3.824554e+07 9.156409e+07 6.804875e+07 3.897175e+07 4.609467e+06 4.367667e+07 5.173452e+07 5.263932e+07 2.980412e+07 9.285076e+07 1.588795e+07 1.241756e+08 1.364389e+07 6.477905e+07 3.611814e+06 8.465951e+06 1.028937e+07 1.310460e+08 1.211540e+08 1.667041e+06 1.282193e+07 1.082070e+07 1.302920e+08 2.489012e+06 1.649510e+07 6.966047e+07 4.523030e+07 3.081175e+07 3.404007e+06 1.091787e+08 7.082866e+06 1.479488e+08 2.536594e+07 1.365889e+07 4.310366e+07 4.857179e+07 7.815311e+07 2.652292e+06 1.249492e+06 4.775142e+07 1.961881e+06 2.489648e+07 5.505224e+06 2.646800e+07 1.112929e+08 8.265163e+07 9.033123e+06 2.083797e+06 1.740510e+07 9.880265e+07 9.650050e+07 1.136153e+08 7.885703e+07 2.184155e+07 6.455177e+06 3.019097e+07 3.394533e+07 1.830604e+08 8.893320e+07 4.385803e+07 1.266305e+08 8.939275e+07 3.379293e+06 3.382758e+07 7.138884e+07 4.778464e+06 1.568791e+06 6.991825e+07 5.922477e+07 5.511334e+07 1.889429e+07 1.573914e+07 1.173494e+07 1.193187e+08 4.199834e+06 4.496484e+07 7.309574e+07 1.483999e+07 8.272071e+06 7.014779e+07 3.914535e+06 5.590877e+06 1.425894e+07 1.273080e+07 5.436707e+06 3.318739e+07 7.019098e+07 1.966209e+08 3.224076e+06 8.906153e+06 3.187891e+07 6.419317e+07 1.085037e+07 4.370773e+07 8.125942e+06 3.889475e+06 4.267776e+07 1.012990e+08 5.750423e+06 1.303843e+06 6.559126e+05 7.186796e+07 1.116421e+08 2.868955e+07 8.739168e+07 1.376864e+07 3.237474e+06 8.144410e+06 3.330356e+06 7.631510e+06 1.184629e+08 3.123497e+07 5.001187e+07 1.428835e+06 1.626693e+06 3.282011e+07 2.092387e+07 9.121272e+07 5.017959e+06 1.230059e+08 8.516645e+06 3.048495e+07 6.736494e+06 3.694526e+07 4.991831e+07 1.416368e+08 1.669330e+08 5.242953e+07 4.278835e+07 3.355475e+07 6.131650e+07 2.008352e+08 2.236203e+07 5.097444e+07 1.733520e+08 5.661414e+07 2.671807e+07 5.032387e+07 5.524485e+07 7.789539e+07 1.354788e+08 2.454061e+07 4.392933e+07 3.918452e+07 3.053448e+07 4.383471e+07 2.201376e+07 6.063907e+07 1.372880e+07 7.213555e+07 5.636435e+07 6.141682e+07 4.685910e+07 5.165892e+07 1.189362e+08 4.207465e+07 4.357517e+07 6.260405e+07 5.510947e+07 2.992246e+07 9.115338e+07 3.161746e+07 1.083806e+08 6.010262e+07 5.552636e+07 6.400872e+07 2.173492e+07 4.505316e+07 4.952410e+07 5.852748e+06 3.759733e+07 4.481210e+07 5.312041e+07 7.307986e+07 1.350667e+08 4.719151e+07 1.459537e+08 4.195648e+07 1.336104e+08 5.800214e+07 2.983009e+07 4.914589e+07 4.307335e+07 8.344651e+06 2.574341e+07 3.456772e+07 2.129593e+07 5.602135e+07 2.156934e+08 1.582614e+07 5.153320e+07 6.518876e+07 4.140414e+06 4.957766e+07 3.937428e+07 3.381124e+07 5.788573e+06 1.635115e+08 3.835773e+07 5.786153e+07 3.758829e+06 1.969014e+07 4.005629e+07 PROPANOLAMINE_7.337 1.507337e+08 5.314054e+07 4.938930e+07 6.024575e+07 3.292759e+05 4.699417e+07 4.857694e+07 5.134542e+07 230301.42 5.699509e+07 5.948866e+07 6.061414e+07 396513.69 4.126219e+07 5.310607e+07 5.361158e+07 3.569969e+05 4.988499e+07 5.006158e+07 5.370945e+07 2.384340e+05 4.986656e+07 5.506371e+07 6.339656e+07 275655.714 4.751124e+07 5.185544e+07 5.027228e+07 4.125900e+04 4.987558e+07 5.250291e+07 5.726318e+07 288846.86 5.290866e+07 5.075654e+07 5.070412e+07 2.482513e+05 5.433567e+07 5.811391e+07 6.136776e+07 2.653525e+05 3.056016e+07 5.999111e+07 5.636880e+07 2.678729e+05 5.214213e+07 4.721043e+07 5.599213e+07 8.506626e+07 2.990006e+07 2.927393e+07 9.662565e+07 7.090672e+07 1.259539e+08 1.411170e+08 1.361194e+08 5.930613e+07 4.951434e+07 9.497130e+07 8.853735e+07 6.932951e+07 5.509595e+07 6.168957e+07 5.762753e+07 3.038579e+07 4.536997e+07 3.309287e+07 3.696670e+07 4.440067e+07 5.645546e+07 5.442680e+07 5.577936e+07 4.767064e+07 4.209577e+07 6.412670e+07 2.269848e+07 1.150306e+08 3.412457e+07 7.367097e+07 4.704403e+07 3.211604e+07 2.396563e+07 5.617856e+07 4.298467e+07 6.880883e+07 2.962874e+07 6.369904e+07 2.252072e+07 3.588750e+07 3.083293e+07 5.904155e+07 2.636518e+07 5.631087e+07 2.341772e+07 5.523479e+07 4.539218e+07 3.599636e+07 2.781406e+07 5.711951e+07 3.508731e+06 5.195989e+07 1.254172e+08 2.998077e+07 5.722552e+07 8.098086e+07 6.210103e+07 3.616515e+07 7.290892e+07 3.933862e+07 1.885471e+07 2.389282e+07 4.843057e+07 4.069141e+07 1.358339e+08 5.448706e+07 3.159688e+07 3.168163e+07 7.001477e+07 6.386380e+07 7.857377e+07 4.182636e+07 3.855726e+07 2.431424e+07 2.916297e+07 2.516651e+07 1.414749e+08 4.601507e+07 5.377303e+07 3.957322e+07 7.460565e+07 4.397083e+07 8.738413e+07 2.514862e+07 7.800500e+07 9.088781e+07 3.924752e+07 4.547214e+07 5.716589e+07 3.351183e+07 2.883570e+07 4.584857e+07 2.832724e+07 2.209072e+07 5.629510e+07 6.626702e+07 6.722837e+07 3.006770e+07 5.967586e+07 1.602204e+07 2.312920e+07 7.601818e+07 3.873839e+07 6.444282e+07 1.003276e+08 6.286674e+07 5.163041e+07 4.795443e+07 4.679465e+07 4.539346e+07 3.472404e+07 2.985418e+07 6.828692e+07 8.920975e+07 3.583536e+07 6.182727e+07 3.306633e+07 2.703855e+07 6.101684e+07 3.800470e+07 2.836257e+07 2.327610e+07 7.454808e+07 6.337963e+07 4.851700e+07 5.767073e+07 7.880374e+07 3.222386e+07 5.022917e+07 3.896641e+07 3.307511e+07 2.661688e+07 5.109106e+07 3.765365e+07 6.311054e+07 9.073586e+07 1.911986e+07 4.445965e+07 9.815619e+07 8.198898e+07 7.322676e+07 5.416854e+07 1.110553e+08 1.540018e+07 3.465142e+07 2.120260e+07 3.571664e+07 6.585383e+07 2.265324e+07 1.467787e+08 1.161927e+08 4.365560e+07 1.921526e+07 4.893920e+07 7.428621e+07 4.136257e+07 1.756576e+07 4.147667e+07 4.713909e+07 1.046158e+08 8.887958e+07 5.226792e+07 7.614650e+07 3.660927e+07 3.708304e+07 1.282540e+07 3.108887e+07 9.177818e+07 6.432969e+07 4.669330e+07 6.414449e+07 3.816528e+07 2.827796e+07 2.846123e+07 7.021620e+07 8.659838e+07 3.412163e+07 4.381948e+07 4.558818e+07 4.040836e+07 6.687263e+07 7.197382e+07 3.139974e+07 4.479272e+07 3.469001e+07 7.789038e+07 2.387342e+07 1.532647e+08 4.748312e+07 2.654802e+07 5.065817e+07 8.538434e+07 4.407247e+07 7.561348e+07 1.125968e+08 2.585536e+07 1.192738e+08 9.434018e+07 5.362946e+07 7.524251e+07 4.158567e+07 2.412698e+07 9.065120e+07 3.590314e+07 5.917475e+07 5.676422e+07 3.876279e+07 3.008821e+07 3.015646e+07 3.846112e+07 6.249803e+07 4.121143e+07 5.787294e+07 150.13677_7.343 2.320179e+07 6.760132e+06 7.276116e+06 4.896503e+06 6.421532e+04 5.646223e+06 7.119707e+06 7.171932e+06 74593.54 5.266932e+06 6.818545e+06 6.455448e+06 99680.34 6.671596e+06 6.028064e+06 6.271561e+06 1.086824e+05 6.236628e+06 4.336876e+06 6.711323e+06 8.431123e+04 6.255383e+06 7.171567e+06 8.181015e+06 23814.626 5.549273e+06 6.209272e+06 5.727332e+06 1.621223e+04 5.546942e+06 6.332664e+06 6.892142e+06 111871.57 7.130427e+06 5.396223e+06 5.587027e+06 9.232056e+04 6.634735e+06 7.271238e+06 6.568359e+06 1.012347e+05 5.768012e+06 6.790637e+06 7.190961e+06 1.245500e+05 5.298837e+06 4.763035e+06 7.570730e+06 1.293312e+07 5.075069e+06 2.240450e+06 1.757879e+07 1.026079e+07 2.169710e+07 2.808427e+07 3.477201e+07 7.815147e+06 6.396486e+06 1.642101e+07 1.601505e+07 1.112256e+07 7.257661e+06 1.268709e+07 7.645712e+06 2.267546e+06 4.164872e+06 4.527369e+06 2.879120e+06 4.714445e+06 7.560688e+06 4.441254e+06 9.689713e+06 6.137803e+06 4.838791e+06 9.228507e+06 1.368149e+06 2.333660e+07 3.322510e+06 1.045524e+07 4.992530e+06 3.568750e+06 1.249836e+06 6.612650e+06 4.219827e+06 9.005713e+06 1.869068e+06 8.837868e+06 1.589933e+06 3.439819e+06 2.638695e+06 7.391484e+06 2.795423e+06 7.493982e+06 1.244381e+06 1.048955e+07 4.996805e+06 3.548537e+06 1.552661e+06 8.259529e+06 9.860935e+05 8.887585e+06 2.407447e+07 2.448518e+06 7.479240e+06 1.265754e+07 7.341990e+06 2.984492e+06 1.086523e+07 3.941892e+06 9.703075e+05 1.298012e+06 6.032717e+06 3.910734e+06 2.050372e+07 7.365269e+06 2.315422e+06 2.438131e+06 9.163618e+06 7.550798e+06 1.133758e+07 2.781942e+06 3.640068e+06 2.049934e+06 2.370499e+06 1.244197e+06 2.536524e+07 3.461159e+06 6.162180e+06 2.778571e+06 1.043224e+07 4.655152e+06 1.402596e+07 1.385585e+06 1.144052e+07 1.606606e+07 6.518756e+06 3.229070e+06 6.625288e+06 2.987693e+06 2.234445e+06 4.904604e+06 1.543262e+06 2.307689e+06 6.646959e+06 5.925284e+06 8.364267e+06 1.314165e+06 5.104189e+06 1.212488e+06 1.331631e+06 9.863513e+06 3.959568e+06 1.011178e+07 1.657059e+07 8.541433e+06 4.333914e+06 4.831043e+06 3.830447e+06 5.109933e+06 5.401223e+06 2.613294e+06 1.090389e+07 1.488345e+07 2.243085e+06 7.321404e+06 4.089817e+06 2.079295e+06 6.645686e+06 2.936903e+06 2.109517e+06 2.537769e+06 1.216797e+07 8.783260e+06 6.035259e+06 7.606667e+06 1.601891e+07 2.546100e+06 4.880785e+06 3.496568e+06 4.274144e+06 2.124883e+06 6.271464e+06 3.336236e+06 1.493602e+07 1.562322e+07 8.389221e+05 5.085064e+06 1.870654e+07 1.366119e+07 9.397640e+06 7.162209e+06 2.398324e+07 2.036517e+05 3.594120e+06 1.301790e+06 5.323023e+06 1.009185e+07 1.395178e+06 3.086510e+07 2.417757e+07 3.974605e+06 1.033248e+06 5.326099e+06 1.014445e+07 6.114661e+06 1.712067e+06 4.610408e+06 4.559582e+06 1.967235e+07 1.257205e+07 6.184419e+06 1.133225e+07 3.477037e+06 3.510150e+06 5.264300e+05 1.800123e+06 1.442104e+07 7.773875e+06 8.179522e+06 9.961673e+06 4.677885e+06 1.238113e+06 2.533694e+06 1.156702e+07 1.577276e+07 3.996850e+06 4.548289e+06 4.623333e+06 5.468615e+06 3.204735e+06 1.165773e+07 2.302599e+06 4.287175e+06 3.361722e+06 1.354460e+07 1.293802e+06 2.681378e+07 5.134177e+06 3.333218e+06 3.919790e+06 1.441515e+07 3.135164e+06 1.325428e+07 1.834705e+07 1.430451e+06 1.823885e+07 1.824071e+07 5.911658e+06 1.756558e+07 6.220548e+06 1.105522e+06 1.552186e+07 2.688181e+06 6.182632e+06 4.813684e+06 6.541262e+06 1.305686e+06 2.104927e+06 6.874154e+06 7.467494e+06 4.372894e+06 7.466016e+06 C9 H20 N2 O3_7.36 1.697321e+05 1.972933e+05 2.462390e+05 2.047151e+05 4.902944e+04 1.972774e+05 2.077295e+05 2.324602e+05 64397.55 1.800129e+05 2.395314e+05 2.445756e+05 81594.69 2.059604e+05 1.629111e+05 2.353007e+05 9.386441e+04 2.100469e+05 1.773220e+05 2.076896e+05 7.898113e+04 1.951314e+05 2.393311e+05 2.956687e+05 25417.640 1.758399e+05 1.948097e+05 2.389947e+05 2.036097e+04 1.576647e+05 2.004747e+05 2.412433e+05 153441.37 2.012801e+05 1.932459e+05 1.949227e+05 1.236060e+05 2.111522e+05 2.658488e+05 2.787094e+05 1.382420e+05 1.190804e+05 2.168429e+05 3.092946e+05 1.826805e+05 1.074970e+05 6.930898e+04 2.191549e+05 5.492116e+04 1.603279e+04 5.525745e+04 5.404562e+04 1.198166e+05 1.461305e+05 4.192999e+04 8.000730e+04 8.757504e+04 8.089535e+04 7.276907e+05 3.436543e+05 8.522963e+04 7.195155e+04 1.833730e+04 2.043719e+05 3.539806e+04 7.589196e+04 6.075439e+04 1.933850e+05 3.836658e+04 1.636341e+05 9.963123e+04 7.849165e+04 7.375428e+04 2.255091e+05 4.549379e+04 1.265563e+05 2.337657e+04 2.207869e+04 1.756277e+06 9.000585e+05 5.856296e+05 3.445990e+04 3.038568e+05 3.404855e+04 6.631574e+05 8.458800e+05 5.265256e+04 1.550586e+05 1.964790e+04 1.880173e+04 3.103487e+04 1.132781e+05 3.943670e+04 2.362942e+04 1.238353e+05 2.517779e+04 6.132650e+04 3.423877e+04 2.442037e+04 3.536434e+04 6.306262e+04 1.294175e+06 3.406788e+04 3.309014e+04 3.657119e+04 3.064281e+04 3.257552e+04 8.618856e+05 2.410388e+04 2.958756e+04 3.314562e+04 4.066442e+04 2.593925e+04 7.399432e+04 2.317108e+04 2.002349e+04 2.093709e+04 4.867680e+04 2.036021e+06 1.918593e+05 2.455947e+05 3.708879e+04 3.906812e+04 3.774651e+04 3.804705e+04 4.012798e+05 1.676303e+04 5.905647e+04 6.934638e+05 1.792588e+04 3.657964e+04 3.495143e+04 5.369768e+04 3.043357e+04 2.018757e+04 1.968683e+05 8.399544e+04 2.384104e+04 1.572725e+05 5.810572e+05 4.115236e+04 5.597600e+04 1.541790e+05 5.568505e+04 5.027947e+04 3.509249e+04 4.107393e+04 4.102414e+04 1.998597e+04 3.054149e+04 2.779420e+04 3.295348e+04 2.207248e+04 1.660516e+06 1.195353e+06 2.340623e+04 3.527869e+04 3.441919e+04 2.108265e+04 6.110487e+04 3.600574e+04 2.299097e+06 5.560515e+04 2.685702e+05 1.132832e+06 1.590267e+05 2.959050e+04 1.285008e+05 2.742291e+05 5.032841e+04 2.669733e+05 1.834312e+06 1.096484e+05 5.288146e+04 5.853192e+04 3.006971e+04 4.440533e+04 3.703004e+04 8.147635e+04 4.559624e+04 3.270388e+04 6.779506e+04 1.451630e+05 2.415203e+04 4.277260e+04 3.021553e+04 5.164052e+05 5.893032e+04 6.346084e+04 7.877406e+04 6.316546e+04 5.855508e+05 4.509592e+04 4.397078e+04 3.085938e+04 1.632664e+04 4.844721e+04 2.359879e+05 2.999961e+05 3.349015e+05 2.060754e+04 2.283434e+04 4.022657e+04 2.212278e+04 3.527391e+04 1.756543e+04 9.836799e+04 1.608096e+06 2.302288e+04 2.296749e+04 4.613891e+04 2.913849e+05 1.077417e+05 2.964875e+04 5.693725e+04 3.422128e+04 6.201865e+04 3.915825e+04 1.816689e+04 2.148217e+04 1.649595e+04 8.042177e+05 2.646790e+04 4.466888e+04 2.199544e+04 1.613746e+04 3.385326e+04 4.598481e+04 3.371578e+04 2.401953e+04 2.546710e+04 4.491242e+04 1.048063e+06 2.240846e+04 2.801810e+04 3.267891e+04 1.578233e+05 1.347262e+05 2.247510e+04 5.207847e+05 1.397154e+05 1.546832e+04 2.777433e+04 2.771905e+06 2.161503e+04 1.525192e+05 3.322762e+04 1.148155e+05 3.217450e+04 4.904973e+05 2.077977e+04 1.373965e+05 5.698178e+04 1.825382e+04 2.008765e+04 4.106299e+04 5.624656e+04 4.364867e+05 1.914934e+04 1.549856e+05 3.190130e+04 2.179128e+04 C6 H10 N2 O2_7.364 7.395906e+06 3.712706e+06 3.155886e+06 3.739727e+06 3.618446e+05 3.401081e+06 3.451816e+06 3.348270e+06 305780.84 4.446643e+06 3.537682e+06 4.767349e+06 302147.24 2.362241e+06 3.546902e+06 3.801846e+06 2.790050e+05 3.458527e+06 3.467578e+06 3.409262e+06 2.128220e+05 3.332679e+06 3.830661e+06 4.464027e+06 62347.027 3.220869e+06 3.526077e+06 3.538344e+06 1.208324e+05 3.246641e+06 3.605410e+06 3.908146e+06 304973.09 3.525702e+06 3.725156e+06 3.668760e+06 2.681219e+05 3.343345e+06 3.587995e+06 4.112438e+06 3.409886e+05 2.419322e+06 3.914720e+06 4.567054e+06 2.903704e+05 3.289796e+06 3.012572e+06 3.809182e+06 9.681118e+05 2.700795e+06 6.659160e+05 7.080957e+06 1.268888e+06 8.982749e+05 1.010274e+07 9.795509e+05 1.534619e+06 7.579445e+05 3.868003e+06 1.460321e+06 1.896435e+06 2.599969e+06 1.310294e+07 1.536235e+06 9.875320e+05 2.000972e+06 5.762685e+05 5.549056e+05 1.318551e+06 9.386789e+05 1.377584e+06 6.046349e+05 1.869568e+06 1.159932e+06 1.102277e+06 1.127606e+07 1.089679e+06 9.312246e+05 1.591854e+07 1.754358e+06 2.265601e+06 1.806263e+06 1.129347e+06 1.866357e+06 5.517718e+05 4.758293e+06 2.504588e+06 1.127763e+07 1.636925e+06 5.345377e+05 3.409510e+06 2.682552e+06 4.114594e+06 4.141498e+05 1.718406e+06 6.657434e+05 2.375191e+06 2.086560e+06 8.200937e+05 1.316491e+06 7.867057e+05 7.822995e+06 2.227468e+06 6.184160e+06 3.944178e+06 4.443920e+06 6.606613e+06 3.064144e+06 1.191903e+07 5.572506e+06 4.249984e+05 7.845142e+05 1.393745e+06 8.304563e+05 5.536840e+05 1.473428e+06 3.174439e+06 1.671314e+06 3.466489e+05 4.444365e+05 9.302610e+06 1.225958e+06 7.957210e+05 1.715470e+06 1.741583e+06 5.639848e+05 1.019797e+07 4.341917e+06 2.439599e+06 1.870763e+06 3.477006e+06 1.194565e+07 8.918974e+05 3.253173e+06 3.808172e+06 2.536004e+06 5.801864e+05 1.579865e+06 2.320228e+06 5.118682e+05 1.460626e+07 1.806967e+06 9.783751e+06 7.405963e+05 8.428297e+05 9.347059e+05 7.022152e+05 1.399075e+06 7.028427e+05 1.401684e+06 4.974536e+05 2.471042e+06 1.657705e+07 1.611042e+07 1.538493e+06 1.050454e+06 4.644214e+05 1.896979e+06 9.857336e+05 6.888120e+05 3.224667e+05 1.549958e+06 5.828595e+05 3.772171e+05 3.242901e+06 1.325238e+06 4.779119e+06 9.003663e+05 1.121817e+06 2.422340e+06 3.453654e+06 2.211961e+06 9.232515e+05 1.141366e+06 1.835362e+06 2.725028e+05 8.184993e+06 2.322273e+06 1.353985e+07 8.505722e+05 1.774993e+06 8.108080e+05 1.228298e+06 2.283743e+06 1.358492e+06 4.163281e+05 5.699667e+05 1.221013e+06 2.732349e+06 2.133300e+07 2.316564e+06 1.825641e+06 1.586089e+06 2.809825e+06 3.379542e+06 1.341103e+06 2.116909e+07 1.060558e+06 3.156374e+05 1.106828e+07 3.788700e+06 2.427036e+06 2.058857e+06 3.014702e+07 1.688479e+07 1.877849e+07 2.216626e+06 6.361675e+05 8.910010e+05 3.475779e+07 2.748132e+06 2.266471e+05 6.718909e+05 4.605356e+05 4.934800e+05 1.776304e+06 9.551519e+06 1.103334e+06 6.005711e+05 5.824915e+06 1.472509e+07 1.219281e+07 7.733354e+06 2.433182e+05 3.388677e+05 6.752579e+05 8.378849e+05 2.891102e+07 1.803178e+06 5.052870e+05 1.014241e+07 1.594650e+06 7.297648e+06 1.162230e+07 2.569133e+06 6.781397e+05 1.479657e+07 2.553218e+06 6.877473e+05 8.011689e+05 1.000450e+07 4.186634e+06 2.559299e+06 1.222833e+06 1.838917e+07 8.391468e+06 2.049458e+06 1.408927e+06 2.819556e+06 2.148005e+06 9.262530e+05 4.246034e+06 9.105012e+06 1.934195e+07 2.571744e+06 8.934908e+05 1.204103e+07 8.020453e+06 2.611003e+06 1.372251e+07 5.047311e+06 7.803513e+05 4-Sulfanyldihydro-3(2H)-furanone_7.381 6.527303e+07 1.347558e+07 1.426129e+07 1.443882e+07 5.153781e+05 1.390925e+07 1.395809e+07 1.609157e+07 481808.55 1.689138e+07 1.081731e+07 1.904687e+07 458857.37 1.142775e+07 1.516072e+07 1.548688e+07 4.358125e+05 1.017431e+07 1.365733e+07 1.442935e+07 3.002013e+05 1.505838e+07 1.686347e+07 1.649565e+07 88300.623 1.159658e+07 1.315986e+07 1.670051e+07 6.537056e+04 1.285761e+07 1.362924e+07 1.455357e+07 413950.95 1.387442e+07 1.694221e+07 1.325967e+07 3.849602e+05 1.292494e+07 1.722151e+07 1.625163e+07 4.647699e+05 7.855490e+06 1.533322e+07 1.780322e+07 4.498993e+05 1.364595e+07 1.224253e+07 1.539212e+07 1.021402e+07 8.732589e+06 1.258724e+08 2.628197e+07 1.308067e+07 1.650796e+07 1.526947e+07 1.079269e+07 2.107996e+07 2.878125e+07 1.926211e+07 1.534802e+07 1.910655e+07 2.102799e+07 1.335431e+07 3.885035e+07 1.976530e+07 8.682742e+06 2.091409e+07 9.983953e+06 1.251376e+07 1.915759e+07 2.085493e+07 1.206255e+07 2.175747e+07 1.027706e+07 1.076099e+07 9.619222e+06 1.763949e+07 3.276107e+07 1.968644e+07 1.182452e+07 1.130367e+07 9.792561e+06 1.332017e+07 1.919306e+07 8.143653e+06 1.180033e+07 6.384151e+06 4.780856e+06 2.265687e+07 1.317228e+07 1.222379e+07 4.463109e+07 7.169928e+06 1.266094e+07 1.149767e+07 3.853527e+07 1.236809e+07 1.941938e+07 7.366997e+06 1.137653e+07 7.416724e+06 5.070875e+06 1.263118e+07 1.420991e+07 1.957188e+07 1.642505e+07 1.191458e+07 6.606733e+06 1.624396e+07 1.242741e+07 7.862919e+06 2.873054e+07 1.339828e+07 1.309714e+07 6.790822e+06 2.183649e+07 2.484734e+07 2.703689e+07 1.290299e+07 1.694009e+07 5.311582e+06 1.543638e+07 8.383185e+06 1.124025e+07 1.106986e+07 1.374643e+07 1.633621e+07 1.078122e+07 1.209917e+07 8.756530e+06 2.214329e+07 1.071607e+07 8.880064e+06 7.048032e+06 1.600102e+07 9.555013e+06 1.089111e+07 1.695583e+07 9.670301e+06 1.151855e+07 1.647595e+07 1.120983e+07 1.006352e+07 1.551966e+07 1.715959e+07 9.385911e+06 1.125928e+07 8.280805e+06 1.058816e+07 7.896673e+06 4.262609e+07 1.005009e+07 7.203173e+06 1.443414e+07 2.969844e+07 1.986346e+07 7.364705e+06 1.244816e+07 7.288001e+06 1.881160e+07 1.347454e+07 1.129973e+07 1.883818e+07 1.553293e+07 7.442157e+06 1.401771e+07 1.445892e+07 1.269690e+07 8.775672e+06 1.966395e+07 2.388075e+07 2.519396e+07 2.248689e+07 1.464077e+07 1.343176e+07 8.436832e+06 2.921768e+07 2.774146e+07 1.768578e+07 6.589863e+06 8.602097e+06 2.317049e+07 1.085244e+07 8.178660e+06 7.260605e+06 2.642832e+07 1.441457e+07 1.231908e+07 6.407570e+06 8.215212e+06 3.894558e+07 8.276344e+06 2.114520e+07 1.357301e+07 6.990595e+06 1.176481e+07 1.069317e+07 9.609602e+06 1.288148e+07 1.315352e+07 2.795438e+07 9.902094e+06 1.479447e+07 4.624986e+07 2.822238e+07 5.195266e+06 1.246755e+07 7.772393e+06 1.093313e+07 7.364946e+06 1.408758e+07 1.554602e+07 1.298935e+07 9.141844e+06 6.565270e+06 9.313318e+06 1.480253e+07 9.999664e+06 1.005584e+07 9.541596e+06 8.520924e+06 8.253850e+06 1.680256e+07 6.146030e+06 1.394071e+07 5.974319e+06 2.874994e+07 1.244220e+07 1.327345e+07 1.195073e+07 8.778773e+06 1.062267e+07 7.913988e+06 6.087901e+06 8.057950e+06 1.961870e+07 9.293028e+06 1.232968e+07 1.243838e+07 6.506574e+06 1.408709e+07 1.305409e+07 3.214839e+07 1.157331e+07 1.322983e+07 1.599548e+07 3.556913e+07 6.523021e+06 1.150666e+07 8.503088e+06 1.858544e+07 1.807558e+07 1.368704e+07 3.853434e+07 5.743859e+07 9.983423e+06 4.085664e+07 1.292973e+07 2.088690e+07 9.006670e+06 1.581340e+07 3.612950e+07 C7 H14 N2 O3_7.381 4.545130e+05 4.286503e+05 4.252852e+05 5.112835e+05 1.830244e+05 3.474639e+05 4.012700e+05 3.461501e+05 163246.89 6.975351e+05 3.478803e+05 6.548465e+05 155877.02 2.780295e+05 4.232416e+05 4.221304e+05 1.664128e+05 3.919406e+05 4.820146e+05 3.889355e+05 1.263927e+05 4.557462e+05 4.409205e+05 5.618769e+05 37920.526 3.955323e+05 4.649797e+05 4.136003e+05 2.840247e+04 3.605547e+05 4.370771e+05 5.189577e+05 169964.58 4.107883e+05 4.772930e+05 4.303278e+05 1.491597e+05 3.589644e+05 5.242486e+05 4.716395e+05 1.706363e+05 3.126187e+05 4.399040e+05 6.588893e+05 1.710014e+05 3.670857e+05 3.151342e+05 4.885635e+05 5.254022e+04 2.526771e+05 1.884737e+05 5.214480e+04 4.273584e+04 6.054331e+04 5.923530e+04 8.323932e+04 7.174928e+05 4.868383e+04 5.920392e+04 4.788025e+04 5.132207e+04 1.443686e+05 1.448271e+06 5.362725e+04 5.445202e+04 6.679531e+04 3.635318e+04 5.349663e+04 4.450630e+04 4.274254e+04 6.522724e+04 5.471257e+04 6.114161e+04 3.585235e+04 4.261184e+04 4.278022e+04 2.199238e+05 4.424497e+04 4.717209e+06 6.972051e+04 5.642996e+04 4.057007e+04 4.503216e+04 6.231291e+04 1.235413e+05 7.014911e+04 4.317435e+04 4.323599e+04 4.317875e+05 3.147483e+04 6.617625e+04 5.293744e+04 3.761921e+04 4.176629e+04 8.452313e+04 4.414253e+04 5.934005e+04 5.376316e+04 4.025943e+04 3.537371e+04 3.897468e+04 7.782046e+04 6.624688e+04 6.526721e+04 5.202511e+04 3.857845e+04 4.154377e+04 5.447853e+04 3.659650e+04 2.350177e+06 5.102321e+04 4.035092e+04 5.241254e+04 4.723370e+04 3.740438e+04 7.572465e+04 6.971909e+04 6.890333e+04 8.271825e+04 5.724927e+04 5.316410e+04 4.294750e+04 5.551297e+04 4.324708e+04 5.207599e+04 4.537687e+04 6.629380e+06 7.263826e+04 7.126896e+04 2.257522e+05 3.567366e+04 9.896912e+06 4.964370e+04 3.948977e+04 4.373729e+04 3.809713e+04 5.309412e+04 4.092135e+04 3.913487e+04 6.768860e+04 4.591114e+04 3.888556e+04 4.262403e+04 4.527345e+04 5.737255e+04 4.397343e+04 4.633823e+04 9.548075e+04 8.448143e+04 5.547254e+04 5.940168e+04 5.152069e+04 3.630136e+04 1.484451e+07 5.829363e+04 3.608072e+05 5.112590e+04 8.268589e+04 3.648728e+04 3.407809e+04 5.360608e+04 6.872712e+04 4.010114e+04 2.282780e+05 6.253894e+04 7.901021e+04 3.962949e+04 4.995216e+04 5.037003e+04 4.341091e+05 4.845078e+04 5.423454e+04 4.363517e+04 4.154641e+04 4.610586e+04 4.265610e+04 7.963821e+04 4.673687e+04 4.002468e+04 7.737079e+04 4.593021e+04 6.231100e+04 5.843062e+04 4.304626e+04 3.567629e+04 4.183506e+04 5.906655e+04 5.495727e+04 3.297879e+05 1.728333e+07 1.166074e+05 4.399335e+04 7.442637e+04 7.516571e+04 2.949317e+06 4.374969e+04 6.735943e+04 7.973486e+05 4.551070e+04 5.160970e+04 5.694407e+04 4.203976e+04 3.962924e+04 5.916895e+04 8.325888e+06 1.503164e+07 4.369140e+04 7.185231e+04 3.675399e+04 2.933668e+07 5.237450e+04 4.128090e+04 3.964800e+04 5.020321e+04 4.926106e+04 4.522443e+04 5.681684e+04 7.729786e+04 3.747308e+04 3.542192e+04 4.416217e+04 8.153861e+04 3.965617e+04 4.038540e+04 3.417024e+04 4.136529e+04 4.753075e+04 6.099056e+04 5.595646e+04 5.233074e+04 1.690834e+05 5.567032e+04 6.442017e+04 4.118126e+04 4.273748e+04 9.039718e+04 8.314709e+04 1.017198e+05 4.366391e+04 1.012885e+05 4.913020e+04 4.562997e+04 4.130904e+04 7.850361e+04 1.103753e+06 1.967627e+05 4.831241e+04 5.201168e+04 5.934285e+04 4.685210e+04 4.838089e+04 4.427293e+04 5.264483e+04 8.896305e+04 7.142124e+04 8.824169e+04 5.882193e+04 6.677090e+04 3.535118e+04 4.444217e+04 1.241536e+05 4.570328e+04 C7 H14 N2 O_7.383 2.868910e+06 7.731227e+05 6.930623e+05 7.351102e+05 1.483228e+05 7.873541e+05 8.144007e+05 6.307127e+05 135719.09 9.428160e+05 7.660411e+05 9.376206e+05 123303.06 5.609184e+05 8.135360e+05 7.834513e+05 1.244843e+05 6.697824e+05 8.000432e+05 7.132303e+05 9.593573e+04 7.672213e+05 8.385969e+05 8.686983e+05 28587.237 7.071882e+05 7.252353e+05 7.230424e+05 2.564877e+04 7.710397e+05 7.558578e+05 8.178012e+05 125705.03 7.356077e+05 7.658147e+05 7.566944e+05 1.127698e+05 7.744849e+05 8.089717e+05 8.831679e+05 1.348794e+05 5.653083e+05 7.961605e+05 8.244140e+05 1.371969e+05 7.568368e+05 6.958911e+05 8.077699e+05 6.351043e+05 1.141504e+06 1.609074e+06 7.897711e+05 8.792340e+05 9.130617e+05 1.365255e+06 1.120869e+06 1.204513e+06 1.634737e+06 2.892352e+06 1.006694e+06 1.645946e+06 2.361516e+06 8.131299e+05 1.385044e+06 1.127357e+06 7.179987e+05 3.005512e+05 8.945413e+05 6.566162e+05 4.324581e+05 2.202070e+06 7.286129e+05 1.158662e+06 5.274672e+05 1.348039e+06 1.099849e+06 9.510488e+05 8.383473e+05 1.606370e+06 8.181681e+05 8.702415e+05 4.988953e+05 7.307441e+05 1.102286e+06 6.447924e+05 9.204119e+05 6.396707e+05 5.630740e+05 5.729886e+05 6.438837e+05 8.414385e+05 4.522430e+05 7.298914e+05 8.308962e+05 7.077704e+05 6.877842e+05 9.151011e+05 9.810945e+05 3.860498e+05 9.016024e+05 4.946184e+05 5.034799e+05 5.480176e+05 6.109210e+05 3.856666e+05 7.700482e+05 1.115052e+06 8.868091e+05 7.755284e+05 6.494771e+05 5.501930e+05 8.650946e+05 8.093699e+05 6.578821e+05 5.218895e+05 6.634410e+05 6.499496e+05 1.146305e+06 7.948083e+05 8.573902e+05 5.632192e+05 8.010442e+05 3.394377e+05 5.354310e+05 8.074977e+05 4.868058e+05 1.032261e+06 5.678532e+05 8.826400e+05 5.469447e+05 8.984690e+05 1.173383e+06 5.389212e+05 5.501399e+05 5.695701e+05 3.360336e+05 1.090110e+06 6.025786e+05 4.380333e+05 5.952937e+05 9.890792e+05 1.166226e+06 6.379736e+05 6.375672e+05 1.315623e+06 9.981502e+05 8.233813e+05 1.674737e+06 9.496967e+05 6.596043e+05 5.578448e+05 1.059628e+06 8.570121e+05 8.354161e+05 4.609789e+05 9.526064e+05 8.095790e+05 8.342446e+05 1.046339e+06 8.212610e+05 8.606674e+05 1.385984e+06 4.020211e+05 7.548588e+05 5.732150e+05 5.418582e+05 7.388518e+05 4.960040e+05 1.138820e+06 7.797186e+05 3.815927e+05 3.943231e+05 7.065480e+05 8.643905e+05 1.321682e+06 5.648286e+05 9.815525e+05 5.295655e+05 9.893284e+05 3.938890e+05 3.958696e+05 5.547560e+05 6.070711e+05 4.532225e+05 1.098951e+06 7.458436e+05 6.054701e+05 4.869831e+05 6.329287e+05 8.239932e+05 9.829941e+05 5.613504e+05 4.341144e+05 1.069253e+06 3.873009e+05 4.938475e+05 1.275956e+06 1.198480e+06 9.392455e+05 7.843383e+05 8.306410e+05 7.810567e+05 5.962911e+05 8.468916e+05 4.459267e+05 4.817505e+05 7.376534e+05 7.613644e+05 9.146940e+05 7.256442e+05 8.264002e+05 7.976140e+05 8.482378e+05 5.944422e+05 4.511191e+05 1.077770e+06 4.598725e+05 1.060663e+06 6.082525e+05 8.747629e+05 6.797432e+05 1.046357e+06 6.315060e+05 5.018226e+05 5.327498e+05 4.115612e+05 5.318375e+05 9.149268e+05 4.611579e+05 5.271660e+05 8.877117e+05 4.006565e+05 5.366402e+05 5.840630e+05 8.888096e+05 9.436495e+05 6.885777e+05 1.021158e+06 7.255572e+05 1.158085e+06 1.034188e+06 5.492539e+05 9.776856e+05 6.293838e+05 5.546059e+05 3.714463e+05 6.055773e+05 1.047378e+06 7.757923e+05 3.040533e+05 8.952058e+05 8.579825e+05 6.144797e+05 1.626642e+06 1.246162e+06 3.846533e+05 1.344277e+06 7.930528e+05 1.058293e+06 8.737927e+05 9.919744e+05 1.401175e+06 HOMOCYSTEINE 1.515496e+07 2.995472e+06 3.210580e+06 3.050141e+06 2.416791e+05 3.076258e+06 3.285014e+06 3.339282e+06 225662.94 3.729420e+06 2.381090e+06 4.231112e+06 207350.71 2.597817e+06 3.177977e+06 3.460621e+06 2.076707e+05 2.464001e+06 3.044340e+06 3.774419e+06 1.533007e+05 2.904900e+06 3.194180e+06 3.732613e+06 46246.513 2.723185e+06 3.275820e+06 3.054620e+06 3.467884e+04 2.686060e+06 3.600055e+06 3.212245e+06 195863.06 3.348165e+06 3.075344e+06 3.095887e+06 1.851889e+05 2.937065e+06 3.798961e+06 3.469866e+06 2.411710e+05 2.311999e+06 2.576675e+06 4.276638e+06 2.323904e+05 3.104389e+06 2.613894e+06 3.439800e+06 2.638255e+06 1.829994e+06 2.748470e+07 5.934648e+06 2.605236e+06 3.764413e+06 2.743253e+06 2.361735e+06 5.066145e+06 7.174404e+06 4.106342e+06 3.372815e+06 4.277220e+06 5.181822e+06 2.966254e+06 7.650817e+06 4.083756e+06 2.328762e+06 5.062457e+06 3.305585e+06 2.824304e+06 4.684567e+06 4.745763e+06 2.655228e+06 4.973367e+06 2.509713e+06 2.459126e+06 2.299237e+06 3.950790e+06 1.060642e+07 4.431598e+06 2.868850e+06 4.666655e+06 2.247221e+06 3.117058e+06 4.194955e+06 2.483200e+06 2.869962e+06 1.666426e+06 1.081209e+06 4.202263e+06 3.899051e+06 3.041872e+06 1.117334e+07 1.887668e+06 2.821532e+06 2.754375e+06 9.141194e+06 2.452214e+06 4.054873e+06 1.965843e+06 2.662819e+06 1.660886e+06 1.411843e+06 2.761421e+06 3.053857e+06 4.604592e+06 3.888584e+06 2.794568e+06 1.603753e+06 3.862606e+06 2.196370e+06 1.496844e+06 8.685221e+06 3.286230e+06 2.814691e+06 2.056332e+06 4.909609e+06 5.639223e+06 6.403234e+06 3.234704e+06 3.524349e+06 1.325760e+06 3.456336e+06 1.805229e+06 2.730014e+06 2.842143e+06 2.850552e+06 3.642687e+06 2.428376e+06 2.558778e+06 1.920627e+06 5.629246e+06 2.495319e+06 2.393824e+06 1.532786e+06 3.540479e+06 2.585705e+06 2.857354e+06 4.493425e+06 2.279812e+06 2.438734e+06 3.584491e+06 2.603794e+06 1.828519e+06 3.727679e+06 3.584749e+06 2.026632e+06 2.875657e+06 1.990010e+06 2.360600e+06 1.661909e+06 9.623477e+06 2.271324e+06 2.048865e+06 3.687908e+06 6.662620e+06 4.334138e+06 1.761920e+06 2.796229e+06 1.666529e+06 4.027640e+06 3.082524e+06 2.522367e+06 3.797313e+06 3.055386e+06 1.619703e+06 3.070721e+06 3.067179e+06 2.703863e+06 2.083879e+06 4.258059e+06 6.238834e+06 4.442374e+06 5.172232e+06 2.402107e+06 2.785403e+06 2.779333e+06 6.678610e+06 6.772491e+06 3.607332e+06 1.679857e+06 2.022009e+06 4.068575e+06 2.685493e+06 1.798881e+06 1.736614e+06 6.999322e+06 2.132735e+06 3.485191e+06 1.387587e+06 2.209256e+06 9.903594e+06 1.843724e+06 4.849679e+06 2.827056e+06 1.488339e+06 2.406057e+06 2.529365e+06 2.187510e+06 2.969468e+06 2.247067e+06 5.937628e+06 2.376976e+06 3.462674e+06 1.065219e+07 9.397916e+06 1.466940e+06 3.055731e+06 1.739715e+06 2.680210e+06 1.807739e+06 3.257442e+06 3.237857e+06 3.013209e+06 2.027795e+06 1.852591e+06 2.250971e+06 3.484917e+06 2.194211e+06 2.688063e+06 1.703517e+06 1.936475e+06 1.865169e+06 3.488686e+06 1.432945e+06 3.194385e+06 1.456590e+06 6.536919e+06 2.904363e+06 2.651670e+06 2.458844e+06 2.164272e+06 2.369855e+06 1.722845e+06 1.841519e+06 1.843741e+06 3.203039e+06 2.060910e+06 2.484868e+06 2.682384e+06 1.646741e+06 3.332526e+06 3.148181e+06 7.531299e+06 3.832421e+06 2.868572e+06 2.737265e+06 8.750614e+06 1.402772e+06 2.637897e+06 1.880142e+06 4.194249e+06 4.024304e+06 2.376575e+06 7.900159e+06 1.349309e+07 2.250021e+06 9.196333e+06 2.978619e+06 4.788401e+06 1.909397e+06 3.620974e+06 9.233737e+06 4-guanidinobutanal_7.389 6.540461e+04 4.283484e+05 4.655543e+05 4.903786e+05 1.462952e+05 4.626420e+05 4.547478e+05 5.706256e+05 141168.64 4.706217e+05 3.846564e+05 6.033563e+05 130188.76 3.627375e+05 4.493304e+05 5.218283e+05 1.283719e+05 4.548596e+05 4.606497e+05 4.803538e+05 1.044898e+05 4.220990e+05 4.974223e+05 5.250588e+05 31121.648 4.439786e+05 4.449397e+05 4.886172e+05 2.894389e+04 4.223979e+05 4.744822e+05 5.697907e+05 133983.68 3.934449e+05 4.921100e+05 4.787876e+05 1.303425e+05 4.375211e+05 5.267901e+05 5.019935e+05 1.592088e+05 3.139277e+05 5.473593e+05 5.536817e+05 1.466464e+05 3.616727e+05 4.186222e+05 5.315563e+05 2.566257e+05 2.426415e+05 6.724782e+05 8.686639e+05 5.056268e+05 7.990758e+05 6.276643e+05 6.205106e+05 1.896117e+06 1.341124e+06 1.195280e+06 5.289977e+05 7.937444e+05 6.661547e+05 5.089468e+05 8.196068e+05 5.583799e+05 3.968805e+05 5.363864e+05 6.855157e+05 5.040494e+05 5.828543e+05 9.164922e+05 5.751673e+05 5.779207e+05 6.985176e+05 9.825140e+05 5.586157e+05 4.400036e+05 5.034435e+05 5.781893e+04 2.766190e+05 7.323612e+04 4.056279e+05 4.175110e+05 7.243856e+05 1.853478e+05 6.082717e+04 3.528581e+05 2.753987e+05 5.056823e+05 5.888345e+05 3.994713e+05 5.873426e+05 9.023566e+05 6.116786e+05 4.313453e+05 6.009134e+05 7.729235e+05 4.447364e+05 1.749560e+05 2.876467e+05 3.291918e+05 2.649421e+05 2.749784e+05 4.110026e+05 3.886883e+05 4.377333e+05 7.040327e+05 4.952197e+05 1.629493e+05 4.169791e+05 3.893131e+05 4.966517e+05 2.954472e+05 2.463042e+05 2.900399e+05 7.165437e+05 4.471859e+05 3.576783e+05 6.746074e+04 3.776622e+05 2.918735e+05 4.856776e+05 3.121568e+05 4.328089e+05 5.637582e+05 1.935080e+05 5.526323e+05 2.279404e+05 8.355499e+04 2.451166e+05 4.690045e+05 5.748636e+05 2.826170e+05 3.604185e+05 4.901422e+05 2.451473e+05 4.309671e+05 4.119781e+05 2.939992e+05 4.556802e+04 6.276274e+04 2.457209e+05 3.476795e+05 1.826917e+05 3.969095e+05 1.434894e+05 2.732523e+05 2.336724e+05 8.551777e+04 3.005283e+05 5.004644e+04 2.721922e+05 3.485899e+05 2.411587e+05 4.875992e+04 4.683424e+05 5.279055e+05 3.915099e+05 2.005725e+05 1.995884e+05 3.375363e+05 6.402412e+04 4.299238e+05 4.013292e+05 5.369443e+05 2.381586e+05 3.635013e+05 3.588863e+05 5.604644e+05 5.991027e+05 7.212952e+04 8.147734e+04 1.073725e+06 2.416431e+05 2.993585e+05 1.802626e+05 1.010665e+06 6.314335e+05 6.615002e+05 3.015483e+05 3.000395e+05 6.764849e+04 5.715127e+05 2.467562e+05 1.600483e+05 3.467120e+05 3.001206e+05 2.721125e+05 2.482169e+05 4.773066e+05 4.821172e+05 1.644541e+05 1.862817e+05 4.467643e+05 2.577203e+05 5.897487e+05 1.874306e+05 1.791345e+05 3.911049e+05 3.085795e+05 5.703018e+05 3.523179e+05 1.576383e+05 4.243703e+05 3.126449e+05 2.029083e+05 5.061883e+05 2.901501e+05 5.290684e+05 3.820535e+05 1.107795e+06 5.282206e+05 5.189067e+05 2.530624e+05 1.324736e+05 6.354791e+05 2.593598e+05 6.357724e+05 6.323153e+05 5.284773e+05 4.134357e+05 1.848787e+05 8.812223e+05 8.658632e+05 1.051430e+06 5.712093e+05 1.570972e+06 1.380803e+06 9.675999e+05 7.117670e+05 3.355125e+05 1.993078e+05 5.609638e+04 4.023231e+05 3.396087e+05 5.664718e+05 7.679068e+05 1.096180e+05 3.838765e+05 8.329796e+04 7.232987e+04 1.488824e+05 4.002045e+04 6.572224e+04 9.744652e+04 1.513234e+05 2.111984e+05 1.785643e+05 1.712412e+05 2.671993e+05 3.125153e+05 1.873834e+05 2.227548e+05 4.471984e+05 5.188501e+05 4.924021e+04 7.053507e+05 5.017003e+04 3.778680e+04 1.816135e+05 4.154471e+05 4.137872e+05 PIPECOLATE 2.489665e+08 1.194150e+08 1.172938e+08 1.184349e+08 5.062390e+05 1.169123e+08 1.180234e+08 1.140597e+08 166675.72 1.536270e+08 7.254696e+07 1.628596e+08 204954.27 9.439853e+07 1.252037e+08 1.217447e+08 1.382895e+05 1.162845e+08 1.171323e+08 1.157096e+08 1.136192e+05 1.117883e+08 1.251022e+08 1.393805e+08 32603.720 1.101005e+08 1.165808e+08 1.130480e+08 2.567310e+04 1.142685e+08 1.188759e+08 1.287667e+08 138343.81 1.143393e+08 1.225819e+08 1.234866e+08 1.312419e+05 1.193961e+08 1.392012e+08 1.432389e+08 1.776085e+05 2.678577e+07 1.442133e+08 1.381428e+08 1.557402e+05 1.187129e+08 1.083112e+08 1.238584e+08 4.455549e+07 3.703558e+07 7.522208e+07 1.779712e+08 1.111084e+08 1.103396e+08 4.728293e+07 6.047469e+07 1.081226e+08 1.287934e+08 2.159828e+08 1.153290e+08 6.014423e+07 7.583310e+07 2.306961e+07 1.504142e+08 4.306070e+07 1.782500e+07 8.891679e+07 1.166780e+08 9.977146e+07 1.228801e+08 9.751031e+07 7.088158e+07 5.923136e+07 1.125631e+08 3.950380e+07 1.369078e+08 2.128150e+07 2.054373e+08 4.935818e+08 4.199545e+08 2.572990e+08 3.891548e+07 1.375483e+08 3.269075e+07 2.430544e+08 4.693713e+08 2.836799e+07 1.197919e+08 2.687742e+07 1.511035e+07 3.480607e+07 2.191084e+08 5.015291e+07 2.336251e+07 6.406558e+07 1.190721e+08 8.363343e+07 4.852213e+07 2.100890e+07 5.586642e+07 4.681182e+07 2.391304e+08 5.420132e+07 3.612918e+07 3.202829e+07 2.231150e+07 7.519056e+07 2.689956e+08 7.305172e+07 2.569627e+07 3.222723e+07 1.119758e+08 1.024294e+08 4.880792e+07 2.934918e+07 3.783234e+07 4.656535e+07 5.723193e+07 6.263362e+08 9.679685e+07 2.051800e+08 9.964322e+07 8.762511e+07 4.966740e+07 4.604455e+07 1.024844e+08 3.974808e+07 2.456927e+07 4.780749e+08 1.551499e+07 5.215373e+07 5.696042e+07 1.834564e+08 2.807539e+07 5.172776e+07 6.569256e+07 7.820793e+07 9.352166e+07 1.120750e+08 3.442836e+08 9.103545e+07 7.090866e+07 3.112135e+07 1.849535e+08 5.681952e+07 7.674624e+07 3.366081e+07 2.683577e+07 3.435941e+07 8.971646e+06 2.994747e+08 6.916953e+07 3.478420e+07 3.920273e+08 3.622396e+08 3.360508e+07 3.950412e+07 8.024984e+07 4.763377e+07 4.694320e+07 2.665889e+07 4.534591e+08 6.310695e+07 4.875525e+07 3.399493e+08 6.111254e+07 3.808461e+07 8.921741e+07 2.369880e+08 5.802315e+07 1.909593e+08 9.681292e+07 8.208658e+07 4.864970e+07 3.157034e+07 6.157589e+06 2.633498e+07 4.729166e+07 7.731749e+07 3.768225e+07 3.377726e+07 3.126952e+07 1.066942e+08 2.946407e+07 2.915128e+07 7.122249e+07 1.940563e+08 3.068110e+07 6.046502e+07 7.629962e+07 1.449868e+08 1.167635e+08 2.984069e+07 3.180655e+07 1.757986e+07 9.436284e+07 6.428630e+07 1.996773e+08 8.885800e+07 1.115663e+08 1.091661e+08 4.258825e+07 3.640070e+07 2.026869e+08 1.057860e+08 1.894279e+07 7.697826e+07 3.716259e+08 2.735200e+07 3.180150e+07 3.489563e+07 1.140740e+08 9.011601e+07 4.618382e+07 4.177307e+07 4.749700e+07 5.331215e+07 6.920786e+07 2.372524e+07 2.608901e+07 2.181555e+07 6.039331e+08 8.523180e+07 2.652119e+07 2.870417e+07 1.830546e+07 4.309094e+07 3.262823e+07 5.488114e+07 6.234013e+07 3.795555e+07 5.598841e+07 3.906727e+08 3.328270e+07 3.152420e+07 3.991245e+07 9.442519e+07 1.013193e+08 3.919671e+07 4.774343e+08 8.479624e+07 4.085517e+07 1.413023e+08 1.502091e+08 2.446760e+07 6.127806e+07 1.401419e+08 7.235725e+07 3.984609e+07 1.435344e+08 4.309919e+07 7.604282e+07 9.310136e+07 1.542349e+08 1.002879e+08 4.736238e+06 1.964753e+08 3.054604e+08 7.265207e+07 1.090332e+08 4.372603e+07 5.615679e+07 C8 H15 N O4 S_7.402 2.804757e+06 4.866678e+05 6.362665e+05 5.918853e+05 1.440843e+05 5.577154e+05 5.774005e+05 5.190549e+05 131168.41 7.792611e+05 3.553215e+05 8.022583e+05 122639.04 4.617265e+05 5.993209e+05 5.719894e+05 1.059370e+05 5.718275e+05 5.295062e+05 6.076192e+05 8.855684e+04 5.216873e+05 6.223488e+05 7.224530e+05 24840.173 4.635342e+05 5.839798e+05 5.976102e+05 2.117155e+04 5.045523e+05 5.677499e+05 6.276241e+05 115691.39 5.227016e+05 6.545258e+05 5.343055e+05 1.047207e+05 5.192255e+05 6.999650e+05 6.036184e+05 1.346024e+05 4.001445e+05 6.486988e+05 6.718771e+05 1.365543e+05 5.382550e+05 4.723893e+05 6.344963e+05 1.245819e+06 7.531835e+05 1.899868e+06 6.259305e+05 5.705078e+05 3.476488e+05 5.869645e+05 5.305561e+05 1.811639e+06 1.450835e+06 7.334835e+05 1.320961e+06 1.072702e+06 1.043336e+06 5.448044e+05 1.511554e+06 5.903674e+05 6.032753e+05 3.412666e+05 4.770905e+05 5.269759e+05 6.472973e+05 5.967022e+05 6.164814e+05 1.267632e+06 3.726913e+05 6.856221e+05 6.367253e+05 1.102003e+06 2.919954e+05 2.669929e+05 3.379865e+05 5.800403e+05 2.987789e+05 8.786863e+05 6.507973e+05 3.489756e+05 4.038766e+05 2.121000e+05 4.289978e+05 5.025709e+05 6.732651e+05 3.305218e+05 3.913802e+05 1.077389e+06 2.760908e+05 5.545046e+05 4.735746e+05 5.283061e+05 2.785363e+05 2.930933e+05 3.904534e+05 2.971579e+05 2.537328e+05 1.300170e+05 1.110428e+06 9.814701e+05 1.107059e+06 4.595996e+05 3.575022e+05 2.578669e+05 5.653479e+05 4.074971e+05 3.289287e+05 2.639982e+05 1.774494e+05 1.625754e+05 8.046088e+05 5.142167e+05 5.052698e+05 1.046605e+05 2.534006e+05 2.862602e+05 1.233436e+06 4.374607e+05 4.139977e+05 6.119351e+05 3.975385e+05 1.847931e+06 6.671692e+05 3.412968e+05 8.390869e+05 1.761659e+06 5.447934e+05 6.166347e+05 3.577752e+05 3.453497e+05 1.055958e+06 8.576048e+05 9.622442e+04 3.108373e+05 2.769755e+05 2.725113e+05 2.857601e+05 4.135031e+05 3.943988e+05 1.204413e+06 1.123763e+06 8.182219e+05 3.458445e+05 6.070255e+05 3.373775e+05 4.002265e+05 9.135394e+05 7.022664e+05 1.802926e+05 2.026496e+05 1.154584e+06 1.526555e+06 1.410888e+06 1.083658e+06 4.960291e+05 1.010600e+06 9.539254e+05 4.059171e+05 8.831993e+04 2.551478e+05 1.127131e+06 1.226620e+06 4.618080e+05 5.219146e+05 9.421422e+05 1.314588e+05 1.098973e+05 4.708047e+05 1.223234e+06 6.360181e+05 1.602639e+05 1.348026e+06 7.332466e+05 4.062921e+05 5.606318e+05 2.389068e+05 4.424380e+05 8.622320e+04 6.984953e+05 2.559084e+05 5.536531e+05 9.882656e+05 4.602830e+05 4.289396e+05 9.399572e+05 4.940638e+05 1.991160e+05 1.012620e+06 2.708921e+05 1.982066e+05 2.853495e+05 5.150927e+05 7.186723e+05 1.551694e+06 7.005766e+05 1.809418e+06 1.630656e+06 3.343142e+05 4.169313e+05 1.092709e+05 5.147617e+05 1.068746e+06 8.428303e+05 8.841998e+05 6.959564e+05 1.164225e+06 1.329488e+06 5.613627e+05 4.236883e+05 6.043516e+05 4.561792e+05 2.306587e+05 1.685489e+05 2.637016e+05 1.137133e+06 1.239854e+06 4.422685e+05 7.758668e+05 7.070514e+05 5.278051e+05 4.456330e+05 3.589968e+05 3.514955e+05 5.082536e+05 3.480731e+05 1.499322e+06 1.267752e+06 4.080901e+05 3.604120e+05 1.395966e+06 2.431749e+06 3.647542e+05 6.573220e+05 6.863663e+05 4.905141e+05 4.079419e+05 6.253460e+05 8.299177e+05 5.249248e+05 6.586653e+05 7.881076e+05 6.491890e+05 1.398387e+06 1.492961e+06 1.828296e+05 8.825152e+05 8.731159e+05 4.997677e+05 8.986156e+05 2.106614e+06 7.580537e+05 7.906466e+05 1.394330e+05 2.564015e+05 7.030061e+05 1.371432e+06 9.361797e+05 C3 H8 N10 O7_7.404 2.090762e+06 6.363150e+05 4.756853e+05 6.282197e+05 1.770588e+05 6.400045e+05 5.760527e+05 4.737882e+05 136030.94 8.858407e+05 4.063093e+05 8.989918e+05 117966.95 4.636319e+05 5.349125e+05 6.417409e+05 1.011097e+05 4.519164e+05 7.892852e+05 5.508532e+05 8.624186e+04 5.718202e+05 7.764502e+05 4.938816e+05 30283.839 6.120502e+05 6.980433e+05 5.387802e+05 3.104850e+04 3.189111e+05 6.163338e+05 7.502669e+05 153359.32 6.028148e+05 7.526714e+05 3.344788e+05 1.287563e+05 1.690187e+05 7.996872e+05 6.764521e+05 1.651708e+05 9.880484e+04 6.464945e+05 6.259870e+05 1.787460e+05 3.596385e+05 2.697660e+05 9.338723e+05 6.191046e+05 3.397349e+05 1.171219e+06 1.775558e+06 4.952658e+05 5.027977e+05 7.106271e+05 1.096127e+06 2.330288e+06 1.467822e+06 5.543839e+05 3.122375e+06 1.068556e+06 5.782830e+05 3.923937e+05 1.291702e+06 1.723306e+05 4.984649e+05 4.329973e+05 1.253714e+06 1.944957e+05 9.051838e+05 1.690917e+06 6.781187e+05 1.176532e+06 3.842079e+05 1.014248e+06 4.956808e+04 8.400151e+05 7.788620e+05 5.596667e+05 5.364749e+05 3.905633e+05 2.311870e+05 2.725466e+05 5.641863e+05 2.517576e+05 5.004299e+05 5.330322e+04 3.644248e+04 3.179680e+05 1.095475e+05 7.414795e+05 2.653397e+05 4.021951e+05 2.645087e+05 1.020447e+05 8.057364e+05 2.836958e+05 7.136795e+04 6.323871e+05 7.590072e+05 1.635556e+05 7.139545e+04 4.786857e+05 1.741980e+06 1.002328e+06 6.457305e+05 5.192348e+05 2.034373e+05 1.181756e+05 2.013943e+05 2.816580e+05 5.529475e+05 1.178809e+06 8.573689e+04 2.843746e+05 1.972633e+05 3.978058e+05 3.923559e+05 9.866329e+04 1.211199e+05 2.887782e+05 6.315237e+05 2.100913e+05 7.849899e+05 8.525207e+05 7.982841e+05 7.907504e+05 5.226763e+05 3.421354e+05 5.238540e+05 1.054069e+05 8.247193e+05 1.487073e+05 8.184183e+04 8.445132e+05 7.018823e+05 9.779577e+05 2.838032e+05 4.609873e+05 1.160900e+05 7.571774e+05 2.669635e+05 2.403554e+05 7.186529e+04 5.605512e+05 1.150209e+06 5.938024e+05 8.236362e+04 3.293615e+05 7.346237e+04 1.004896e+06 1.809107e+06 2.771708e+05 1.169442e+06 4.612242e+05 5.970068e+05 1.622074e+05 4.285181e+05 1.099227e+06 4.883838e+05 4.767660e+05 7.171555e+05 6.171005e+05 6.917666e+05 3.012613e+05 1.060776e+06 5.727751e+05 7.176822e+05 2.932714e+05 8.358225e+05 2.946686e+05 8.579459e+05 2.818583e+05 8.168656e+05 7.253552e+04 2.895978e+05 6.211397e+04 6.529293e+05 1.883341e+05 2.751754e+05 5.223136e+05 1.302702e+05 7.717732e+05 3.825278e+05 4.505831e+05 9.988988e+05 7.530093e+05 5.918309e+04 2.361105e+05 8.787597e+05 1.117194e+06 7.321644e+04 6.911531e+06 8.323807e+05 3.097257e+05 1.061630e+05 2.265557e+05 1.003874e+06 4.119335e+05 3.627735e+04 1.426818e+06 1.000492e+06 4.314178e+04 4.454609e+05 5.565747e+05 2.102053e+05 1.275245e+06 4.093507e+05 7.666846e+05 9.356114e+05 5.625769e+05 6.195246e+05 7.159489e+05 3.501433e+05 2.042562e+05 5.532727e+05 2.178592e+05 7.393959e+04 1.729949e+05 6.906054e+05 8.275947e+05 2.817032e+05 5.255362e+05 1.877952e+05 5.053802e+05 2.799600e+05 7.523952e+05 3.280829e+05 3.609792e+05 1.347001e+06 2.454081e+05 8.028430e+05 4.461090e+05 5.152903e+05 2.504357e+05 1.131861e+06 9.401169e+05 3.884104e+05 1.094799e+06 8.638331e+05 1.200835e+06 1.412992e+06 1.030609e+06 8.572007e+05 1.363603e+06 5.511451e+05 2.129008e+06 1.092164e+06 5.741373e+05 6.190414e+05 1.595789e+06 6.849795e+05 6.514120e+05 1.593032e+06 2.351499e+06 6.442955e+05 7.584606e+05 1.280856e+05 4.440070e+05 6.225315e+05 4.347885e+05 5.773351e+05 4-hydroxy-3-methoxyamphetamine_7.405 1.184927e+05 3.468771e+06 3.266207e+06 3.043294e+06 1.928014e+05 3.195681e+06 3.107519e+06 3.668469e+06 177911.13 3.807755e+06 2.892758e+06 4.257110e+06 183708.50 2.760242e+06 3.719643e+06 3.820677e+06 1.842159e+05 1.621952e+06 3.476271e+06 3.472564e+06 1.445399e+05 2.839886e+06 3.968976e+06 4.362710e+06 39954.975 2.489125e+06 3.124797e+06 3.356533e+06 3.430215e+04 3.325905e+06 3.090806e+06 3.691270e+06 180249.64 3.465698e+06 2.954830e+06 2.879156e+06 1.587866e+05 3.448117e+06 3.524934e+06 4.183346e+06 1.904360e+05 2.656448e+06 3.533070e+06 3.497878e+06 1.778223e+05 2.919459e+06 2.754768e+06 3.852253e+06 3.191377e+06 2.161300e+06 2.112470e+06 6.607056e+06 4.377357e+06 3.950225e+06 5.391166e+06 9.445532e+06 9.700538e+06 8.704882e+06 9.196144e+06 5.048064e+06 8.408400e+06 6.832983e+06 4.517859e+06 3.583951e+06 2.424509e+06 1.074390e+06 4.677349e+06 6.444581e+06 5.114456e+06 3.309210e+06 4.595277e+06 7.896132e+06 5.433683e+06 5.170170e+06 2.864594e+06 3.101259e+06 2.501069e+06 3.974858e+06 1.425533e+05 4.209056e+06 2.771358e+06 2.500282e+06 1.811962e+06 1.660581e+06 1.564841e+06 2.630935e+06 2.129092e+06 1.348034e+06 1.574234e+06 3.230641e+06 3.215554e+06 2.147839e+06 5.272397e+06 3.062748e+06 1.541231e+06 5.009670e+06 3.585487e+06 3.434324e+06 2.265798e+06 1.988378e+06 2.338361e+06 7.217957e+06 1.942712e+06 2.973488e+06 3.338763e+06 3.504931e+06 2.340436e+06 7.377583e+06 3.168523e+06 1.310667e+06 2.047423e+06 3.846387e+06 3.946666e+06 3.690640e+06 2.309361e+06 2.050684e+06 2.770883e+06 2.941834e+06 4.154658e+06 4.468985e+06 1.494472e+06 2.083033e+06 1.853211e+06 3.876160e+06 2.267013e+06 1.581646e+06 4.388829e+06 2.213942e+06 4.420112e+06 2.140453e+06 4.622781e+06 7.165426e+04 1.729202e+06 3.645272e+06 4.597350e+06 1.400946e+06 2.390254e+06 3.030302e+06 2.585030e+06 4.213619e+06 2.911478e+06 3.899316e+06 5.031361e+06 3.675727e+06 4.085241e+06 2.485413e+06 3.640548e+06 4.190130e+06 3.867662e+06 4.533322e+06 4.154468e+06 3.253197e+06 3.674612e+06 2.391970e+06 2.546581e+06 2.985231e+06 5.174766e+06 6.358121e+06 3.685636e+06 1.780524e+06 2.502338e+06 3.351546e+06 2.848435e+06 2.893551e+06 2.589340e+06 1.678817e+06 2.485597e+06 2.572325e+06 1.798128e+06 3.648266e+06 3.264953e+06 2.724531e+06 4.064710e+06 1.377512e+06 2.861074e+06 1.748532e+06 4.418005e+06 3.438899e+06 5.745759e+06 4.130027e+06 2.246745e+06 2.198995e+06 3.730302e+06 2.731603e+06 1.369831e+06 2.571866e+06 1.675004e+06 2.889438e+06 1.896707e+06 1.409569e+06 2.423351e+06 3.275321e+06 1.469435e+06 4.106812e+06 3.567243e+06 2.804576e+06 5.007324e+06 2.142456e+06 2.885091e+06 3.079985e+06 2.661441e+06 2.208085e+06 2.603771e+06 5.095468e+06 3.002164e+06 3.404998e+06 3.206507e+06 1.035707e+06 4.163792e+06 4.269263e+06 1.484001e+06 1.739279e+06 1.498844e+06 2.493806e+06 1.376871e+06 3.221532e+06 3.759359e+06 1.358572e+06 3.299380e+06 3.658559e+06 2.167584e+06 4.029060e+06 1.520673e+06 2.263928e+06 3.874709e+06 2.867624e+06 4.187024e+06 3.395805e+06 3.778082e+06 2.892892e+06 3.512940e+06 1.961724e+06 5.195019e+06 2.894020e+06 1.990613e+06 2.008729e+06 4.304684e+06 3.007755e+06 4.436187e+06 2.681738e+06 6.772070e+06 2.131088e+06 2.615296e+06 4.476926e+06 3.705878e+06 3.444877e+06 3.755344e+06 1.520370e+06 2.457160e+06 4.813735e+06 6.268588e+06 5.827553e+06 3.577510e+06 2.405522e+06 1.097188e+07 1.661944e+06 4.512472e+06 4.464346e+06 3.832909e+06 4.895920e+06 3.826691e+06 3.936711e+06 C11 H6 N3 O4 P_7.416 3.409154e+07 1.365442e+07 1.239951e+07 1.428950e+07 8.371687e+05 1.617617e+07 1.109838e+07 1.121288e+07 633926.81 1.958957e+07 1.164831e+07 1.955460e+07 549403.71 1.205330e+07 1.321945e+07 1.446972e+07 9.075359e+05 1.337296e+07 1.284969e+07 1.369122e+07 4.465053e+05 1.259381e+07 1.619914e+07 1.639702e+07 133922.813 1.339070e+07 1.325307e+07 1.274680e+07 1.241097e+05 1.432852e+07 1.316315e+07 1.638646e+07 656328.97 1.344082e+07 1.409522e+07 1.437400e+07 5.871030e+05 1.254900e+07 1.425702e+07 1.397340e+07 6.802000e+05 1.221292e+07 1.734923e+07 1.366193e+07 5.756206e+05 1.331116e+07 1.306256e+07 1.487664e+07 1.254819e+07 8.073928e+06 1.527599e+07 2.392868e+07 1.493900e+07 1.685112e+07 1.786233e+07 1.514309e+07 2.471933e+07 2.138230e+07 2.251737e+07 3.277540e+07 2.023328e+07 1.785631e+07 1.098999e+07 2.780306e+07 3.306419e+07 1.142250e+07 8.415286e+06 1.654167e+07 1.123881e+07 1.527450e+07 3.360591e+07 1.454488e+07 1.642194e+07 1.032858e+07 1.609658e+07 9.175223e+06 1.885822e+07 1.437574e+07 1.396153e+07 1.187556e+07 1.333027e+07 1.082223e+07 1.166342e+07 1.271867e+07 1.088931e+07 1.337435e+07 8.701519e+06 4.492875e+06 1.191154e+07 1.030396e+07 1.438239e+07 1.029669e+07 1.700431e+07 1.367433e+07 9.070219e+06 1.482274e+07 1.369690e+07 1.134587e+07 1.587585e+07 1.122498e+07 7.511894e+06 1.172336e+07 1.079758e+07 1.885931e+07 1.820867e+07 1.303803e+07 1.571629e+07 1.243093e+07 1.036308e+07 1.214786e+07 9.795125e+06 1.064199e+07 2.015434e+07 1.465228e+07 7.881038e+06 9.632718e+06 1.180272e+07 1.472325e+07 1.270893e+07 1.347475e+07 1.020772e+07 1.442986e+07 7.475871e+06 1.440133e+07 1.459355e+07 1.395733e+07 2.256499e+07 1.269192e+07 1.384928e+07 1.086494e+07 1.638182e+07 1.599308e+07 9.056611e+06 9.565152e+06 1.359520e+07 1.008353e+07 1.470932e+07 8.674764e+06 1.183393e+07 1.299709e+07 1.424371e+07 1.889156e+07 8.783934e+06 8.571903e+06 2.190206e+07 1.661763e+07 1.411430e+07 1.208134e+07 2.081521e+07 7.985488e+06 1.875957e+07 1.605161e+07 1.149177e+07 1.680109e+07 1.120038e+07 2.009007e+07 1.084455e+07 1.653280e+07 1.634666e+07 7.852058e+06 1.239122e+07 1.859114e+07 1.420669e+07 1.750719e+07 1.447203e+07 1.161484e+07 1.395980e+07 1.362416e+07 1.241360e+07 1.901477e+07 1.039918e+07 1.389051e+07 1.103220e+07 1.546420e+07 1.343453e+07 9.189654e+06 2.069944e+07 1.414160e+07 1.142888e+07 8.982492e+06 1.140468e+07 1.821993e+07 1.480768e+07 9.885398e+06 1.167676e+07 1.585295e+07 1.447038e+07 1.199283e+07 1.014777e+07 1.594455e+07 1.482367e+07 8.173100e+06 5.553965e+07 1.673736e+07 7.729106e+06 7.995295e+06 2.367983e+07 1.912367e+07 1.205736e+07 1.613162e+07 2.250529e+07 1.433370e+07 1.146106e+07 1.831821e+07 9.956399e+06 6.126906e+06 1.651073e+07 1.299579e+07 1.352151e+07 1.782235e+07 1.574052e+07 1.390962e+07 1.242974e+07 1.763146e+07 8.073194e+06 1.288271e+07 1.230446e+07 1.477368e+07 9.422206e+06 1.241563e+07 1.245792e+07 1.515346e+07 1.060368e+07 9.487108e+06 1.114947e+07 8.816631e+06 1.842519e+07 1.164754e+07 1.060559e+07 2.365989e+07 1.088524e+07 1.543543e+07 1.252680e+07 1.135919e+07 1.134069e+07 2.193652e+07 2.547711e+07 1.678967e+07 1.563269e+07 1.665092e+07 2.278060e+07 2.106069e+07 1.496721e+07 1.575893e+07 1.715734e+07 1.340042e+07 2.215612e+07 1.752685e+07 1.233755e+07 1.040017e+07 2.253599e+07 1.622489e+07 1.867921e+07 2.544167e+07 3.494069e+07 1.017009e+07 1.934969e+07 1.031934e+07 8.787165e+06 1.347676e+07 1.304817e+07 1.462421e+07 C7 H4 Cl N3 O S_7.42 7.987392e+07 2.538585e+08 1.776893e+08 2.415498e+08 2.147380e+07 2.303355e+08 2.733719e+08 2.342539e+08 23705331.14 1.624541e+07 6.076417e+07 4.175119e+08 1221628.75 2.537668e+08 1.538938e+08 1.853961e+08 1.253852e+06 3.646455e+08 4.814861e+07 2.830387e+08 1.182518e+06 9.279581e+05 8.464025e+07 2.194480e+08 1877499.111 1.695492e+08 2.556812e+08 1.221066e+08 2.415983e+06 2.236081e+08 3.017301e+08 1.935278e+08 9044190.00 1.821392e+08 2.449765e+08 2.610750e+08 1.138128e+07 7.214774e+07 1.859178e+08 1.681844e+08 1.132029e+06 1.116977e+08 3.806574e+08 9.934673e+07 8.437420e+06 2.663866e+08 3.573139e+08 7.977030e+07 2.893783e+08 3.296340e+07 1.533809e+08 9.145156e+05 2.904171e+08 1.106760e+06 1.036991e+08 2.382041e+08 4.935881e+06 1.172429e+08 1.987924e+08 1.278921e+08 1.176227e+08 1.338183e+08 9.078953e+07 3.639157e+06 4.930680e+08 5.748341e+07 1.395255e+08 5.398611e+07 3.945151e+08 2.171151e+07 6.068417e+08 5.129623e+07 3.226197e+07 3.600655e+07 4.509937e+06 6.275451e+07 1.405587e+06 5.347439e+06 2.341234e+08 2.283527e+08 1.014287e+09 8.431175e+05 2.742034e+08 3.967585e+07 2.793818e+08 2.139108e+08 4.444518e+07 1.950298e+07 4.083753e+06 1.210130e+07 1.610697e+07 2.597427e+08 3.458565e+07 2.698640e+08 1.287820e+08 2.119315e+08 3.244464e+07 2.329006e+07 4.868368e+08 2.061130e+06 9.812621e+07 2.977569e+07 2.795644e+08 1.167264e+08 1.358055e+08 2.999553e+07 1.975801e+07 1.289772e+08 1.371147e+08 1.971367e+08 1.315068e+08 2.778482e+08 1.112441e+07 4.162405e+07 1.249261e+08 2.206151e+07 3.353533e+08 2.093418e+08 7.670444e+07 3.008347e+08 1.044968e+08 3.303807e+06 9.826508e+07 1.467526e+06 2.359387e+06 1.645004e+07 2.134148e+08 1.331135e+08 4.477734e+08 1.901175e+08 6.355996e+06 7.943420e+07 1.125915e+07 1.432678e+08 3.907812e+08 1.438809e+08 2.131905e+08 1.552543e+07 2.615799e+08 2.280363e+08 2.055211e+08 5.067862e+08 3.555944e+07 1.870925e+07 5.327444e+08 1.095695e+08 2.197874e+08 2.088518e+08 2.524491e+08 1.168255e+08 3.919004e+08 1.760377e+08 2.255866e+08 2.663152e+08 3.015659e+08 5.612354e+08 7.644402e+07 5.068930e+08 2.293561e+06 1.781913e+08 7.436814e+07 2.127700e+08 1.179483e+08 1.309141e+08 2.097445e+08 1.594994e+07 9.514919e+06 2.423856e+07 1.142853e+08 1.236134e+06 1.274682e+08 2.014228e+08 5.987768e+06 2.295450e+06 2.511457e+07 2.585642e+08 1.438746e+08 1.783389e+08 6.185076e+06 1.781054e+08 1.611668e+08 2.076269e+07 1.899202e+08 6.873095e+08 2.286324e+08 1.402406e+08 5.104182e+07 2.779557e+08 3.622540e+08 1.928864e+08 4.880860e+08 2.120500e+08 2.207571e+08 1.416774e+08 1.968167e+08 7.502095e+07 1.529055e+08 1.810199e+08 1.938401e+08 9.613641e+07 6.562389e+08 2.247718e+08 1.167952e+08 2.835518e+08 2.303059e+08 1.221911e+08 6.425457e+08 4.929891e+08 2.477426e+08 8.613811e+07 2.679209e+08 2.855400e+08 2.553775e+08 1.600651e+08 1.909890e+08 2.261096e+08 2.856799e+08 2.115125e+08 2.410016e+08 3.564439e+08 2.645791e+08 5.370722e+08 2.428739e+08 1.569160e+08 1.755608e+08 2.286658e+08 3.348965e+08 1.879467e+08 2.311168e+08 3.053952e+08 1.388263e+08 3.374844e+08 1.833215e+08 5.041686e+08 1.559615e+08 2.190118e+08 2.405037e+08 2.230584e+08 2.935457e+08 2.394010e+08 1.317244e+08 9.637003e+08 9.146378e+07 2.613156e+08 1.138472e+08 6.170569e+07 1.731002e+08 2.103500e+08 1.950411e+08 1.270101e+08 1.833120e+08 1.272202e+07 3.856313e+08 4.030511e+08 3.004888e+08 1.243490e+06 2.262019e+07 4.763205e+07 1.757538e+08 2.753610e+08 3.743278e+07 2.305428e+08 C7 H11 N O2_7.422 4.343881e+05 4.503791e+05 3.314713e+05 3.743239e+05 1.137357e+05 5.126636e+05 3.778319e+05 4.071257e+05 117832.49 4.103828e+05 2.321966e+05 6.116391e+05 105889.77 5.050351e+05 2.763448e+05 3.211031e+05 1.089051e+05 6.205415e+05 3.399142e+05 3.553391e+05 1.066463e+05 3.430097e+05 3.435011e+05 6.779520e+05 46405.881 3.821284e+05 2.931519e+05 4.182138e+05 3.581034e+04 4.266683e+05 3.618072e+05 4.038305e+05 129320.91 3.546207e+05 5.706935e+05 3.326641e+05 1.118363e+05 4.477704e+05 4.305062e+05 3.191253e+05 1.613376e+05 5.069853e+05 2.573512e+05 5.066686e+05 1.727310e+05 4.102489e+05 4.181954e+05 4.035756e+05 7.143766e+04 3.816230e+04 8.039276e+04 7.878284e+04 7.090349e+04 5.496407e+04 4.078123e+05 9.163361e+04 2.365081e+05 1.106174e+05 6.547864e+05 1.428426e+05 6.612486e+04 8.368112e+04 8.478959e+04 2.469542e+05 8.104244e+04 1.454452e+05 5.261745e+04 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3.182431e+06 4.329854e+06 3.431820e+06 2.051366e+06 4.177895e+06 3.109026e+06 3.818613e+06 4.120285e+06 4.135810e+06 3.469112e+06 3.515321e+06 3.596712e+06 2.567889e+06 3.885154e+06 3.314247e+06 3.717239e+06 2.641979e+06 3.859468e+06 3.675764e+06 3.732524e+06 2.878742e+06 2.385667e+06 3.281824e+06 2.358708e+06 5.759497e+06 3.039464e+06 3.248646e+06 6.012331e+06 3.358239e+06 3.776158e+06 3.613932e+06 3.924370e+06 3.250397e+06 4.650860e+06 5.687797e+06 4.054894e+06 4.449098e+06 3.867364e+06 5.531722e+06 5.409869e+06 4.586977e+06 4.612984e+06 5.343251e+06 3.296867e+06 5.850670e+06 4.058824e+06 3.935016e+06 3.208052e+06 5.912524e+06 3.932466e+06 3.990036e+06 7.704983e+06 7.766156e+06 3.312064e+06 5.098603e+06 2.488727e+06 2.951244e+06 3.674428e+06 3.621670e+06 4.359213e+06 C6 H6 O3_7.431 3.344780e+06 1.338675e+06 1.214760e+06 1.302517e+06 4.056099e+05 1.332823e+06 1.108303e+06 1.113880e+06 362711.77 1.732318e+06 9.079177e+05 1.754999e+06 334814.42 1.229731e+06 1.300052e+06 1.195810e+06 3.189360e+05 1.182471e+06 1.382450e+06 1.266705e+06 2.637030e+05 1.106038e+06 1.404552e+06 1.579295e+06 65966.572 1.096209e+06 1.254313e+06 1.345427e+06 7.019541e+04 1.283277e+06 1.255654e+06 1.330002e+06 357557.69 1.154056e+06 1.360876e+06 1.421618e+06 3.173917e+05 1.236106e+06 1.267287e+06 1.113542e+06 4.066407e+05 1.189403e+06 1.567589e+06 1.454925e+06 3.615520e+05 1.131128e+06 1.181722e+06 1.349667e+06 1.311921e+06 1.127931e+06 1.518189e+06 2.312381e+06 1.217012e+06 1.197665e+06 1.613211e+06 1.162044e+06 2.667679e+06 2.084835e+06 1.932300e+06 3.182731e+06 2.381791e+06 1.691171e+06 1.311327e+06 2.588917e+06 2.879298e+06 1.219689e+06 9.336991e+05 1.951546e+06 1.090890e+06 1.307521e+06 3.012063e+06 1.719425e+06 1.761767e+06 1.109979e+06 1.638500e+06 8.299659e+05 1.731831e+06 1.505188e+06 1.134538e+06 8.661276e+05 1.530754e+06 9.761810e+05 7.426235e+05 1.275747e+06 9.780700e+05 1.053199e+06 6.523855e+05 5.534236e+05 9.309972e+05 8.309234e+05 1.328855e+06 1.321163e+06 1.610385e+06 1.073419e+06 9.856497e+05 1.685208e+06 1.280471e+06 1.104979e+06 1.643925e+06 1.130873e+06 6.439207e+05 1.109670e+06 1.260506e+06 1.994268e+06 1.871794e+06 1.192692e+06 1.259988e+06 1.153020e+06 1.103603e+06 1.227969e+06 7.985427e+05 1.026479e+06 1.881654e+06 1.115105e+06 6.580295e+05 9.696102e+05 1.165244e+06 1.056570e+06 9.357924e+05 1.022727e+06 8.587557e+05 1.304358e+06 7.489918e+05 1.233800e+06 1.353248e+06 1.247784e+06 2.051305e+06 1.022854e+06 1.026973e+06 1.180202e+06 2.041824e+06 1.384762e+06 8.006708e+05 7.439017e+05 1.514777e+06 1.290167e+06 1.419573e+06 7.802018e+05 1.043743e+06 1.295614e+06 1.291920e+06 1.985630e+06 8.658475e+05 7.188377e+05 1.802870e+06 1.769656e+06 1.059263e+06 9.446768e+05 1.229307e+06 5.892360e+05 1.982235e+06 1.757495e+06 1.043907e+06 1.821937e+06 1.098260e+06 1.983422e+06 8.360565e+05 1.293157e+06 1.447933e+06 8.740329e+05 1.315887e+06 1.849164e+06 1.492760e+06 1.314149e+06 1.207423e+06 1.442752e+06 1.422052e+06 1.151522e+06 1.001341e+06 1.560190e+06 7.842224e+05 1.569659e+06 9.277969e+05 1.387319e+06 1.223839e+06 1.001647e+06 1.651620e+06 1.479061e+06 1.017313e+06 1.177683e+06 1.269262e+06 1.499263e+06 1.554126e+06 1.245320e+06 1.239451e+06 1.744175e+06 1.416335e+06 9.439773e+05 1.051883e+06 1.348408e+06 1.629963e+06 6.937025e+05 1.912432e+07 1.537415e+06 8.285429e+05 1.066056e+06 1.954683e+06 1.574594e+06 1.148473e+06 1.715328e+06 2.183534e+06 1.542658e+06 1.104255e+06 1.507038e+06 1.111662e+06 6.799833e+05 1.629278e+06 1.015719e+06 1.437424e+06 1.718973e+06 1.465735e+06 1.233328e+06 1.250774e+06 1.089636e+06 8.033185e+05 1.404542e+06 1.253153e+06 1.202189e+06 8.398424e+05 1.312481e+06 1.456414e+06 1.061286e+06 9.359779e+05 5.833968e+05 1.172185e+06 8.877344e+05 1.977727e+06 1.001587e+06 1.003006e+06 2.301273e+06 1.138344e+06 1.096224e+06 1.153704e+06 1.180582e+06 1.044768e+06 1.694699e+06 2.267965e+06 1.145754e+06 1.857350e+06 1.817509e+06 2.046466e+06 1.886353e+06 1.617958e+06 1.616542e+06 2.609328e+06 1.298787e+06 2.143506e+06 1.532204e+06 1.294409e+06 1.052628e+06 2.330207e+06 1.514683e+06 1.943890e+06 2.508937e+06 3.001545e+06 1.219481e+06 1.872362e+06 6.145960e+05 1.143741e+06 1.302780e+06 1.167433e+06 1.666276e+06 C6 H15 N O6_7.433 1.585640e+06 4.009978e+05 4.109198e+05 4.341635e+05 1.287651e+05 3.506124e+05 3.331186e+05 3.123575e+05 131932.10 7.438853e+05 1.462184e+05 5.871653e+05 131540.20 2.662117e+05 3.954961e+05 4.362533e+05 1.149697e+05 3.871821e+05 4.126753e+05 3.702120e+05 9.600018e+04 4.936631e+05 3.596951e+05 2.111883e+05 25538.267 5.686726e+05 3.844030e+05 3.758329e+05 2.861641e+04 5.176483e+05 3.335583e+05 2.727906e+05 149390.99 5.671542e+05 3.317982e+05 4.667257e+05 1.695437e+05 3.960126e+05 3.972347e+05 3.696539e+05 2.327177e+05 3.903577e+05 2.646845e+05 4.535525e+05 1.804185e+05 4.736153e+05 4.798402e+05 3.292635e+05 5.915242e+05 5.276397e+05 2.143048e+05 4.512895e+05 3.129288e+05 5.321619e+05 3.225216e+05 2.944242e+05 8.398597e+05 3.954886e+05 2.771777e+05 1.870772e+06 5.013358e+05 3.299981e+05 3.627151e+05 1.123732e+06 1.804793e+06 2.806386e+05 9.212708e+04 1.291967e+06 1.316237e+05 4.588540e+05 9.316585e+05 8.767983e+04 3.476218e+05 8.297289e+05 2.948487e+05 2.082570e+05 6.089131e+05 3.778023e+05 1.337328e+05 1.704698e+05 1.863766e+05 2.909140e+05 5.893073e+05 4.277417e+05 3.452090e+05 1.588466e+05 2.133947e+05 6.828940e+04 1.767895e+05 2.237511e+05 5.690051e+05 1.593632e+05 1.437164e+06 1.965361e+05 2.315008e+05 3.414474e+05 2.166773e+05 6.569796e+05 7.991002e+05 4.343196e+05 9.732900e+04 2.034454e+05 3.191677e+05 1.234669e+06 9.866548e+05 5.053968e+05 3.445616e+05 1.070361e+05 4.447297e+05 2.409250e+05 2.726056e+05 4.542290e+05 5.303715e+05 3.359561e+05 2.483932e+05 1.287210e+05 2.096022e+05 6.107037e+05 1.696161e+05 2.352356e+05 4.634050e+05 2.460436e+05 1.873649e+05 4.727851e+05 5.699815e+05 1.318265e+06 1.484663e+06 6.875162e+05 1.985830e+05 2.024679e+05 7.398375e+05 3.818057e+05 2.368829e+05 1.107217e+05 7.115218e+05 4.604217e+05 3.512656e+05 1.474947e+05 2.759068e+05 1.173313e+05 7.702997e+05 8.872625e+05 8.390254e+04 8.244600e+04 5.952750e+05 1.068631e+06 3.863553e+05 2.398609e+05 2.857869e+05 2.971091e+05 9.422926e+05 1.074274e+06 1.585375e+05 5.111888e+05 1.223602e+05 4.359598e+05 4.124793e+05 3.359852e+05 9.035141e+05 3.870420e+05 3.951603e+05 3.106464e+05 4.571291e+05 2.423542e+05 3.045520e+05 6.115917e+05 6.762609e+05 3.578326e+05 3.081082e+05 1.947773e+05 2.220784e+05 2.327012e+05 2.039022e+05 7.721503e+05 7.347049e+05 3.652344e+05 4.063207e+05 1.054201e+06 1.798825e+05 2.793823e+05 1.735163e+06 1.210554e+06 8.107190e+05 3.496603e+05 6.303896e+05 1.567031e+06 7.341976e+05 3.283194e+05 1.595222e+05 9.222454e+05 6.487253e+05 1.493829e+05 1.237623e+07 8.691068e+05 7.082475e+05 8.854608e+04 4.382784e+05 4.631253e+05 3.489445e+05 8.650815e+05 4.397636e+05 8.222984e+05 6.402234e+05 1.570527e+05 3.623146e+05 2.323889e+05 7.982433e+05 4.500797e+05 5.679091e+05 1.047672e+06 5.007541e+05 3.232563e+05 4.195140e+05 3.520527e+05 4.029948e+05 2.512954e+05 6.309412e+05 5.994842e+05 1.002015e+05 5.621688e+05 6.794538e+05 1.451983e+05 1.504489e+05 5.032952e+05 4.903861e+05 3.005312e+05 1.002438e+06 4.355344e+05 1.972973e+05 7.648768e+05 1.886805e+05 4.274428e+05 2.114751e+05 4.360325e+05 1.103842e+05 1.656894e+06 5.672530e+05 4.517077e+05 1.092631e+06 3.182741e+05 3.871911e+05 1.377740e+06 8.672897e+05 2.244914e+05 1.133054e+06 4.390103e+05 4.499096e+05 6.156291e+05 9.625585e+04 2.636102e+05 1.338103e+06 4.289344e+05 5.086910e+05 9.988414e+05 1.311557e+06 3.134389e+05 5.331472e+05 2.662183e+05 2.301418e+05 1.466372e+06 4.509711e+05 1.776549e+05 C4 H4 O2_7.433 4.077746e+06 1.957435e+06 1.985905e+06 2.530267e+06 2.224577e+05 1.692050e+06 2.057962e+06 1.661467e+06 205330.62 2.865846e+06 1.358767e+06 2.632581e+06 188674.21 1.864931e+06 2.338266e+06 2.018695e+06 1.718391e+05 1.862780e+06 2.184554e+06 1.903061e+06 1.392241e+05 1.746801e+06 2.068002e+06 2.719447e+06 33862.958 2.201432e+06 1.769874e+06 1.898365e+06 3.914787e+04 1.771328e+06 2.116049e+06 2.341815e+06 177897.93 2.116852e+06 2.016885e+06 2.102187e+06 1.639833e+05 2.034099e+06 2.091168e+06 1.893663e+06 2.214629e+05 2.115399e+06 2.327271e+06 1.965131e+06 1.904510e+05 1.789168e+06 1.805238e+06 2.417006e+06 1.943407e+06 1.616630e+06 2.376375e+06 3.440750e+06 1.774589e+06 2.020549e+06 2.540538e+06 2.420208e+06 4.407106e+06 3.415183e+06 3.456617e+06 5.651347e+06 3.351359e+06 2.646016e+06 1.982931e+06 4.222315e+06 5.206752e+06 1.696713e+06 1.595674e+06 2.668470e+06 1.690259e+06 2.032658e+06 4.854486e+06 2.593053e+06 2.529973e+06 1.858054e+06 2.398055e+06 1.304861e+06 2.936989e+06 2.221270e+06 3.337460e+06 1.648136e+06 1.714539e+06 1.494907e+06 1.775298e+06 1.929522e+06 1.786309e+06 2.177387e+06 1.144075e+06 7.408386e+05 1.655603e+06 1.569916e+06 2.072779e+06 1.535842e+06 2.640941e+06 1.592890e+06 1.733609e+06 2.541386e+06 1.866874e+06 1.914229e+06 2.293800e+06 1.963914e+06 1.295207e+06 1.713619e+06 1.872486e+06 3.205920e+06 2.484890e+06 1.856317e+06 2.027708e+06 1.650681e+06 1.498401e+06 1.710601e+06 1.197933e+06 1.895115e+06 2.676386e+06 1.701939e+06 1.268050e+06 1.330073e+06 1.795669e+06 1.464370e+06 1.628751e+06 1.726600e+06 1.336734e+06 2.516596e+06 1.030301e+06 1.695379e+06 2.306408e+06 2.209106e+06 3.344063e+06 1.703004e+06 1.722654e+06 1.879232e+06 2.887057e+06 2.104080e+06 9.414511e+05 1.147163e+06 2.461760e+06 1.756791e+06 2.141877e+06 1.234120e+06 1.547165e+06 1.873229e+06 2.479328e+06 2.757183e+06 2.233419e+06 1.036927e+06 2.843038e+06 2.613221e+06 1.536612e+06 1.455372e+06 1.804270e+06 1.145840e+06 2.794873e+06 2.789009e+06 1.781114e+06 2.490163e+06 3.109470e+06 2.889140e+06 1.777475e+06 2.409937e+06 2.431973e+06 1.501747e+06 1.956018e+06 3.054456e+06 1.873137e+06 1.866647e+06 1.955272e+06 2.326275e+06 1.973060e+06 2.916498e+06 2.104633e+06 2.267945e+06 1.427014e+06 2.293944e+06 1.721125e+06 2.104702e+06 1.600624e+06 1.754617e+06 2.978494e+06 2.466200e+06 1.918276e+06 2.391711e+06 1.491003e+06 2.133098e+06 2.150391e+06 1.949756e+06 1.749341e+06 2.152295e+06 2.297125e+06 1.405369e+06 1.391862e+06 2.162610e+06 2.005109e+06 1.046762e+06 3.173527e+07 2.497119e+06 1.139680e+06 1.517138e+06 2.572111e+06 2.583858e+06 1.856060e+06 2.464292e+06 4.070539e+06 2.079971e+06 1.610435e+06 2.724145e+06 1.909806e+06 1.013478e+06 2.556427e+06 1.313106e+06 2.016155e+06 2.296745e+06 1.968949e+06 1.589477e+06 1.827716e+06 1.860883e+06 9.082539e+05 2.002653e+06 1.741254e+06 2.169806e+06 1.240157e+06 1.835757e+06 2.169534e+06 1.864884e+06 1.526977e+06 1.344456e+06 1.906944e+06 1.459816e+06 3.140954e+06 1.366981e+06 1.608043e+06 3.149568e+06 1.446795e+06 1.966723e+06 1.685287e+06 1.834820e+06 1.378003e+06 2.137381e+06 3.895450e+06 1.842939e+06 2.317585e+06 2.453375e+06 3.288781e+06 3.143573e+06 2.408650e+06 2.944698e+06 3.113292e+06 1.909631e+06 3.434838e+06 2.134500e+06 2.284159e+06 1.675046e+06 3.870404e+06 2.314743e+06 2.385709e+06 3.853226e+06 4.974306e+06 1.990686e+06 2.805805e+06 1.586221e+06 1.549557e+06 2.129244e+06 1.890191e+06 2.132160e+06 C5 H4 O2_7.434 2.685218e+06 9.972811e+05 1.016007e+06 1.235110e+06 1.999472e+05 1.065923e+06 9.258062e+05 9.406282e+05 176310.70 1.400783e+06 7.467982e+05 1.540931e+06 210148.18 1.028514e+06 1.069383e+06 1.072758e+06 1.624548e+05 8.535809e+05 1.172507e+06 9.347635e+05 1.419095e+05 9.561133e+05 1.271358e+06 1.376344e+06 33193.736 8.492757e+05 9.779213e+05 1.157813e+06 5.905844e+04 9.753083e+05 1.151725e+06 1.066639e+06 150156.53 1.035102e+06 1.140441e+06 1.068998e+06 1.459686e+05 1.037756e+06 1.020923e+06 1.126395e+06 1.885769e+05 1.103912e+06 1.157341e+06 9.758023e+05 1.701433e+05 1.063477e+06 8.981573e+05 1.243780e+06 1.045729e+06 8.554058e+05 1.197873e+06 1.520941e+06 1.022126e+06 1.122788e+06 1.482457e+06 1.158219e+06 1.901320e+06 1.727597e+06 1.728677e+06 2.550805e+06 1.664744e+06 1.372228e+06 1.140733e+06 1.930471e+06 1.737676e+06 1.003013e+06 7.859363e+05 1.322992e+06 9.931884e+05 1.222717e+06 2.004426e+06 1.483300e+06 1.320435e+06 8.778032e+05 1.395580e+06 6.476212e+05 1.609065e+06 1.363465e+06 1.116644e+06 5.456105e+05 1.231071e+06 8.958780e+05 9.730762e+05 9.661989e+05 7.371965e+05 1.055276e+06 6.833758e+05 3.673190e+05 1.039162e+06 9.571524e+05 1.293110e+06 6.036980e+05 1.473825e+06 7.302035e+05 8.041774e+05 1.229384e+06 1.080264e+06 1.084358e+06 1.053737e+06 8.291289e+05 6.265059e+05 9.975389e+05 7.978452e+05 1.413034e+06 1.361715e+06 9.344112e+05 1.149613e+06 1.036223e+06 8.189941e+05 9.029738e+05 6.688296e+05 9.162942e+05 1.481406e+06 8.640502e+05 5.376555e+05 8.930674e+05 9.962604e+05 7.587315e+05 7.524330e+05 7.446271e+05 1.117185e+06 1.162236e+06 4.963868e+05 1.223840e+06 1.203867e+06 1.188251e+06 1.645687e+06 9.204898e+05 1.096936e+06 8.507026e+05 1.212495e+06 1.343667e+06 5.171227e+05 7.223218e+05 1.076111e+06 9.573672e+05 1.083963e+06 6.066264e+05 7.366561e+05 9.180370e+05 1.132026e+06 1.295605e+06 4.946620e+05 5.607549e+05 1.279272e+06 1.157808e+06 8.309104e+05 6.811289e+05 1.021166e+06 6.507835e+05 1.303349e+06 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1.088008e+06 2.053347e+06 1.008113e+06 1.118924e+06 7.602283e+05 1.331053e+06 1.142975e+06 1.461522e+06 2.138844e+06 1.080944e+06 1.357272e+06 1.508417e+06 1.601157e+06 1.411610e+06 1.200880e+06 1.392182e+06 1.569081e+06 9.131903e+05 1.946983e+06 1.288824e+06 1.228760e+06 9.307460e+05 1.813136e+06 1.339162e+06 1.452783e+06 1.947667e+06 2.573810e+06 9.488324e+05 1.393164e+06 7.661099e+05 7.894692e+05 1.019224e+06 8.422037e+05 1.081498e+06 C3 H7 N O_7.436 6.264681e+07 3.216740e+07 1.045878e+08 1.134433e+08 3.097030e+05 3.212510e+07 8.700018e+07 8.539675e+07 168672.63 9.875301e+07 6.117645e+07 1.017174e+08 1010801.56 6.477430e+07 7.890844e+07 8.901298e+07 8.346279e+05 6.454235e+07 8.107950e+07 8.850049e+07 7.344738e+05 6.643065e+07 8.277492e+07 9.275685e+07 914762.871 6.977374e+07 7.836359e+07 8.062308e+07 9.778348e+05 6.953185e+07 7.941151e+07 8.923586e+07 124286.23 7.243694e+07 8.452879e+07 8.739959e+07 1.252561e+05 7.223230e+07 8.997998e+07 9.839293e+07 8.029132e+05 2.327886e+07 9.581950e+07 9.374628e+07 8.713919e+05 6.919156e+07 7.760767e+07 8.154588e+07 6.686580e+07 4.577622e+07 6.918061e+07 1.150239e+08 5.440374e+07 6.105084e+07 1.006685e+08 7.592264e+07 7.714165e+07 9.446121e+07 9.164208e+07 9.065733e+07 9.319822e+07 6.757702e+07 4.739095e+07 7.314470e+07 9.707988e+07 6.323563e+07 5.720498e+07 7.128627e+07 7.030416e+07 6.622228e+07 1.396103e+08 7.747974e+07 8.327723e+07 5.342686e+07 7.896546e+07 6.782877e+07 8.964759e+07 6.209301e+07 4.652592e+07 6.557175e+07 5.078620e+07 6.527296e+07 5.508493e+07 9.658323e+07 6.402986e+07 6.014027e+07 5.467950e+07 3.421652e+07 6.387178e+07 7.962630e+07 9.348236e+07 8.161309e+06 8.424860e+07 5.082140e+07 2.125238e+07 6.953891e+07 8.478730e+07 7.060098e+07 6.457359e+07 5.429615e+07 4.695681e+07 3.715640e+07 6.315239e+07 7.545378e+07 7.540190e+07 7.717900e+07 5.878824e+07 4.108686e+07 7.285047e+07 6.950545e+07 7.990090e+07 7.070665e+07 7.241320e+07 5.624297e+07 9.903435e+06 1.136269e+08 6.679110e+07 9.479575e+07 5.239245e+07 7.119183e+07 5.224455e+07 8.834080e+07 5.946060e+07 6.202759e+07 9.595362e+07 8.180181e+07 1.356992e+08 7.674097e+07 6.343735e+07 7.288209e+07 8.817225e+07 9.026703e+07 4.660684e+07 6.522603e+07 6.613600e+07 5.102384e+07 6.536948e+07 7.013410e+07 6.097255e+07 4.360308e+07 6.830602e+07 8.441119e+07 4.282105e+07 7.105189e+07 1.289698e+08 7.601817e+07 6.188418e+07 7.484293e+07 6.675499e+07 6.782632e+07 6.408414e+07 6.175277e+07 6.297227e+07 5.340625e+07 3.688132e+07 1.360304e+08 7.266243e+07 9.879209e+07 6.789233e+07 5.369805e+07 5.565979e+07 5.062246e+07 9.333299e+07 5.881070e+07 5.573510e+07 4.996874e+07 8.539216e+07 8.726077e+07 4.949493e+07 5.601570e+07 4.857398e+07 3.491514e+07 7.260924e+07 7.457272e+07 8.879838e+07 6.275456e+07 9.076597e+07 8.073087e+07 5.670171e+07 5.526835e+07 6.082556e+07 7.257918e+07 6.242644e+07 6.079437e+07 6.719387e+07 5.113754e+07 7.998519e+07 6.629268e+07 9.024234e+07 6.313778e+07 7.291123e+07 4.747979e+07 9.930731e+06 5.514365e+07 4.801972e+07 5.563028e+07 9.088039e+07 7.623041e+07 5.103004e+07 5.149589e+07 1.096109e+08 4.092327e+07 5.819426e+07 8.079097e+07 9.239659e+07 5.187460e+07 6.555557e+07 6.952970e+07 7.608705e+07 3.728901e+07 7.079664e+07 7.145793e+07 5.793461e+07 6.766957e+07 6.410677e+07 7.813317e+07 4.579736e+07 9.056196e+07 6.124946e+07 7.173431e+07 4.747699e+07 4.167068e+07 7.221992e+07 7.006154e+07 6.776819e+07 6.412287e+07 7.293652e+07 7.168732e+07 7.198719e+07 1.048480e+08 6.183984e+07 9.204896e+07 3.725889e+07 9.147218e+07 7.194203e+07 6.121902e+07 1.268637e+08 5.681153e+07 9.673328e+07 6.522388e+07 7.203760e+07 1.144494e+08 6.457438e+07 6.697349e+07 5.711906e+07 5.632238e+07 8.115226e+07 9.126982e+07 5.991367e+07 4.988580e+07 9.020138e+07 6.057492e+07 8.348795e+07 1.284507e+08 1.397170e+08 1.316763e+07 1.256747e+08 4.427566e+07 6.665142e+07 6.457275e+07 6.293671e+07 9.357282e+07 C9 H3 N3 O10_7.439 3.313723e+06 8.932932e+05 7.657553e+05 8.981869e+05 2.647325e+05 1.001591e+06 7.003717e+05 6.415993e+05 192946.70 1.294205e+06 4.873471e+05 1.247955e+06 157547.32 8.038871e+05 9.639843e+05 8.180938e+05 1.446799e+05 7.816874e+05 9.375180e+05 8.143768e+05 1.275702e+05 8.135702e+05 8.741764e+05 1.081050e+06 34119.674 8.113212e+05 9.162051e+05 7.954900e+05 4.019388e+04 6.788139e+05 8.966782e+05 1.011333e+06 169343.70 8.678755e+05 8.073019e+05 8.653330e+05 1.515393e+05 8.998739e+05 8.798077e+05 9.508914e+05 1.872494e+05 7.316785e+05 9.904389e+05 9.136614e+05 1.698265e+05 7.446966e+05 8.748424e+05 8.960063e+05 9.402037e+05 7.549825e+05 1.362351e+06 1.576859e+06 6.724702e+05 7.993639e+05 8.944174e+05 5.870369e+05 2.259477e+06 1.411239e+06 9.961940e+05 2.762271e+06 1.666847e+06 7.762199e+05 7.192756e+05 1.962977e+06 2.544485e+06 8.201088e+05 3.938950e+05 1.657750e+06 3.980495e+05 1.233217e+06 2.417874e+06 4.221112e+05 1.597709e+06 1.051057e+06 9.869889e+05 3.536491e+05 1.126777e+06 1.228244e+06 5.732998e+05 3.788127e+05 4.583441e+05 3.474308e+05 5.856859e+05 7.405874e+05 6.528156e+05 5.443046e+05 2.593003e+05 8.147042e+04 4.187202e+05 4.867916e+05 1.035153e+06 4.203200e+05 1.925572e+06 3.673616e+05 5.686544e+05 1.252805e+06 3.974275e+05 7.814651e+05 1.174594e+06 6.706333e+05 1.892830e+05 5.459247e+05 8.293004e+05 1.966314e+06 1.631848e+06 8.596164e+05 7.269363e+05 3.660572e+05 7.365912e+05 7.650103e+05 5.005692e+05 1.113541e+06 1.391396e+06 4.949648e+05 3.216823e+05 4.136124e+05 8.651190e+05 9.878798e+05 2.278790e+05 5.035461e+05 4.964139e+05 5.383565e+05 4.301489e+05 9.916938e+05 8.761116e+05 1.124948e+06 1.769012e+06 1.027014e+06 5.114194e+05 5.315874e+05 1.540268e+06 8.638366e+05 4.674158e+05 2.534278e+05 1.142872e+06 9.942948e+05 9.758864e+05 3.466183e+05 6.272482e+05 5.216435e+05 1.016000e+06 1.586929e+06 2.706905e+05 1.265707e+05 1.203602e+06 1.976415e+06 5.391025e+05 4.980348e+05 4.289465e+05 2.788667e+05 1.843927e+06 2.008119e+06 4.039331e+05 1.567530e+06 5.318650e+05 1.052566e+06 4.957062e+05 7.687728e+05 1.424049e+06 6.839162e+05 6.885189e+05 1.148029e+06 1.051493e+06 7.183316e+05 5.782238e+05 9.309385e+05 1.143133e+06 3.347779e+05 5.693516e+05 8.224705e+05 4.287425e+05 6.739321e+05 3.636924e+05 1.095914e+06 9.527694e+05 4.833081e+05 1.515058e+06 1.487551e+06 4.715582e+05 5.192513e+05 1.060677e+06 1.464891e+06 1.220008e+06 5.461470e+05 9.361872e+05 1.800472e+06 9.313303e+05 4.405172e+05 4.634028e+05 9.565816e+05 1.605076e+06 2.148609e+05 3.271101e+06 1.242412e+06 4.620194e+05 3.010206e+05 1.049763e+06 1.326362e+06 6.810745e+05 1.427232e+06 1.214398e+06 1.210685e+06 7.998379e+05 9.245147e+05 7.748096e+05 3.487141e+05 1.476717e+06 6.119449e+05 1.116753e+06 1.403937e+06 9.582073e+05 7.853602e+05 8.406462e+05 8.347164e+05 3.173301e+05 5.817329e+05 9.497167e+05 1.157527e+06 4.347979e+05 1.028200e+06 9.032301e+05 4.668659e+05 4.838604e+05 4.836436e+05 8.970594e+05 5.133259e+05 1.663192e+06 6.068078e+05 4.684717e+05 2.249113e+06 5.312608e+05 8.378930e+05 2.662411e+05 6.736498e+05 2.084413e+05 1.509837e+06 1.791887e+06 4.857819e+05 1.433327e+06 7.916763e+05 1.450916e+06 1.802111e+06 1.706684e+06 8.946091e+05 1.514059e+06 9.134638e+05 1.582037e+06 1.440098e+06 7.030513e+05 5.035208e+05 1.978023e+06 1.141570e+06 1.068206e+06 2.329027e+06 3.039942e+06 6.597552e+05 1.436907e+06 1.539723e+05 6.372695e+05 1.135450e+06 8.696775e+05 6.142337e+05 C4 H7 Cl N6 S3_7.441 2.662459e+07 7.411391e+06 7.171484e+06 7.376296e+06 3.955818e+05 8.412543e+06 6.219223e+06 5.506435e+06 298836.24 1.061952e+07 4.076128e+06 1.103648e+07 242826.27 6.835787e+06 7.469026e+06 7.016171e+06 2.194832e+05 7.403043e+06 7.509772e+06 7.283559e+06 1.940889e+05 6.953979e+06 8.477677e+06 7.679486e+06 53699.228 6.505040e+06 7.564426e+06 6.597320e+06 6.109577e+04 7.485534e+06 8.697129e+06 8.645962e+06 278152.71 4.484286e+06 8.755096e+06 8.456575e+06 2.680581e+05 6.531249e+06 6.102057e+06 6.733855e+06 3.364650e+05 7.916588e+06 9.848037e+06 7.686902e+06 3.220051e+05 5.548326e+06 7.947990e+06 7.184450e+06 9.034306e+06 6.103505e+06 1.532119e+07 9.231772e+06 5.305357e+06 8.484468e+06 8.299496e+06 8.028453e+06 1.631366e+07 1.129636e+07 9.535552e+06 2.213571e+07 1.212741e+07 7.660692e+06 5.561356e+06 1.510455e+07 1.677575e+07 8.520892e+06 3.750359e+06 1.437474e+07 4.114950e+06 1.023469e+07 2.085875e+07 5.080423e+06 1.530373e+07 8.645912e+06 7.102137e+06 5.027223e+06 9.035663e+06 1.003465e+07 4.098094e+06 4.494276e+06 4.999791e+06 3.830185e+06 5.310108e+06 6.393553e+06 5.852843e+06 5.682213e+06 3.394040e+06 1.034961e+06 4.338741e+06 4.696615e+06 7.053093e+06 3.165359e+06 1.746944e+07 3.562000e+06 5.029635e+06 9.715614e+06 4.843513e+06 7.069124e+06 9.801455e+06 5.802406e+06 2.387789e+06 5.510430e+06 7.060999e+06 1.558054e+07 1.142615e+07 7.226700e+06 6.085532e+06 4.655948e+06 7.416160e+06 6.094370e+06 5.195188e+06 8.640050e+06 1.038300e+07 5.174118e+06 3.422867e+06 3.906088e+06 6.784363e+06 9.603150e+06 1.894091e+06 5.624759e+06 5.272011e+06 5.429479e+06 4.938598e+06 8.233956e+06 1.082081e+07 8.497976e+06 1.539901e+07 1.119802e+07 4.548546e+06 5.098726e+06 1.329199e+07 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9.441445e+06 1.093760e+07 6.977606e+06 7.037513e+06 6.984102e+06 5.163212e+06 4.073598e+06 5.719550e+06 8.799460e+06 1.384157e+07 3.535739e+06 8.899254e+06 7.724242e+06 4.937758e+06 4.541735e+06 6.051045e+06 7.625618e+06 4.391125e+06 1.341534e+07 5.234727e+06 4.552317e+06 1.965678e+07 5.108239e+06 6.522867e+06 3.641899e+06 6.366020e+06 2.605775e+06 1.548998e+07 1.443205e+07 5.081109e+06 1.051421e+07 6.741637e+06 1.125609e+07 1.118727e+07 1.523831e+07 8.032909e+06 1.288242e+07 1.068083e+07 1.133445e+07 1.260571e+07 4.618419e+06 4.670819e+06 1.651116e+07 9.195999e+06 9.510300e+06 1.883888e+07 2.577427e+07 6.216073e+06 1.167574e+07 2.629590e+06 5.158381e+06 1.174296e+07 7.223183e+06 5.417702e+06 C11 H22 Cl N4 O5 P3 S_7.442 2.179809e+07 4.869936e+06 4.366012e+06 4.888083e+06 1.680446e+05 4.503288e+06 4.928187e+06 3.088589e+06 115679.98 7.019399e+06 2.718613e+06 6.889960e+06 92864.65 4.028577e+06 4.767624e+06 4.730702e+06 8.171602e+04 4.926507e+06 4.413845e+06 4.788292e+06 7.171268e+04 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2.248206e+06 3.416583e+06 6.047772e+06 1.110730e+06 1.640440e+07 4.033494e+06 2.155292e+06 1.212483e+06 4.865882e+06 3.517991e+06 2.669873e+06 5.330666e+06 4.550123e+06 4.672780e+06 2.585104e+06 3.327842e+06 3.092907e+06 1.470752e+06 5.811309e+06 2.215009e+06 4.534064e+06 4.851591e+06 3.254444e+06 3.265040e+06 3.085502e+06 2.189872e+06 2.263325e+06 2.558726e+06 4.955160e+06 6.556585e+06 1.532031e+06 3.817479e+06 3.393420e+06 1.868951e+06 2.156382e+06 3.040820e+06 3.632215e+06 1.757287e+06 6.330980e+06 2.749859e+06 2.195026e+06 6.084974e+06 2.395691e+06 2.114509e+06 1.519237e+06 2.932248e+06 1.444313e+06 6.805034e+06 6.497228e+06 2.646877e+06 4.576488e+06 3.153498e+06 5.413337e+06 5.054188e+06 7.336326e+06 4.057005e+06 5.670708e+06 4.880062e+06 6.914251e+06 5.398348e+06 2.345867e+06 2.204851e+06 7.575370e+06 4.107888e+06 4.108499e+06 8.877010e+06 1.182087e+07 2.857441e+06 4.874125e+06 1.018455e+06 2.279913e+06 5.242468e+06 3.317182e+06 2.312220e+06 C6 H8 O4_7.45 4.667815e+06 2.050883e+06 1.959069e+06 2.207482e+06 2.206915e+05 1.971711e+06 1.847107e+06 1.659803e+06 189642.30 2.748477e+06 1.836262e+06 2.534795e+06 178038.10 1.985896e+06 1.997330e+06 2.082287e+06 1.725029e+05 1.848626e+06 1.977632e+06 2.091138e+06 1.417447e+05 1.871220e+06 2.238395e+06 2.367467e+06 34644.325 2.053446e+06 1.837169e+06 2.034849e+06 3.893615e+04 2.085496e+06 1.977706e+06 2.223866e+06 178965.96 2.022258e+06 2.093592e+06 1.923095e+06 1.745551e+05 1.923378e+06 2.218168e+06 2.116892e+06 2.137650e+05 1.923768e+06 2.292307e+06 2.099915e+06 1.930981e+05 1.812569e+06 2.110614e+06 2.083505e+06 2.093205e+06 1.696342e+06 2.541804e+06 3.162485e+06 2.262889e+06 1.883227e+06 2.506405e+06 2.656908e+06 3.915214e+06 3.351794e+06 3.468097e+06 5.081671e+06 3.652929e+06 2.327448e+06 2.090653e+06 3.843092e+06 4.658401e+06 1.846588e+06 1.344479e+06 2.731646e+06 1.911559e+06 2.169732e+06 4.299369e+06 2.499490e+06 2.747744e+06 1.855765e+06 3.005435e+06 1.289708e+06 2.781850e+06 2.256238e+06 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3.019552e+06 1.715774e+06 2.128520e+06 2.617912e+06 1.367743e+06 2.085234e+06 2.705984e+06 2.212256e+06 2.100419e+06 1.922644e+06 1.721291e+06 2.240534e+06 1.992885e+06 1.544356e+06 2.425807e+06 1.522280e+06 2.110686e+06 1.570138e+06 2.086473e+06 1.878851e+06 1.470162e+06 3.356715e+06 2.406934e+06 1.779181e+06 1.642599e+06 2.055165e+06 2.733072e+06 2.230812e+06 1.644889e+06 1.945004e+06 2.469598e+06 2.362219e+06 1.761044e+06 1.502383e+06 1.982871e+06 2.423748e+06 1.081065e+06 3.220876e+07 2.551227e+06 1.212285e+06 1.869420e+06 3.062083e+06 2.674475e+06 2.098953e+06 2.743122e+06 3.971135e+06 2.468983e+06 1.897766e+06 2.605354e+06 1.834855e+06 1.026964e+06 2.516837e+06 1.422635e+06 2.307774e+06 2.548143e+06 2.373372e+06 1.870699e+06 1.891304e+06 1.990008e+06 1.326353e+06 2.274378e+06 1.808366e+06 2.152225e+06 1.437193e+06 2.342392e+06 2.066488e+06 1.842457e+06 1.539732e+06 1.383147e+06 1.828639e+06 1.287619e+06 3.055400e+06 1.771630e+06 1.736965e+06 3.405158e+06 1.837056e+06 2.160152e+06 1.691034e+06 2.151552e+06 1.889761e+06 2.682446e+06 3.523967e+06 2.095617e+06 2.466056e+06 2.170340e+06 3.227257e+06 3.263799e+06 2.493523e+06 1.973335e+06 3.042624e+06 1.959298e+06 3.358552e+06 2.374460e+06 2.365979e+06 1.731625e+06 3.389059e+06 2.435107e+06 2.118590e+06 5.519908e+06 4.626417e+06 1.732357e+06 3.378400e+06 1.263777e+06 1.603091e+06 2.011032e+06 2.075736e+06 2.420292e+06 C5 H5 N3 O4 P2_7.451 1.913175e+05 3.891879e+05 1.031319e+06 3.981070e+05 7.266642e+04 5.073037e+04 5.212225e+05 1.296904e+06 88576.29 3.505860e+05 1.209635e+06 3.938024e+05 107885.99 4.644623e+05 7.650301e+05 2.446931e+05 1.712754e+05 7.110140e+05 7.723512e+05 7.006906e+05 2.281437e+05 1.277960e+06 3.537460e+05 4.940023e+05 66152.375 8.489988e+05 7.740376e+05 4.279624e+05 4.846418e+04 6.673185e+05 7.578337e+05 5.713897e+05 159121.99 6.893081e+05 5.516902e+05 5.904584e+05 1.670828e+05 6.575360e+05 3.992711e+05 5.566489e+05 2.654481e+05 1.819385e+05 5.087032e+05 5.188141e+05 2.857318e+05 8.331866e+05 7.490569e+05 4.387324e+05 8.615450e+05 6.046118e+05 1.029424e+06 3.428728e+05 4.944129e+05 6.827333e+05 6.067640e+05 1.085184e+06 7.996265e+05 8.449933e+05 4.962999e+05 2.669628e+05 2.627380e+05 3.824202e+05 5.301077e+05 1.663321e+05 2.750001e+05 5.446500e+05 7.907725e+05 3.276571e+05 1.015428e+06 7.381345e+05 1.397353e+05 2.271134e+05 4.178799e+05 8.642941e+05 2.581443e+05 1.012645e+06 4.582283e+05 1.361660e+06 3.676406e+05 3.905040e+05 3.728462e+05 5.998322e+05 4.919162e+05 1.701543e+05 8.566523e+05 6.355576e+05 4.903098e+05 1.079019e+06 1.185188e+06 4.893389e+05 5.132504e+05 4.274324e+05 1.941741e+05 7.797889e+05 1.276588e+06 2.753681e+05 3.670065e+05 5.224756e+05 4.618403e+05 5.653643e+05 1.319600e+06 6.019142e+05 9.304541e+05 4.371389e+05 3.424401e+05 6.131492e+05 5.978910e+05 3.963417e+05 1.303372e+06 3.143432e+05 2.917306e+05 9.634496e+05 4.461090e+05 7.219852e+05 8.159865e+05 7.450769e+05 6.232832e+05 4.816291e+05 4.855053e+05 5.400265e+05 7.444599e+05 6.048545e+05 1.456201e+06 5.973011e+05 4.346103e+05 7.160447e+05 2.767267e+05 7.973886e+05 3.680005e+05 4.283534e+05 8.711734e+05 3.274064e+05 7.068887e+05 8.367456e+05 4.927658e+05 1.641765e+05 3.031997e+05 4.415901e+05 9.325182e+05 3.699135e+05 5.282585e+05 3.128232e+05 7.369332e+05 1.287555e+06 1.543019e+05 2.330992e+05 4.967503e+05 6.956576e+05 1.060654e+06 7.441705e+05 2.353321e+05 5.741250e+05 9.472880e+05 2.626105e+05 1.095089e+06 3.624013e+05 3.221088e+05 2.254229e+05 5.623062e+05 1.187916e+06 2.027483e+05 2.728626e+05 1.239141e+06 5.047824e+05 2.974938e+05 8.780018e+05 3.948389e+05 5.658994e+05 5.505751e+05 3.498595e+05 1.027461e+06 9.822505e+05 4.543406e+05 4.504946e+05 6.852507e+05 6.803764e+05 1.371956e+05 5.316381e+05 2.695896e+05 7.184808e+05 3.636346e+05 3.772866e+05 4.910909e+05 4.043913e+05 8.633022e+05 5.128389e+05 1.550329e+06 4.652319e+05 9.430304e+05 3.701265e+05 3.688106e+05 6.154411e+05 1.218789e+05 3.731109e+05 4.785580e+05 7.670907e+05 1.890790e+05 5.460084e+05 5.083044e+05 3.733404e+05 3.207390e+05 9.036575e+05 4.453336e+05 2.460097e+05 1.878981e+06 5.193174e+05 7.903059e+05 1.081616e+06 1.001701e+06 6.670414e+05 4.272907e+05 5.646245e+05 1.076675e+06 3.866680e+05 1.450691e+06 5.068589e+05 6.780091e+05 6.859470e+05 3.361251e+05 3.288771e+05 3.374777e+05 3.366652e+05 7.027066e+05 1.344867e+06 9.643608e+05 4.176448e+05 4.496041e+05 3.464663e+05 4.296575e+05 6.260390e+05 8.133543e+05 7.261797e+05 3.559122e+05 1.088237e+06 4.870880e+05 9.136904e+05 1.843192e+05 3.087842e+05 7.068678e+05 3.869692e+05 7.361001e+05 1.257837e+06 1.138450e+06 4.727578e+05 2.827250e+05 9.933267e+05 4.381954e+05 6.107719e+05 4.066443e+05 6.925881e+05 2.098432e+05 3.988638e+05 2.395832e+05 3.375617e+05 2.022016e+05 7.679359e+05 3.797918e+05 3.563090e+05 9.018111e+05 4.710379e+05 2.279075e+05 1.389522e+05 C6 H9 N S2_7.451 4.647346e+06 2.415064e+06 2.582926e+06 2.055331e+06 2.102729e+05 1.920336e+06 2.736397e+06 1.990694e+06 172329.63 3.187622e+06 1.719107e+06 2.773222e+06 145244.19 2.162357e+06 2.436971e+06 2.464516e+06 1.369141e+05 2.243598e+06 2.331393e+06 2.395959e+06 1.182257e+05 2.241519e+06 2.543965e+06 2.612756e+06 30982.526 2.210539e+06 2.156417e+06 2.353983e+06 3.464957e+04 2.241540e+06 2.426939e+06 2.876868e+06 153417.56 2.168796e+06 2.205067e+06 2.127749e+06 1.445378e+05 2.267750e+06 2.290163e+06 2.707657e+06 1.737411e+05 2.326016e+06 2.781678e+06 2.165577e+06 1.700709e+05 2.100041e+06 2.333744e+06 2.447909e+06 2.091298e+06 2.181751e+06 2.423523e+06 2.919262e+06 2.107485e+06 2.396312e+06 2.486174e+06 2.672437e+06 3.463281e+06 3.631785e+06 3.556106e+06 4.293817e+06 3.484494e+06 2.839702e+06 1.796372e+06 3.708607e+06 3.971194e+06 2.064433e+06 1.458389e+06 2.974111e+06 2.142257e+06 2.595992e+06 4.544672e+06 2.468009e+06 3.138311e+06 2.289716e+06 4.839012e+06 1.810665e+06 2.812101e+06 2.582355e+06 2.125079e+06 1.911240e+06 2.990060e+06 1.752473e+06 2.859109e+06 2.644562e+06 2.077083e+06 2.406257e+06 1.335753e+06 7.059057e+05 1.470442e+06 1.923437e+06 2.726414e+06 1.868267e+06 3.209961e+06 1.720559e+06 1.818692e+06 2.775377e+06 1.961390e+06 2.007350e+06 2.429926e+06 2.097633e+06 1.529191e+06 1.842026e+06 2.183169e+06 3.589389e+06 3.050540e+06 2.610306e+06 2.643922e+06 1.960907e+06 1.854949e+06 2.277353e+06 1.746003e+06 2.055646e+06 3.052693e+06 1.619587e+06 1.259019e+06 1.550227e+06 2.124393e+06 2.078976e+06 1.774480e+06 2.792088e+06 1.676652e+06 2.292494e+06 1.413584e+06 2.505005e+06 2.178501e+06 2.511763e+06 3.551701e+06 2.187574e+06 2.339253e+06 1.859130e+06 2.781591e+06 2.575821e+06 1.733798e+06 1.657271e+06 2.690232e+06 1.796208e+06 2.729231e+06 1.730461e+06 2.061199e+06 1.982272e+06 2.407253e+06 3.387532e+06 1.513105e+06 1.459153e+06 3.368764e+06 2.927843e+06 1.613633e+06 1.976125e+06 1.498737e+06 1.709418e+06 2.742976e+06 3.271460e+06 2.099151e+06 3.432036e+06 2.025502e+06 2.774290e+06 1.929013e+06 2.378637e+06 2.604357e+06 1.513396e+06 2.282987e+06 3.177832e+06 3.574612e+06 3.033420e+06 2.354678e+06 2.204221e+06 2.583563e+06 2.095955e+06 2.050697e+06 2.282590e+06 1.683946e+06 3.921289e+06 3.309531e+06 2.731968e+06 2.232729e+06 1.600655e+06 3.103811e+06 2.545748e+06 1.507757e+06 1.717597e+06 2.147280e+06 3.098640e+06 2.780343e+06 1.757765e+06 1.949604e+06 2.828890e+06 2.122719e+06 2.383643e+06 1.662408e+06 2.347667e+06 3.031093e+06 1.226207e+06 5.884018e+06 2.115540e+06 1.375384e+06 1.157588e+06 3.009727e+06 3.262000e+06 2.042920e+06 2.650445e+06 3.775590e+06 3.100634e+06 2.256738e+06 2.719087e+06 2.076410e+06 1.095515e+06 2.756218e+06 1.637235e+06 2.508635e+06 2.887798e+06 2.340756e+06 2.393056e+06 2.492771e+06 2.535235e+06 2.215410e+06 2.408715e+06 2.051861e+06 1.992003e+06 1.649413e+06 2.491446e+06 2.290114e+06 2.450350e+06 1.922547e+06 1.581089e+06 2.046293e+06 1.496896e+06 3.096069e+06 1.886482e+06 1.920506e+06 3.019598e+06 1.713447e+06 2.041468e+06 1.894518e+06 2.300907e+06 1.925869e+06 2.911721e+06 4.439230e+06 2.406488e+06 2.509562e+06 3.081264e+06 3.264530e+06 3.005655e+06 2.753283e+06 1.991653e+06 2.734861e+06 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4.293037e+07 6.609298e+07 7.935334e+07 6.322111e+07 C11 H17 N3 O10 P2_7.454 2.362914e+06 2.671893e+06 3.509187e+06 1.795510e+06 8.135992e+04 3.319200e+06 3.111286e+06 4.059734e+06 109993.08 1.920849e+06 3.387416e+06 2.412959e+06 136027.70 2.322807e+06 2.720811e+06 3.204866e+06 1.471048e+05 2.659874e+06 2.967444e+06 2.424789e+06 1.219192e+05 3.669106e+06 3.065684e+06 2.469012e+06 35531.938 3.127410e+06 2.516978e+06 2.770353e+06 3.375271e+04 3.349616e+06 2.704105e+06 2.409978e+06 150126.09 3.705429e+06 2.324299e+06 2.844381e+06 1.541537e+05 3.524263e+06 2.626834e+06 3.022893e+06 2.221170e+05 2.744001e+06 2.115666e+06 2.916852e+06 2.040086e+05 3.565624e+06 3.107229e+06 2.578755e+06 3.447717e+06 4.158392e+06 2.860528e+06 2.854688e+06 2.186884e+06 2.819426e+06 3.427249e+06 2.095772e+06 3.267509e+06 2.962011e+06 3.387276e+06 2.749015e+06 2.037981e+06 2.877685e+06 2.544700e+06 3.570914e+06 3.523455e+06 2.904394e+06 1.842799e+06 3.195353e+06 2.544230e+06 2.461545e+06 1.957880e+06 2.308358e+06 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1.259966e+06 1.161659e+06 2.766924e+06 1.389291e+06 2.124911e+06 3.277881e+05 6.415983e+05 2.160908e+05 7.554216e+05 8.673432e+05 1.181043e+06 1.253469e+06 C6 H19 N3 O P2 S_7.455 5.635048e+06 2.134218e+06 1.908787e+06 2.438995e+06 2.165491e+05 1.599351e+06 2.063815e+06 1.844819e+06 216198.79 3.029930e+06 1.674407e+06 2.157773e+06 221175.97 1.679288e+06 2.107267e+06 2.247608e+06 2.009300e+05 2.354482e+06 1.960791e+06 1.998592e+06 1.699120e+05 1.901379e+06 2.019525e+06 2.042694e+06 40475.168 2.374710e+06 2.169787e+06 1.976281e+06 4.240423e+04 1.906049e+06 2.062731e+06 2.139631e+06 190349.92 2.196241e+06 1.995773e+06 2.054215e+06 1.878798e+05 2.111202e+06 2.277773e+06 1.959297e+06 2.621667e+05 1.829277e+06 2.089137e+06 2.304023e+06 2.559500e+05 2.033886e+06 2.108401e+06 2.014791e+06 2.472049e+06 1.951910e+06 3.131471e+06 3.267760e+06 2.257161e+06 2.372127e+06 2.958740e+06 2.643606e+06 2.665386e+06 2.736554e+06 1.857594e+06 2.650620e+06 2.700402e+06 2.884708e+06 1.755794e+06 2.829656e+06 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1.833902e+06 2.561313e+06 2.269210e+06 8.023395e+05 3.224581e+06 1.969109e+06 2.216220e+06 1.816345e+06 2.817714e+06 2.303589e+06 2.321716e+06 2.544997e+06 2.384338e+06 2.426143e+06 5.061913e+05 2.999783e+06 2.484079e+06 2.723982e+06 4.542460e+06 2.387182e+06 2.070386e+06 5.733350e+05 2.701999e+06 2.315788e+06 3.347338e+06 1.198352e+06 2.854022e+06 2.001449e+06 2.519664e+06 2.621388e+06 2.831876e+06 1.205570e+06 4.417989e+06 2.294002e+06 4.202385e+06 4.162652e+06 6.846298e+06 1.489379e+06 3.793790e+06 4.798916e+05 1.391419e+06 2.296338e+06 2.482903e+06 2.367195e+06 C17 H18 O8 S2_7.455 9.317441e+06 2.451865e+06 2.396312e+06 2.929387e+06 1.828941e+05 2.816507e+06 2.566297e+06 2.220170e+06 147644.88 4.115944e+06 1.470976e+06 3.677009e+06 119079.92 2.415237e+06 2.644388e+06 2.935677e+06 1.118459e+05 2.547306e+06 2.356775e+06 2.569015e+06 8.864714e+04 2.403346e+06 2.881670e+06 4.372692e+06 21783.848 1.928105e+06 2.667979e+06 2.471013e+06 2.933134e+04 2.250734e+06 1.596314e+06 4.383977e+06 135138.19 2.459609e+06 2.657454e+06 2.732921e+06 1.284648e+05 2.351268e+06 1.829089e+06 3.164610e+06 1.438964e+05 2.770210e+06 3.099644e+06 2.796825e+06 1.323384e+05 2.622773e+06 3.057470e+06 2.144410e+06 2.622813e+06 2.451665e+06 4.399786e+06 5.722728e+06 2.653672e+06 2.558643e+06 4.114904e+06 4.247747e+06 5.492281e+06 6.063106e+06 5.105357e+06 1.060202e+07 7.145598e+06 3.378646e+06 1.578487e+06 6.776388e+06 9.311821e+06 2.166567e+06 1.571208e+06 4.525875e+06 1.767822e+06 3.114428e+06 8.730898e+06 2.449301e+06 5.567311e+06 2.621651e+06 3.180659e+06 1.495695e+06 3.875908e+06 2.760129e+06 3.396418e+06 1.899941e+06 1.535373e+06 1.580338e+06 1.962433e+06 2.580823e+06 1.333695e+06 2.333545e+06 1.011268e+06 3.506016e+05 1.723545e+06 1.546829e+06 2.846557e+06 1.872304e+06 5.283924e+06 1.914747e+06 2.023631e+06 3.993704e+06 1.884049e+06 1.952181e+06 3.050201e+06 2.213644e+06 1.513928e+06 2.427908e+06 2.232524e+06 6.363887e+06 4.452009e+06 2.585050e+06 2.639034e+06 2.599422e+06 1.724099e+06 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2.925936e+06 2.076347e+06 1.772506e+06 2.940860e+06 4.025468e+06 1.231823e+06 3.559879e+07 3.371401e+06 1.064796e+06 1.374240e+06 4.402777e+06 4.271235e+06 2.405913e+06 4.073832e+06 6.314306e+06 3.124038e+06 2.072054e+06 1.967436e+06 2.543820e+06 1.176703e+06 3.964485e+06 1.881185e+06 3.084751e+06 3.036774e+06 2.851328e+06 2.387642e+06 1.591488e+06 2.273853e+06 1.717551e+06 2.755431e+06 2.324362e+06 1.909352e+06 1.233757e+06 2.650355e+06 2.232198e+06 3.379092e+06 1.638000e+06 1.625156e+06 1.723270e+06 1.652726e+06 4.668666e+06 1.827422e+06 1.807764e+06 5.665796e+06 1.595864e+06 2.258055e+06 2.149984e+06 2.285132e+06 2.024126e+06 4.987517e+06 4.603089e+06 2.958507e+06 4.054294e+06 3.510331e+06 4.813301e+06 4.625387e+06 3.252373e+06 2.792032e+06 5.384553e+06 2.515114e+06 6.405492e+06 4.050030e+06 2.703808e+06 2.379079e+06 8.270954e+06 3.167845e+06 3.795075e+06 6.643864e+06 9.532874e+06 2.398694e+06 4.217021e+06 1.261041e+06 1.709344e+06 2.444803e+06 2.571182e+06 3.352752e+06 C15 H28 N6 O15 P2_7.456 1.711941e+07 5.081033e+06 5.183578e+06 5.070763e+06 1.563052e+05 5.224140e+06 4.765358e+06 3.843002e+06 126646.12 7.407897e+06 3.813518e+06 6.774137e+06 101258.45 4.730528e+06 5.139992e+06 5.210268e+06 9.922823e+04 5.172130e+06 4.914813e+06 4.560647e+06 8.308505e+04 4.400119e+06 5.827712e+06 7.437417e+06 20315.212 4.312341e+06 4.841430e+06 4.210694e+06 2.580220e+04 5.173120e+06 5.801489e+06 6.113084e+06 128909.05 3.668030e+06 4.462541e+06 6.146825e+06 1.230921e+05 5.337392e+06 4.851026e+06 5.243806e+06 1.552012e+05 4.593253e+06 6.459911e+06 5.261577e+06 1.336870e+05 4.158654e+06 4.669614e+06 5.796161e+06 5.060654e+06 3.721548e+06 6.810600e+06 1.511572e+07 4.934769e+06 5.437386e+06 7.509921e+06 8.873464e+06 1.575279e+07 1.266055e+07 1.322339e+07 2.850456e+07 1.301263e+07 5.913479e+06 3.732774e+06 1.399673e+07 2.317075e+07 3.581171e+06 2.363464e+06 1.337046e+07 3.069156e+06 6.237036e+06 1.587749e+07 5.193595e+06 9.756344e+06 4.178558e+06 4.206230e+06 2.359591e+06 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9.727694e+06 3.241271e+06 6.259676e+06 3.775844e+06 4.260582e+06 7.419166e+06 4.228463e+06 4.928860e+06 1.132973e+07 6.170864e+06 4.511477e+06 4.852674e+06 8.737391e+06 5.589297e+06 4.815877e+06 4.019630e+06 5.688444e+06 3.086257e+06 6.119741e+06 2.761466e+06 5.986428e+06 4.105630e+06 3.173365e+06 1.097702e+07 6.833185e+06 2.826296e+06 2.892503e+06 4.653464e+06 7.699374e+06 7.003636e+06 4.438550e+06 4.164376e+06 8.120756e+06 6.212579e+06 2.965863e+06 2.987900e+06 5.122833e+06 7.936362e+06 1.726793e+06 8.553295e+07 7.139449e+06 2.033414e+06 2.276582e+06 9.804890e+06 7.753188e+06 4.147602e+06 7.849473e+06 1.152003e+07 7.084679e+06 4.679917e+06 5.668618e+06 4.709184e+06 2.049865e+06 7.979478e+06 3.296594e+06 4.163995e+06 6.088997e+06 5.658346e+06 4.196131e+06 4.868687e+06 3.671944e+06 2.636358e+06 4.676839e+06 3.963951e+06 5.698889e+06 2.098712e+06 5.968812e+06 6.726433e+06 4.450503e+06 3.034629e+06 2.945032e+06 4.497135e+06 2.684404e+06 1.323749e+07 2.966911e+06 3.357951e+06 5.311651e+06 2.972819e+06 5.442886e+06 4.441799e+06 4.504253e+06 2.991283e+06 9.830469e+06 8.348941e+06 5.306065e+06 7.841091e+06 6.726308e+06 1.082835e+07 9.084428e+06 7.541288e+06 6.104827e+06 1.147550e+07 4.324649e+06 1.454335e+07 8.332594e+06 5.086538e+06 4.899841e+06 1.348938e+07 6.366138e+06 6.456988e+06 1.234625e+07 1.975315e+07 5.459981e+06 7.888569e+06 2.011829e+06 3.762849e+06 5.708612e+06 3.412698e+06 5.682525e+06 C5 H12 N O9 P S_7.456 8.557258e+05 9.724525e+05 1.096102e+06 1.037597e+06 5.563808e+04 1.607396e+06 1.173442e+06 1.770396e+06 79318.76 8.353401e+05 1.384167e+06 7.246095e+05 107526.80 9.665867e+05 1.300079e+06 1.284308e+06 1.245484e+05 9.794001e+05 1.164729e+06 1.078755e+06 9.854397e+04 1.612579e+06 1.172851e+06 1.012664e+06 24722.301 1.428228e+06 9.111304e+05 1.198076e+06 2.677833e+04 1.254929e+06 1.309410e+06 1.042119e+06 116927.89 1.189039e+06 1.089143e+06 1.324995e+06 1.133838e+05 1.369115e+06 1.112659e+06 1.332491e+06 1.644852e+05 8.349832e+05 8.459874e+05 1.467095e+06 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2.620830e+07 1.299840e+07 1.554801e+07 1.310666e+07 1.799165e+07 1.832030e+07 1.005462e+07 9.159353e+06 1.549614e+07 1.128951e+07 1.807043e+07 1.053667e+07 1.418433e+07 1.455337e+07 1.585358e+07 2.403280e+07 8.613920e+06 9.135508e+06 2.454114e+07 1.951344e+07 1.394688e+07 1.275873e+07 1.287921e+07 8.859781e+06 2.065430e+07 2.145839e+07 1.270453e+07 1.565311e+07 1.319987e+07 2.174866e+07 1.243992e+07 1.908821e+07 1.910636e+07 9.146016e+06 1.358062e+07 1.694401e+07 1.638110e+07 1.949696e+07 1.547300e+07 1.318702e+07 1.675411e+07 1.498365e+07 1.498466e+07 1.926288e+07 1.289408e+07 1.795605e+07 1.166408e+07 1.675807e+07 1.360059e+07 9.521703e+06 1.951038e+07 1.277555e+07 1.216995e+07 1.079573e+07 1.326122e+07 1.820025e+07 1.616826e+07 1.092114e+07 1.368893e+07 1.823830e+07 1.582050e+07 1.334036e+07 1.173817e+07 1.710306e+07 1.793246e+07 9.811561e+06 4.968163e+07 1.655344e+07 9.158512e+06 1.017131e+07 2.330619e+07 2.065754e+07 1.431317e+07 1.809164e+07 2.640790e+07 1.695555e+07 1.258068e+07 2.069942e+07 1.134832e+07 6.653090e+06 1.795653e+07 1.360888e+07 1.556602e+07 2.039113e+07 1.564986e+07 1.704639e+07 1.532953e+07 1.598115e+07 9.605985e+06 1.514540e+07 1.380551e+07 1.493100e+07 1.053279e+07 1.603939e+07 1.391184e+07 1.616442e+07 1.156185e+07 9.874399e+06 1.302793e+07 9.669902e+06 2.213260e+07 1.265665e+07 1.262363e+07 2.209540e+07 1.157060e+07 1.676940e+07 1.337730e+07 1.464265e+07 1.209601e+07 1.988281e+07 3.080147e+07 1.900914e+07 1.676641e+07 1.840633e+07 2.312211e+07 2.392127e+07 1.823925e+07 1.678516e+07 1.849606e+07 1.338067e+07 2.169591e+07 1.798300e+07 1.576342e+07 1.052200e+07 2.534520e+07 1.857421e+07 1.920452e+07 2.908471e+07 3.490647e+07 1.124091e+07 2.337667e+07 1.080519e+07 1.008565e+07 1.474596e+07 1.550175e+07 1.628287e+07 C8 H13 N O5_7.464 2.397999e+06 1.720161e+06 1.418369e+06 1.789865e+06 1.541096e+05 1.489593e+06 1.705266e+06 1.559799e+06 154993.03 1.889319e+06 1.281735e+06 2.065767e+06 138317.64 1.429408e+06 1.716388e+06 1.753229e+06 1.410110e+05 1.575257e+06 1.354567e+06 1.556571e+06 1.111639e+05 1.570832e+06 1.657820e+06 2.206745e+06 27112.510 1.372283e+06 1.701766e+06 1.459979e+06 3.046959e+04 1.614864e+06 1.593226e+06 1.727583e+06 143176.61 1.551396e+06 1.713850e+06 1.565743e+06 1.349571e+05 1.493284e+06 1.725956e+06 1.697043e+06 1.704747e+05 1.659846e+06 1.558351e+06 1.962780e+06 1.645292e+05 1.410668e+06 1.446353e+06 1.749764e+06 1.649745e+06 1.694229e+06 1.795671e+06 2.552640e+06 1.922337e+06 1.505600e+06 2.797960e+06 2.153015e+06 2.618590e+06 3.143984e+06 2.321739e+06 2.408837e+06 2.877308e+06 2.451678e+06 1.690402e+06 3.217983e+06 2.978107e+06 1.766483e+06 1.278088e+06 1.836820e+06 1.808230e+06 1.621939e+06 2.809589e+06 2.373595e+06 2.435149e+06 1.941608e+06 2.572421e+06 1.099563e+06 3.683054e+06 2.075506e+06 1.286687e+06 1.370138e+06 1.271535e+06 1.710501e+06 1.350403e+06 1.730965e+06 1.406332e+06 1.773612e+06 7.713468e+05 5.287409e+05 1.486704e+06 1.156953e+06 1.846903e+06 1.242013e+06 2.466421e+06 1.227302e+06 1.159061e+06 2.259507e+06 1.803505e+06 1.434969e+06 2.202113e+06 1.683406e+06 9.131528e+05 1.454572e+06 1.361784e+06 2.082671e+06 2.079215e+06 1.678975e+06 1.536088e+06 1.466743e+06 1.080097e+06 1.697205e+06 1.203068e+06 1.428041e+06 2.232401e+06 1.498623e+06 1.542061e+06 1.081284e+06 1.969191e+06 1.362598e+06 1.078068e+06 1.378431e+06 9.730685e+05 1.540870e+06 8.133066e+05 1.346752e+06 1.507070e+06 1.652510e+06 2.624952e+06 1.360159e+06 1.193266e+06 1.360639e+06 1.636323e+06 1.374531e+06 9.644717e+05 1.119127e+06 1.856239e+06 1.335267e+06 1.697798e+06 1.039464e+06 1.294139e+06 1.364968e+06 1.661407e+06 2.414725e+06 1.132926e+06 8.895080e+05 1.884822e+06 1.918173e+06 1.356622e+06 1.441772e+06 9.438702e+05 1.036894e+06 1.888930e+06 1.707317e+06 1.331380e+06 1.878567e+06 1.622028e+06 1.740174e+06 1.795697e+06 1.618940e+06 2.489626e+06 1.229458e+06 1.924792e+06 1.914022e+06 1.638512e+06 1.732122e+06 1.516267e+06 1.572310e+06 1.708080e+06 1.786150e+06 1.363064e+06 2.132919e+06 1.115643e+06 1.524754e+06 1.746247e+06 1.642920e+06 1.813309e+06 9.497997e+05 2.574018e+06 1.874249e+06 1.531098e+06 1.446253e+06 1.575011e+06 1.326680e+06 1.809025e+06 1.732137e+06 2.032214e+06 1.760230e+06 1.462780e+06 1.384564e+06 2.085392e+06 1.435082e+06 2.513086e+06 9.276805e+05 1.156102e+07 1.559735e+06 8.432818e+05 9.352167e+05 2.813357e+06 1.791744e+06 1.376998e+06 2.337268e+06 2.552331e+06 2.112809e+06 1.349213e+06 1.764046e+06 1.610292e+06 1.139335e+06 1.428499e+06 1.186727e+06 1.514921e+06 1.707509e+06 1.457312e+06 1.421623e+06 1.284686e+06 1.521325e+06 1.341395e+06 1.594716e+06 1.567149e+06 1.649293e+06 1.571799e+06 1.556433e+06 1.568353e+06 1.406020e+06 1.237699e+06 9.501057e+05 1.510711e+06 8.799250e+05 2.225582e+06 9.737965e+05 1.466149e+06 2.268227e+06 1.310227e+06 1.297609e+06 2.361354e+06 1.985442e+06 1.023690e+06 2.546198e+06 2.334864e+06 1.346730e+06 1.335814e+06 1.497979e+06 3.495635e+06 1.895101e+06 1.696508e+06 1.924675e+06 2.052156e+06 1.364820e+06 2.226705e+06 2.002827e+06 1.332778e+06 1.235487e+06 2.086932e+06 2.205741e+06 2.152189e+06 2.407324e+06 2.540452e+06 1.291405e+06 1.665105e+06 1.230185e+06 9.868318e+05 1.219150e+06 2.222465e+06 2.013386e+06 C9 H18 N4 O3_7.466 1.191004e+06 3.191639e+05 4.945669e+05 4.332626e+05 2.029717e+05 3.919071e+05 4.556819e+05 3.006939e+05 188913.18 5.313111e+05 3.468005e+05 4.706047e+05 151207.80 3.478969e+05 4.390388e+05 3.979902e+05 1.354963e+05 5.076197e+05 3.336542e+05 4.637630e+05 1.051266e+05 3.137245e+05 4.794853e+05 4.940649e+05 26561.667 3.760060e+05 3.779190e+05 3.777387e+05 2.764834e+04 3.588053e+05 4.693968e+05 4.534496e+05 116565.03 4.357303e+05 3.911211e+05 4.102150e+05 1.128875e+05 3.464968e+05 4.153868e+05 5.169644e+05 1.472694e+05 3.618627e+05 4.035613e+05 4.441997e+05 1.508997e+05 3.904944e+05 4.137299e+05 4.039231e+05 2.272883e+05 7.947127e+04 1.753083e+05 3.934378e+06 7.900632e+05 9.277718e+04 1.157991e+06 2.627737e+06 4.722616e+05 9.124824e+05 2.148786e+05 1.105584e+06 2.582492e+06 1.683066e+06 8.729247e+05 1.893573e+05 1.119233e+05 1.660815e+06 7.489791e+05 1.015283e+06 5.267568e+05 5.219236e+05 1.869915e+05 2.538264e+05 4.459808e+05 7.129092e+05 2.742702e+06 4.380535e+05 1.091183e+05 1.063967e+06 4.229131e+05 1.867985e+05 3.021727e+05 3.100838e+05 2.299705e+05 1.531058e+06 1.613243e+05 2.132309e+05 1.063287e+06 9.773299e+04 9.180209e+04 2.478778e+05 9.204868e+05 5.822877e+05 6.614577e+05 9.735516e+05 2.211382e+05 1.687360e+06 5.877524e+05 3.033891e+06 5.462922e+05 7.270763e+05 3.615840e+05 1.291510e+05 8.612390e+05 2.951410e+05 1.086979e+06 1.181677e+06 3.871166e+05 3.411968e+05 6.363598e+05 9.477624e+04 3.934628e+05 8.541293e+05 2.251752e+06 5.668993e+05 3.009966e+05 1.206109e+06 3.974977e+05 2.857052e+06 1.866303e+05 7.157697e+05 7.055298e+05 2.394483e+05 1.526082e+05 9.302655e+04 9.741178e+04 9.918628e+04 2.209251e+05 9.174712e+05 1.914350e+05 8.576801e+05 3.035701e+06 6.416777e+05 4.760202e+05 8.813621e+05 7.190122e+05 1.279494e+05 1.531399e+05 3.455523e+05 4.964091e+05 1.424920e+05 9.606835e+05 3.198193e+05 1.525971e+05 9.948542e+04 1.563836e+05 8.329290e+05 8.645070e+05 6.308537e+05 4.754024e+05 9.946541e+04 1.540227e+05 7.201704e+05 6.023525e+05 5.040784e+05 1.433167e+05 1.253914e+06 2.089666e+05 3.335039e+05 3.425431e+05 1.869405e+05 1.899072e+05 1.618489e+05 1.167477e+06 1.161376e+06 1.400907e+05 1.890051e+05 9.982314e+05 3.713218e+05 1.225613e+05 5.161205e+05 1.154304e+05 1.455074e+05 9.328971e+04 2.825309e+05 9.177571e+05 3.186929e+05 1.141566e+06 1.028731e+06 4.832612e+05 2.253178e+05 6.457291e+04 1.121516e+06 1.721786e+05 6.496601e+05 1.615086e+06 1.140299e+05 4.977921e+05 2.319245e+05 8.532405e+05 9.164105e+05 7.657654e+04 1.278644e+05 9.062870e+04 4.341097e+05 2.870976e+05 1.196477e+05 1.366968e+06 9.843537e+05 8.213330e+05 1.586838e+06 3.987892e+05 2.102172e+05 3.220974e+05 1.230363e+05 2.112023e+05 6.209241e+04 3.669494e+05 1.855585e+05 2.438572e+05 2.615622e+05 9.224253e+04 1.206341e+05 1.055181e+06 5.346018e+05 9.455451e+05 7.682195e+05 7.580609e+05 1.042142e+05 8.872896e+05 6.498412e+05 1.294978e+05 2.138334e+05 2.381482e+05 7.191614e+04 3.712592e+05 1.024361e+05 1.632396e+05 4.113914e+05 2.322658e+05 6.481842e+05 2.211381e+05 1.634204e+06 1.963967e+05 1.348913e+05 7.560298e+05 1.876995e+05 4.504070e+05 1.619906e+05 3.363349e+05 2.363682e+05 1.498547e+06 1.261449e+06 1.497066e+05 2.302939e+05 1.554576e+05 1.205503e+05 1.063864e+05 1.376860e+05 1.413880e+06 1.430022e+05 6.079920e+05 2.013400e+06 7.951704e+05 1.539542e+05 4.408613e+05 1.119833e+05 1.316011e+06 1.426503e+05 8.494677e+05 5.121717e+05 8.153018e+05 2.192620e+05 178.53105_7.466 1.154690e+07 4.369974e+06 4.559630e+06 4.226878e+06 5.663722e+05 3.961180e+06 3.476730e+06 3.856588e+06 396757.51 6.041601e+06 3.813487e+06 5.960322e+06 366439.45 3.888249e+06 4.318569e+06 4.242489e+06 4.084082e+05 3.528659e+06 3.537978e+06 6.167113e+06 3.425704e+05 3.798336e+06 4.341077e+06 4.988468e+06 101146.772 3.917583e+06 3.929974e+06 4.154346e+06 1.017134e+05 4.560031e+06 4.588791e+06 4.391339e+06 526786.57 3.862325e+06 4.165792e+06 4.320162e+06 3.847167e+05 5.626884e+06 3.823325e+06 4.654613e+06 5.154415e+05 3.908396e+06 4.882719e+06 3.846233e+06 5.018527e+05 4.066191e+06 4.707873e+06 4.412995e+06 4.583092e+06 2.842522e+06 5.256478e+06 6.888770e+06 4.022472e+06 3.459667e+06 5.250273e+06 5.810427e+06 7.359094e+06 6.585261e+06 6.374743e+06 9.450060e+06 9.499532e+06 5.516324e+06 3.491040e+06 7.316704e+06 8.153457e+06 4.466587e+06 2.556181e+06 4.795008e+06 2.839450e+06 4.789914e+06 1.008572e+07 4.193295e+06 6.968437e+06 4.125634e+06 4.868787e+06 3.321390e+06 4.970926e+06 4.031352e+06 4.266672e+06 3.429706e+06 6.319686e+06 2.907301e+06 3.158342e+06 4.432037e+06 3.021360e+06 4.315172e+06 2.937391e+06 1.160519e+06 2.870090e+06 3.893352e+06 5.054175e+06 2.730425e+06 5.764644e+06 4.728979e+06 3.167498e+06 4.503909e+06 3.443324e+06 3.827180e+06 4.703169e+06 3.539757e+06 2.341545e+06 3.388646e+06 3.672192e+06 7.533837e+06 5.637187e+06 4.424687e+06 4.735897e+06 4.221584e+06 3.471620e+06 4.461639e+06 3.352847e+06 3.225972e+06 5.603606e+06 3.958682e+06 1.882653e+06 3.286662e+06 4.052178e+06 3.620771e+06 3.515529e+06 3.148677e+06 3.015727e+06 4.860019e+06 2.241690e+06 5.174385e+06 4.541882e+06 3.782468e+06 6.651414e+06 4.369551e+06 3.820511e+06 3.085728e+06 5.295698e+06 4.378445e+06 3.335871e+06 2.853598e+06 3.824565e+06 3.136291e+06 5.323758e+06 2.696227e+06 4.565428e+06 4.268514e+06 4.664693e+06 6.329560e+06 2.274890e+06 2.736061e+06 5.643134e+06 4.996243e+06 3.826519e+06 3.161987e+06 2.847689e+06 2.890547e+06 5.880852e+06 6.022156e+06 3.513989e+06 5.169887e+06 3.760458e+06 5.956744e+06 3.457746e+06 5.568226e+06 5.052814e+06 2.636305e+06 4.132913e+06 5.718940e+06 4.467798e+06 4.941182e+06 3.876316e+06 3.508916e+06 3.524379e+06 3.615058e+06 5.689023e+06 4.946398e+06 2.879932e+06 4.161911e+06 4.681675e+06 5.152975e+06 7.774197e+06 2.427994e+06 6.597169e+06 5.774908e+06 2.595307e+06 3.063222e+06 3.479869e+06 6.098477e+06 4.299130e+06 3.062698e+06 4.153687e+06 4.705970e+06 7.893089e+06 4.275230e+06 3.563012e+06 4.824806e+06 5.286209e+06 2.073417e+06 1.527286e+07 4.751256e+06 2.222795e+06 2.451730e+06 7.286256e+06 5.663708e+06 5.227962e+06 5.151268e+06 6.503135e+06 5.066439e+06 3.662658e+06 4.364242e+06 3.079263e+06 1.880381e+06 6.215017e+06 3.781557e+06 4.420081e+06 7.312646e+06 3.942832e+06 4.198032e+06 4.660158e+06 4.588558e+06 3.041681e+06 4.085554e+06 4.094401e+06 4.684833e+06 2.953941e+06 4.627434e+06 3.801711e+06 4.168404e+06 3.200726e+06 3.181096e+06 3.737663e+06 2.447790e+06 5.952889e+06 3.656437e+06 3.970161e+06 6.732951e+06 3.343465e+06 4.705085e+06 4.527156e+06 4.070503e+06 3.499057e+06 5.246411e+06 7.536510e+06 4.737461e+06 4.244961e+06 5.422685e+06 6.961995e+06 5.828503e+06 5.065669e+06 4.387103e+06 4.726466e+06 4.502993e+06 7.976019e+06 4.938985e+06 4.123289e+06 2.848745e+06 6.173967e+06 4.928235e+06 4.628687e+06 8.154494e+06 9.536657e+06 3.243303e+06 5.886740e+06 2.720254e+06 2.742316e+06 4.492888e+06 4.188769e+06 3.990702e+06 "2,4,6-Octatriyn-1-ol_7.467" 2.116913e+08 9.552135e+07 9.499776e+07 9.893676e+07 5.578151e+05 8.483087e+07 9.428150e+07 9.010008e+07 502114.20 1.168380e+08 5.614006e+07 1.115611e+08 396994.29 9.609142e+07 9.804581e+07 9.639412e+07 3.486221e+05 9.056234e+07 9.200343e+07 9.064407e+07 2.622356e+05 9.145147e+07 9.735617e+07 1.066472e+08 100326.357 9.092376e+07 8.938858e+07 8.937737e+07 9.251696e+04 9.638731e+07 9.053928e+07 9.900309e+07 328021.69 9.294811e+07 9.794223e+07 8.813198e+07 2.894857e+05 9.291361e+07 9.636811e+07 9.666937e+07 3.713747e+05 8.686244e+07 9.818000e+07 1.052175e+08 3.512506e+05 8.857040e+07 8.583487e+07 9.760249e+07 9.319478e+07 6.157088e+07 1.161928e+08 1.275749e+08 1.238048e+08 9.960620e+07 1.314504e+08 1.697258e+08 1.282663e+08 1.430528e+08 1.387437e+08 1.211132e+08 1.444446e+08 1.626003e+08 9.259297e+07 1.160379e+08 1.259476e+08 1.008872e+08 5.991546e+07 9.657511e+07 1.145938e+08 9.124165e+07 1.553342e+08 1.686233e+08 1.117029e+08 5.715434e+07 1.471752e+08 7.290677e+07 1.299123e+08 8.211502e+07 5.816231e+07 5.416831e+07 7.971233e+07 1.226204e+08 6.291467e+07 1.173440e+08 5.310193e+07 6.179121e+07 8.019846e+07 4.969070e+07 1.125950e+08 1.028331e+08 1.080660e+08 9.800629e+07 7.699919e+07 7.643240e+07 5.347534e+07 9.694538e+07 1.051162e+08 1.078998e+08 9.328153e+07 7.597882e+07 6.725902e+07 7.366061e+07 9.517502e+07 1.077293e+08 1.021343e+08 9.358148e+07 1.082296e+08 9.484259e+07 8.147931e+07 1.131635e+08 8.571209e+07 5.531642e+07 1.149742e+08 1.053429e+08 4.316850e+07 1.160506e+08 9.299613e+07 7.445411e+07 3.419494e+07 1.000379e+08 5.374537e+07 1.423313e+08 4.501224e+07 1.043159e+08 1.193020e+08 7.521651e+07 1.131251e+08 8.475211e+07 7.085583e+07 1.182160e+08 1.001961e+08 1.159806e+08 5.234750e+07 1.116986e+08 1.183250e+08 5.172074e+07 9.475339e+07 8.186797e+07 9.148680e+07 6.345553e+07 7.986847e+07 9.931339e+07 1.422311e+08 1.176776e+08 2.006474e+08 8.376467e+07 1.038847e+08 1.007422e+08 9.408384e+07 6.251675e+07 8.599748e+07 9.066000e+07 1.300341e+08 7.498389e+07 5.977882e+07 1.764512e+08 1.099191e+08 1.580046e+08 1.062799e+08 5.998096e+07 1.314280e+08 5.953531e+07 9.290810e+07 1.134844e+08 4.146122e+07 6.221097e+07 1.027088e+08 1.298757e+08 7.127277e+07 1.337348e+08 4.327574e+07 7.761347e+07 1.098184e+08 1.056247e+08 9.639448e+07 6.758419e+07 1.380169e+08 8.124640e+07 1.179553e+08 8.939903e+07 4.774204e+07 1.013984e+08 7.925893e+07 9.391940e+07 8.573829e+07 6.703351e+07 6.845782e+07 1.082079e+08 9.808562e+07 1.125857e+08 7.549776e+07 6.770204e+07 7.609591e+07 1.159506e+08 4.734965e+07 7.891501e+07 1.319807e+08 9.222953e+07 1.129970e+08 8.819127e+07 2.229709e+08 8.814948e+07 9.484513e+07 1.406562e+08 6.764819e+07 4.685797e+07 9.783049e+07 3.437426e+07 9.750770e+07 7.488902e+07 1.021575e+08 7.618712e+07 1.028386e+08 1.127996e+08 1.000414e+08 1.459249e+08 7.521167e+07 8.223966e+07 1.018578e+08 9.592725e+07 8.214185e+07 6.748621e+07 9.698879e+07 6.130370e+07 8.031512e+07 5.840613e+07 1.137417e+08 9.015966e+07 1.087702e+08 1.603184e+08 1.168117e+08 1.043659e+08 7.650395e+07 1.093702e+08 1.387169e+08 8.986293e+07 1.902098e+08 1.291869e+08 7.090032e+07 6.484115e+07 1.391510e+08 8.178435e+07 7.730421e+07 1.061478e+08 1.208007e+08 8.209618e+07 1.498166e+08 8.579910e+07 1.264574e+08 1.021462e+08 1.232626e+08 1.173293e+08 1.401793e+08 1.223543e+08 1.823542e+08 7.515423e+07 1.285615e+08 5.058301e+07 6.574949e+07 7.860394e+07 1.116786e+08 1.444656e+08 C7 H6_7.467 1.808997e+07 7.524595e+06 7.877963e+06 7.508827e+06 8.944074e+05 7.021891e+06 8.352206e+06 7.287856e+06 847968.80 9.400494e+06 4.730533e+06 9.299221e+06 658581.46 7.163231e+06 7.494416e+06 7.719930e+06 6.407700e+05 7.444576e+06 8.991224e+06 7.116592e+06 5.724899e+05 6.455362e+06 8.366328e+06 8.476675e+06 31721.334 7.214699e+06 7.621485e+06 7.050221e+06 3.428264e+04 7.603580e+06 7.503420e+06 7.952273e+06 171595.23 7.771785e+06 8.143367e+06 6.877415e+06 3.165671e+05 7.110781e+06 8.053230e+06 8.052761e+06 4.564640e+05 7.153449e+06 8.331964e+06 8.128915e+06 1.740475e+05 7.060455e+06 6.937992e+06 8.040195e+06 8.130048e+06 6.914844e+06 9.843494e+06 1.044347e+07 1.019652e+07 8.428794e+06 1.036110e+07 1.372598e+07 9.953156e+06 1.113012e+07 1.063663e+07 9.170541e+06 1.147272e+07 1.434233e+07 1.616516e+06 9.057238e+06 1.047448e+07 7.731237e+06 2.159667e+06 7.510090e+06 8.731544e+06 7.613481e+06 1.160547e+07 1.305892e+07 2.366118e+06 4.501843e+06 1.264591e+07 5.974223e+06 1.020646e+07 7.091949e+06 4.015215e+06 4.159664e+06 5.880655e+06 1.035626e+07 4.821582e+06 9.117562e+06 3.663632e+06 5.135726e+06 6.780786e+06 2.945460e+06 8.985977e+06 8.657762e+06 9.186027e+06 6.095422e+06 6.543548e+06 3.575589e+06 4.713593e+06 1.890453e+06 9.275933e+06 8.717979e+06 7.114067e+06 6.766470e+06 1.100914e+06 6.171161e+06 8.843186e+06 9.249425e+06 8.509447e+06 7.584457e+06 8.671563e+06 7.233421e+06 6.715866e+06 8.928601e+06 7.400252e+06 5.032415e+06 9.478564e+06 8.767851e+06 3.967065e+06 9.360556e+06 7.879166e+06 6.249251e+06 2.537606e+06 8.357800e+06 3.960800e+06 1.153602e+07 4.250373e+06 8.743406e+06 9.522776e+06 6.345337e+06 8.686181e+06 6.032605e+06 4.784928e+06 6.400914e+06 8.756622e+06 9.640695e+06 3.714582e+06 9.852638e+06 1.001604e+07 3.933580e+06 1.912249e+06 6.950605e+06 7.202332e+06 4.195157e+06 6.894085e+06 8.298538e+06 1.072302e+07 9.572818e+06 1.409745e+07 6.925918e+06 9.378449e+06 8.633850e+06 5.765125e+06 1.501893e+06 6.607925e+06 7.218880e+06 1.001319e+07 6.036434e+06 3.955908e+06 1.473323e+07 9.724377e+06 1.389588e+07 8.680986e+06 4.371706e+06 1.129335e+07 4.202035e+06 7.083447e+06 8.849579e+06 2.580643e+06 4.911341e+06 8.155058e+06 1.046760e+07 5.680502e+06 1.117831e+07 3.913269e+06 5.331266e+06 9.145043e+06 8.670854e+06 7.769051e+06 1.078964e+06 1.167435e+07 6.902962e+06 8.328900e+06 7.139541e+06 3.757546e+06 9.668907e+06 6.604670e+06 7.841411e+06 6.728291e+06 5.679428e+06 3.730452e+06 9.000660e+06 7.642488e+06 8.804969e+06 6.126040e+06 3.980292e+06 6.778125e+06 9.119816e+06 4.010007e+06 5.351005e+06 1.213650e+07 7.709706e+06 8.993928e+06 7.000662e+06 1.775957e+07 7.034443e+06 7.589332e+06 1.104720e+07 7.425923e+06 1.784399e+06 8.199265e+06 2.197197e+06 8.006375e+06 6.592373e+06 8.651315e+06 5.861825e+06 8.171449e+06 9.352217e+06 9.331528e+06 1.210311e+07 6.227718e+06 6.608501e+06 8.985137e+06 8.395178e+06 7.075865e+06 4.350447e+06 7.829915e+06 5.292860e+06 7.475379e+06 4.889985e+06 8.903913e+06 7.433974e+06 8.798774e+06 1.530873e+07 9.774568e+06 8.057402e+06 5.600214e+06 9.054800e+06 1.164961e+07 7.457378e+06 1.615873e+07 1.100771e+07 4.805301e+06 3.408264e+06 1.120642e+07 7.722258e+06 7.342063e+06 5.121908e+06 9.876823e+06 5.589125e+06 1.281406e+07 7.718615e+06 1.037223e+07 1.177670e+07 1.125001e+07 9.810300e+06 1.187710e+07 9.312031e+06 1.560984e+07 5.974709e+06 1.038377e+07 3.735132e+06 5.394277e+06 1.314791e+06 8.985830e+06 1.148142e+07 Indole_7.468 4.445348e+06 2.031346e+06 2.022654e+06 1.955652e+06 4.965455e+05 2.055900e+06 2.106806e+06 1.610342e+06 405136.21 2.625027e+06 1.451584e+06 2.227175e+06 214987.97 2.077792e+06 2.025121e+06 2.206695e+06 1.863239e+05 1.925223e+06 2.123662e+06 2.012212e+06 1.531378e+05 1.920451e+06 1.913015e+06 2.255691e+06 97849.073 1.745289e+06 1.876937e+06 1.736599e+06 3.427914e+04 2.896807e+06 1.869435e+06 1.889311e+06 198030.19 1.974719e+06 2.134212e+06 1.865760e+06 1.716820e+05 1.916090e+06 2.060001e+06 2.262032e+06 2.274904e+05 1.901425e+06 1.918654e+06 2.258303e+06 2.154343e+05 1.937036e+06 1.790704e+06 2.180856e+06 2.028579e+06 1.470451e+06 2.632539e+06 2.342998e+06 2.325674e+06 2.150813e+06 2.727953e+06 3.494637e+06 2.567104e+06 2.827818e+06 2.708006e+06 2.446220e+06 2.875364e+06 3.496903e+06 1.854391e+06 2.442701e+06 2.556943e+06 2.032659e+06 1.822922e+06 2.837960e+06 2.478547e+06 1.882531e+06 3.215439e+06 4.455263e+06 1.671695e+06 1.308603e+06 2.917249e+06 1.269124e+06 2.656120e+06 1.896419e+06 1.113991e+06 1.200322e+06 1.572739e+06 2.429319e+06 1.379816e+06 2.550634e+06 1.339919e+06 1.411931e+06 1.863670e+06 8.789860e+05 2.398085e+06 2.313552e+06 2.213582e+06 1.823190e+06 1.540519e+06 2.463710e+06 1.260264e+06 2.094285e+06 2.337434e+06 2.622235e+06 2.015393e+06 1.586536e+06 1.550986e+06 1.350867e+06 1.791936e+06 1.730615e+06 2.211002e+06 1.810980e+06 2.411049e+06 1.935790e+06 1.768797e+06 2.168752e+06 1.833477e+06 1.339130e+06 1.842244e+06 2.549777e+06 1.519181e+06 1.940084e+06 1.850288e+06 1.824248e+06 7.742868e+05 2.413424e+06 1.319016e+06 2.933861e+06 1.224911e+06 2.021515e+06 2.867080e+06 1.634718e+06 2.548907e+06 1.623101e+06 1.473806e+06 2.180485e+06 2.028374e+06 2.525838e+06 1.094301e+06 2.014752e+06 2.705191e+06 1.087373e+06 1.974902e+06 1.984099e+06 1.795751e+06 1.233259e+06 1.861163e+06 1.801904e+06 2.473379e+06 2.328393e+06 3.360748e+06 1.680708e+06 2.279154e+06 1.827788e+06 2.120314e+06 1.564566e+06 2.029487e+06 1.738276e+06 2.154105e+06 1.846663e+06 1.139883e+06 3.433285e+06 2.572803e+06 3.336890e+06 2.215981e+06 1.126709e+06 2.620221e+06 1.057285e+06 2.022056e+06 2.044430e+06 9.065413e+05 1.200988e+06 2.339733e+06 3.139260e+06 1.651040e+06 3.499401e+06 1.028507e+06 1.796814e+06 2.487216e+06 1.999691e+06 2.368507e+06 1.064096e+06 2.740783e+06 1.925769e+06 2.315060e+06 1.957315e+06 1.123786e+06 2.284653e+06 1.700816e+06 1.909884e+06 1.968465e+06 1.812744e+06 1.090277e+06 2.301076e+06 1.998043e+06 2.624589e+06 1.455435e+06 1.218345e+06 1.893590e+06 2.313595e+06 1.079451e+06 1.851901e+06 3.196763e+06 1.663370e+06 1.508106e+06 1.797915e+06 5.308189e+06 1.944533e+06 2.116947e+06 2.665753e+06 1.876441e+06 1.566999e+06 1.976533e+06 7.288422e+05 2.172411e+06 1.729231e+06 2.145238e+06 1.845790e+06 2.295280e+06 1.588433e+06 2.308234e+06 3.182474e+06 1.730534e+06 1.940991e+06 2.265473e+06 1.993381e+06 1.656427e+06 1.533410e+06 1.785700e+06 1.530931e+06 1.884489e+06 1.085603e+06 2.665951e+06 2.211033e+06 2.169251e+06 3.637237e+06 2.765144e+06 2.175116e+06 1.573958e+06 2.858920e+06 2.653068e+06 2.010536e+06 4.057651e+06 2.524870e+06 1.706619e+06 1.109637e+06 2.717859e+06 1.920670e+06 1.620300e+06 1.897056e+06 2.507611e+06 1.655049e+06 2.887161e+06 1.707446e+06 2.991584e+06 2.112515e+06 2.901497e+06 2.261211e+06 2.836387e+06 2.497669e+06 3.873823e+06 1.613905e+06 2.724199e+06 1.269929e+06 1.661093e+06 1.917540e+06 1.977543e+06 2.858850e+06 Benzenol_7.468 1.915991e+08 8.775688e+07 8.686085e+07 8.981843e+07 5.507528e+05 7.959056e+07 8.686732e+07 8.378047e+07 496973.34 1.067080e+08 5.216230e+07 1.025180e+08 395244.22 8.876772e+07 8.944204e+07 8.848329e+07 3.477040e+05 8.335540e+07 8.391709e+07 8.436557e+07 2.605340e+05 8.461723e+07 8.933623e+07 9.783620e+07 99918.535 8.416367e+07 8.179035e+07 8.174174e+07 1.089772e+05 8.906007e+07 8.269644e+07 9.173318e+07 325430.93 8.518312e+07 9.100924e+07 8.132734e+07 2.878622e+05 8.551830e+07 8.771959e+07 8.848760e+07 3.705825e+05 7.997096e+07 9.062434e+07 9.719074e+07 3.995962e+05 8.169607e+07 7.836771e+07 9.002227e+07 8.597348e+07 5.758355e+07 1.066766e+08 1.173379e+08 1.150036e+08 9.126569e+07 1.212329e+08 1.549081e+08 1.171085e+08 1.309031e+08 1.263064e+08 1.119366e+08 1.312862e+08 1.496357e+08 6.783935e+07 1.068776e+08 1.162994e+08 9.400893e+07 5.488408e+07 8.926232e+07 1.052697e+08 8.410515e+07 1.422950e+08 1.534468e+08 1.025748e+08 5.161799e+07 1.350644e+08 6.729063e+07 1.193876e+08 7.624447e+07 5.426305e+07 5.062185e+07 7.428759e+07 1.127743e+08 5.835847e+07 1.089545e+08 4.921521e+07 5.737192e+07 7.309719e+07 4.587869e+07 1.028188e+08 9.361462e+07 9.864884e+07 8.494738e+07 6.979079e+07 7.007113e+07 5.028617e+07 8.903728e+07 9.590399e+07 9.904137e+07 8.556996e+07 7.130834e+07 6.144924e+07 6.799947e+07 8.634478e+07 9.837923e+07 9.337639e+07 8.573314e+07 9.851878e+07 8.738764e+07 7.487468e+07 1.040589e+08 7.835388e+07 5.122502e+07 1.057344e+08 9.739186e+07 4.039478e+07 1.059564e+08 8.387051e+07 6.812783e+07 3.164520e+07 9.225310e+07 5.018958e+07 1.310543e+08 4.137982e+07 9.591843e+07 1.098344e+08 6.961669e+07 1.034887e+08 7.857377e+07 6.591162e+07 1.092661e+08 9.202493e+07 1.056560e+08 4.909631e+07 1.021329e+08 1.091203e+08 4.716592e+07 8.622385e+07 7.539276e+07 8.372839e+07 5.896089e+07 7.324793e+07 9.149393e+07 1.381046e+08 1.078209e+08 1.836335e+08 7.706023e+07 9.522049e+07 9.152848e+07 8.889131e+07 5.714045e+07 7.962905e+07 8.325446e+07 1.192891e+08 6.877288e+07 5.563626e+07 1.610534e+08 1.003350e+08 1.439734e+08 9.729841e+07 5.565832e+07 1.200263e+08 5.476757e+07 8.550933e+07 1.042028e+08 3.842809e+07 5.773391e+07 9.449623e+07 1.192985e+08 6.666198e+07 1.225894e+08 4.065601e+07 7.107482e+07 1.009459e+08 9.670745e+07 8.763955e+07 6.361550e+07 1.256582e+08 7.419725e+07 1.091619e+08 8.224865e+07 4.416719e+07 9.287625e+07 7.328572e+07 6.638616e+07 7.843343e+07 6.152452e+07 6.545552e+07 9.940891e+07 8.980740e+07 1.030787e+08 6.965183e+07 6.239856e+07 6.948749e+07 1.057680e+08 4.330853e+07 7.277330e+07 1.201223e+08 8.511174e+07 1.028247e+08 8.128569e+07 2.030441e+08 8.082895e+07 8.730525e+07 1.295853e+08 8.477381e+07 4.479535e+07 8.986908e+07 3.130270e+07 8.905125e+07 7.032976e+07 9.328232e+07 7.050530e+07 9.450056e+07 1.031515e+08 9.255904e+07 1.314825e+08 6.889747e+07 7.564103e+07 9.334236e+07 8.828541e+07 7.726544e+07 6.288324e+07 8.976097e+07 5.629936e+07 7.303753e+07 5.447505e+07 1.040775e+08 8.222080e+07 1.001741e+08 1.471118e+08 1.066856e+08 9.578732e+07 7.052338e+07 1.004831e+08 1.270569e+08 8.238490e+07 1.719719e+08 1.193394e+08 6.654760e+07 6.053914e+07 1.267854e+08 7.489195e+07 7.148630e+07 9.555519e+07 1.110765e+08 7.365012e+07 1.375193e+08 7.775984e+07 1.168894e+08 9.128120e+07 1.124164e+08 1.066559e+08 1.283638e+08 1.116498e+08 1.661608e+08 7.067682e+07 1.174942e+08 4.656182e+07 6.065033e+07 7.256214e+07 1.024481e+08 1.323887e+08 4-Hydroxybenzaldehyde_7.468 5.730844e+07 2.484925e+07 2.504348e+07 2.474441e+07 2.835671e+05 2.381982e+07 2.802068e+07 2.616354e+07 409413.31 3.431253e+07 1.824395e+07 7.715671e+06 363841.43 3.249642e+07 2.916447e+07 2.731203e+07 1.893392e+05 2.648077e+07 2.478603e+07 2.449749e+07 1.905779e+05 2.345629e+07 2.621600e+07 2.818634e+07 152530.771 2.602320e+07 2.441224e+07 2.353853e+07 1.568916e+05 2.407010e+07 2.443154e+07 2.717519e+07 174740.44 2.623643e+07 2.557902e+07 2.434738e+07 1.494157e+05 2.439845e+07 2.410839e+07 2.749680e+07 1.917769e+05 2.365892e+07 2.648768e+07 2.734877e+07 2.509597e+05 2.312261e+07 2.445485e+07 2.580110e+07 2.523215e+07 2.668263e+07 3.110553e+07 3.708289e+07 3.351781e+07 2.788189e+07 3.978036e+07 5.018161e+07 3.485944e+07 3.836930e+07 3.610881e+07 3.984940e+07 3.766637e+07 4.729658e+07 6.504634e+06 3.284755e+07 3.484374e+07 2.519807e+07 2.422660e+07 2.692129e+07 3.288801e+07 2.721179e+07 4.386292e+07 4.709374e+07 3.032465e+07 1.833775e+07 4.013491e+07 1.929872e+07 3.569389e+07 2.339526e+07 1.698242e+07 1.372482e+07 2.083205e+07 3.438845e+07 1.757592e+07 3.556340e+07 1.374546e+07 1.626965e+07 2.181465e+07 1.589112e+07 3.010285e+07 2.831576e+07 2.861125e+07 3.308436e+07 2.110525e+07 1.270231e+07 3.811214e+06 2.671307e+07 3.020659e+07 3.056248e+07 2.581139e+07 2.484004e+07 1.934287e+07 1.881712e+07 2.867756e+07 2.836589e+07 2.877771e+07 2.570237e+07 2.908673e+07 2.466585e+07 2.478854e+07 3.132013e+07 2.362021e+07 1.528845e+07 5.178461e+06 2.998041e+07 2.008665e+07 3.080323e+07 2.438919e+07 2.110885e+07 8.482966e+06 2.955582e+07 1.422048e+07 3.781897e+07 3.430524e+06 2.860530e+07 3.292703e+07 2.113579e+07 3.273182e+07 2.010147e+07 2.058110e+07 3.557734e+07 2.717751e+07 3.264638e+07 1.384784e+07 3.056160e+07 3.985272e+07 1.527299e+07 2.573731e+07 2.265800e+07 2.315858e+07 1.448616e+07 2.220921e+07 2.818003e+07 3.013197e+07 3.181969e+07 5.420866e+07 4.597386e+06 2.883531e+07 2.832198e+07 3.168543e+07 1.728491e+07 2.706332e+07 2.403876e+07 3.979099e+07 2.021922e+07 1.520731e+07 5.449092e+07 2.988112e+07 4.662054e+07 2.800750e+07 1.935861e+07 3.616446e+07 1.393481e+07 2.485882e+07 2.869237e+07 1.019564e+07 2.245590e+07 3.127497e+07 3.623343e+07 1.998146e+07 4.303506e+07 1.308691e+07 1.933585e+07 2.952337e+07 3.018577e+07 2.630085e+07 3.774610e+06 3.799494e+07 2.337407e+07 3.149865e+07 2.568375e+07 1.288592e+07 3.002483e+07 2.360254e+07 6.894071e+06 2.299269e+07 1.788561e+07 2.458094e+06 2.940984e+07 2.431147e+07 3.033625e+07 2.254498e+07 2.061597e+07 1.998256e+07 3.322435e+07 1.345525e+07 2.277196e+07 4.076363e+07 2.483192e+07 2.922954e+07 2.440595e+07 7.407912e+07 2.410177e+07 2.811884e+07 4.504725e+07 2.596428e+07 1.902663e+07 2.612775e+07 7.665981e+06 2.681439e+07 5.525338e+06 2.828154e+07 1.940928e+07 2.694743e+07 3.021852e+07 2.890272e+07 3.876933e+07 2.011313e+07 2.534944e+07 3.214680e+07 2.439517e+07 2.940398e+07 2.105632e+07 2.412120e+07 1.688395e+07 2.157305e+07 1.852950e+07 3.149106e+07 2.469253e+07 3.038888e+07 4.289269e+07 3.068578e+07 2.666211e+07 1.920137e+07 3.498466e+07 3.738612e+07 2.472398e+07 9.091266e+06 3.506023e+07 1.972646e+07 1.179671e+07 3.627198e+07 2.615940e+07 2.070046e+07 9.992195e+06 3.952554e+07 1.947969e+07 4.651618e+07 2.282352e+07 3.548525e+07 3.186676e+07 4.110901e+07 3.091583e+07 4.813303e+07 3.559569e+07 5.022378e+07 1.862215e+07 4.004562e+07 1.395689e+07 1.863326e+07 2.226548e+07 2.983385e+07 4.337421e+07 N-Benzylformamide_7.468 2.169611e+08 9.795856e+07 9.736176e+07 1.009187e+08 1.047980e+06 8.732254e+07 9.659197e+07 9.203990e+07 902671.86 1.198471e+08 5.774554e+07 1.141982e+08 616404.86 9.858692e+07 1.000938e+08 9.896532e+07 5.387950e+05 9.281369e+07 9.443107e+07 9.296177e+07 4.054363e+05 9.366268e+07 9.957738e+07 1.092548e+08 194013.795 9.296027e+07 9.143194e+07 9.143404e+07 1.740829e+05 9.976954e+07 9.257529e+07 1.012217e+08 536453.58 9.518875e+07 1.004045e+08 9.028713e+07 4.482140e+05 9.512820e+07 9.873070e+07 9.922389e+07 5.753350e+05 8.903306e+07 1.004161e+08 1.078053e+08 5.440684e+05 9.078220e+07 8.789591e+07 1.000906e+08 9.551501e+07 6.325062e+07 1.191865e+08 1.303354e+08 1.265392e+08 1.020929e+08 1.346595e+08 1.737534e+08 1.312398e+08 1.464053e+08 1.419032e+08 1.239744e+08 1.478122e+08 1.666068e+08 3.074271e+07 1.188484e+08 1.289053e+08 1.032405e+08 6.193806e+07 9.976499e+07 1.174590e+08 9.328152e+07 1.592051e+08 1.736773e+08 1.137313e+08 5.860842e+07 1.505774e+08 7.442580e+07 1.329948e+08 8.428266e+07 5.948536e+07 5.548514e+07 8.148874e+07 1.254649e+08 6.451835e+07 1.203417e+08 5.462781e+07 6.339194e+07 8.230883e+07 5.076738e+07 1.153557e+08 1.054882e+08 1.106550e+08 9.989302e+07 7.864719e+07 7.912810e+07 5.477115e+07 9.937629e+07 1.077781e+08 1.108420e+08 9.556116e+07 7.780569e+07 6.907652e+07 7.523810e+07 9.726972e+07 1.098058e+08 1.046159e+08 9.570364e+07 1.109385e+08 9.712136e+07 8.339753e+07 1.156434e+08 8.785422e+07 5.678643e+07 1.171391e+08 1.082059e+08 4.467454e+07 1.183643e+08 9.514239e+07 7.650080e+07 3.509543e+07 1.027790e+08 5.527023e+07 1.457166e+08 4.632166e+07 1.066773e+08 1.225249e+08 7.708308e+07 1.158397e+08 8.664201e+07 7.256019e+07 1.207797e+08 1.025595e+08 1.188822e+08 5.360691e+07 1.141288e+08 1.212304e+08 5.292390e+07 9.702686e+07 8.415391e+07 9.358562e+07 6.473023e+07 8.197085e+07 1.014226e+08 1.451740e+08 1.203929e+08 2.046145e+08 8.573249e+07 1.064855e+08 1.028924e+08 9.651045e+07 6.419719e+07 8.814634e+07 9.271182e+07 1.325827e+08 7.709781e+07 6.104443e+07 1.805274e+08 1.128662e+08 1.620569e+08 1.088400e+08 6.128575e+07 1.344920e+08 6.074036e+07 9.524594e+07 1.158941e+08 4.250253e+07 6.361802e+07 1.054350e+08 1.333873e+08 7.313978e+07 1.376371e+08 4.446675e+07 7.959147e+07 1.126438e+08 1.079565e+08 9.906258e+07 6.888521e+07 1.412270e+08 8.341925e+07 1.207737e+08 9.156988e+07 4.896884e+07 1.039670e+08 8.124167e+07 3.284949e+07 8.798325e+07 6.905270e+07 6.952517e+07 1.108490e+08 1.002791e+08 1.155504e+08 7.714977e+07 6.921334e+07 7.824577e+07 1.186370e+08 4.857433e+07 8.041714e+07 1.355730e+08 9.412388e+07 1.147624e+08 9.028872e+07 2.291670e+08 9.038074e+07 9.726082e+07 1.438227e+08 3.881053e+07 4.837264e+07 1.001349e+08 3.522128e+07 9.991951e+07 7.679041e+07 1.046566e+08 7.824961e+07 1.054897e+08 1.146721e+08 1.026640e+08 1.495973e+08 7.720003e+07 8.441080e+07 1.044349e+08 9.823289e+07 8.404063e+07 6.906171e+07 9.904678e+07 6.278719e+07 8.248241e+07 5.968288e+07 1.167518e+08 9.266393e+07 1.113000e+08 1.645534e+08 1.199881e+08 1.069148e+08 7.843516e+07 1.126220e+08 1.418124e+08 9.211521e+07 1.950774e+08 1.321417e+08 7.262318e+07 6.584108e+07 1.423124e+08 8.386359e+07 7.889915e+07 1.083316e+08 1.235905e+08 8.401116e+07 1.532702e+08 8.779843e+07 1.299002e+08 1.046049e+08 1.264834e+08 1.199778e+08 1.435175e+08 1.251884e+08 1.869307e+08 7.701002e+07 1.317754e+08 5.200479e+07 6.755584e+07 8.079631e+07 1.139916e+08 1.478355e+08 2-Hydroxycinnamic acid_7.468 2.216266e+09 1.017227e+09 1.013589e+09 1.015454e+09 8.034062e+05 9.124420e+08 9.295093e+08 9.282664e+08 721452.62 1.224031e+09 6.429939e+08 1.198544e+09 574552.67 9.486877e+08 1.086671e+09 9.806243e+08 5.171524e+05 9.532278e+08 9.626156e+08 9.682419e+08 4.005399e+05 9.173157e+08 1.020569e+09 1.135395e+09 109399.645 9.377874e+08 9.725070e+08 9.360951e+08 1.145007e+05 9.738435e+08 9.708209e+08 1.055106e+09 542106.58 9.869185e+08 9.583885e+08 9.598115e+08 4.503032e+05 9.436837e+08 1.005410e+09 1.105186e+09 5.739137e+05 9.075355e+08 1.006807e+09 1.066185e+09 5.543029e+05 9.074551e+08 9.164724e+08 1.035969e+09 9.858054e+08 7.143061e+08 1.204019e+09 1.362417e+09 1.450038e+09 1.053835e+09 1.348496e+09 1.761834e+09 1.318578e+09 1.490650e+09 1.446479e+09 1.236913e+09 1.486506e+09 1.741657e+09 9.802687e+08 1.234561e+09 1.304125e+09 1.005991e+09 1.428827e+09 1.019738e+09 1.212230e+09 9.636632e+08 1.632831e+09 1.738523e+09 1.156115e+09 6.638969e+08 1.582795e+09 8.185810e+08 1.319941e+09 8.841250e+08 6.580126e+08 6.021299e+08 8.504859e+08 1.377073e+09 6.802147e+08 1.235310e+09 5.695249e+08 7.663713e+08 8.549343e+08 5.887806e+08 1.183104e+09 1.078086e+09 9.913080e+08 8.923376e+08 7.115933e+08 1.158049e+09 6.198478e+08 1.003369e+09 1.145494e+09 9.935800e+08 9.642775e+08 8.361652e+08 8.650098e+08 8.962095e+08 1.071689e+09 1.113671e+09 1.063316e+09 1.055992e+09 1.155332e+09 1.041315e+09 8.422379e+08 1.204524e+09 9.148750e+08 5.998620e+08 1.212442e+09 1.082398e+09 6.116022e+08 1.256282e+09 9.774434e+08 7.747340e+08 4.181133e+08 1.083453e+09 5.893880e+08 1.410698e+09 5.072903e+08 1.107535e+09 1.225154e+09 7.957695e+08 1.155192e+09 8.586952e+08 7.473953e+08 9.656057e+08 1.046575e+09 1.210898e+09 5.573300e+08 1.163631e+09 1.235398e+09 5.292646e+08 1.018736e+09 8.727005e+08 9.848880e+08 6.706464e+08 8.326196e+08 1.059482e+09 9.233100e+08 1.238325e+09 1.778740e+09 7.555832e+08 1.061894e+09 1.065964e+09 9.729023e+08 6.601339e+08 8.568396e+08 9.473295e+08 1.480774e+09 9.077079e+08 6.512859e+08 1.809063e+09 1.285212e+09 1.626868e+09 1.100219e+09 5.179233e+08 1.368963e+09 6.301311e+08 9.424973e+08 1.169287e+09 4.825100e+08 6.135901e+08 1.057762e+09 1.420511e+09 7.961652e+08 1.362665e+09 4.399569e+08 8.190030e+08 1.164150e+09 1.073753e+09 1.024581e+09 7.153400e+08 1.406465e+09 8.491932e+08 1.229899e+09 9.133043e+08 4.939189e+08 1.173241e+09 8.318297e+08 9.699589e+08 9.090240e+08 7.276356e+08 9.116182e+08 1.108528e+09 1.034544e+09 1.195741e+09 7.930740e+08 7.214562e+08 7.482400e+08 1.227114e+09 5.018857e+08 8.725525e+08 1.275355e+09 9.994253e+08 1.203083e+09 9.223554e+08 2.242486e+09 9.707012e+08 9.938335e+08 1.363685e+09 9.428884e+08 6.061483e+08 1.016971e+09 3.801101e+08 1.098746e+09 7.978325e+08 1.082068e+09 8.030332e+08 1.090168e+09 1.178682e+09 1.111886e+09 1.476415e+09 7.933897e+08 8.759069e+08 1.050207e+09 9.845408e+08 8.761806e+08 7.404300e+08 9.811991e+08 7.369362e+08 8.512810e+08 6.274376e+08 1.169054e+09 9.398277e+08 1.118495e+09 1.552834e+09 1.218942e+09 1.068396e+09 8.597682e+08 1.126172e+09 1.474580e+09 8.312250e+08 1.883266e+09 1.367458e+09 7.715926e+08 6.126982e+08 1.438238e+09 8.200605e+08 7.999056e+08 1.029253e+09 1.215387e+09 7.722744e+08 1.542224e+09 8.901252e+08 1.309516e+09 8.604562e+08 1.233889e+09 1.246328e+09 1.436352e+09 1.258904e+09 1.800558e+09 8.178854e+08 1.327620e+09 6.295863e+08 6.908031e+08 7.922044e+08 1.152706e+09 1.494039e+09 phenylpropiolic acid_7.469 2.868408e+07 1.184989e+07 1.226733e+07 1.160756e+07 2.767810e+05 9.851392e+06 1.264517e+07 1.090584e+07 245558.82 1.408225e+07 6.887085e+06 1.430580e+07 196903.09 1.158731e+07 1.214080e+07 1.131049e+07 1.714752e+05 1.133066e+07 1.143849e+07 1.162493e+07 1.290561e+05 1.114856e+07 1.204984e+07 1.315504e+07 32540.646 1.100554e+07 1.099693e+07 1.093427e+07 3.436172e+04 1.136946e+07 1.237684e+07 1.184083e+07 171884.88 1.163328e+07 1.177208e+07 1.081371e+07 1.433856e+05 1.095641e+07 1.186237e+07 1.299761e+07 1.808312e+05 1.097251e+07 1.146065e+07 1.244864e+07 1.724280e+05 1.119066e+07 1.056259e+07 1.220571e+07 1.318382e+07 9.710784e+06 1.437000e+07 1.734148e+07 1.529767e+07 1.317474e+07 1.679017e+07 2.107340e+07 1.659602e+07 1.703237e+07 1.944023e+07 1.554987e+07 1.842131e+07 1.878512e+07 9.761784e+06 1.489110e+07 1.627828e+07 1.165409e+07 1.036302e+07 1.158715e+07 1.473687e+07 1.164870e+07 1.973335e+07 2.259753e+07 1.371670e+07 7.486217e+06 1.788261e+07 9.728927e+06 1.681255e+07 1.036066e+07 5.896765e+06 6.186720e+06 7.918446e+06 1.566399e+07 7.621452e+06 1.594104e+07 6.184144e+06 7.298264e+06 1.029359e+07 6.122658e+06 1.464293e+07 1.331901e+07 1.437456e+07 1.118735e+07 8.954386e+06 8.989383e+06 5.757375e+06 1.175618e+07 1.405924e+07 1.524044e+07 1.188812e+07 9.584580e+06 7.399868e+06 8.917647e+06 1.174782e+07 1.332154e+07 1.290932e+07 1.129772e+07 1.354491e+07 1.184746e+07 1.015173e+07 1.284035e+07 1.071947e+07 6.736725e+06 1.446133e+07 1.328766e+07 7.859460e+06 1.456433e+07 1.164157e+07 8.999863e+06 3.766467e+06 1.218230e+07 6.452268e+06 1.743290e+07 6.475911e+06 1.337461e+07 1.416863e+07 9.368227e+06 1.384298e+07 9.124557e+06 7.748332e+06 1.620186e+07 1.265525e+07 1.513160e+07 6.032799e+06 1.339494e+07 1.451194e+07 5.611850e+06 9.450296e+06 1.027121e+07 1.141814e+07 7.419075e+06 9.415916e+06 1.288221e+07 1.080670e+07 1.531330e+07 2.556605e+07 1.040049e+07 1.317776e+07 1.288656e+07 8.234440e+06 7.534910e+06 9.730310e+06 9.035443e+06 1.634146e+07 9.568428e+06 7.458401e+06 2.374932e+07 1.385074e+07 2.026069e+07 1.404210e+07 7.341854e+06 1.622523e+07 6.445395e+06 1.119517e+07 1.321889e+07 4.624039e+06 7.397106e+06 1.435267e+07 1.673165e+07 8.483549e+06 1.888601e+07 5.170321e+06 9.512079e+06 1.231922e+07 1.343769e+07 1.143972e+07 6.294391e+06 1.729767e+07 9.967627e+06 1.405509e+07 1.132207e+07 5.335336e+06 1.429443e+07 9.992906e+06 8.265804e+06 1.081243e+07 8.424341e+06 7.905424e+06 1.294052e+07 1.226049e+07 1.407291e+07 1.030325e+07 6.024977e+06 8.939097e+06 1.345332e+07 5.608346e+06 9.633964e+06 1.614516e+07 1.152646e+07 1.387905e+07 1.109327e+07 2.816339e+07 1.138051e+07 1.234136e+07 1.629315e+07 9.041041e+06 6.027036e+06 1.164788e+07 4.171832e+06 1.244974e+07 7.883284e+06 1.313034e+07 8.802890e+06 1.135025e+07 1.468637e+07 1.293973e+07 1.803698e+07 1.086251e+07 1.040704e+07 1.262233e+07 1.239389e+07 7.422598e+06 8.677871e+06 1.276894e+07 7.481783e+06 1.024438e+07 7.002647e+06 1.447294e+07 1.111478e+07 1.399872e+07 2.003333e+07 1.469524e+07 1.266385e+07 9.615371e+06 1.362430e+07 1.809936e+07 1.137945e+07 2.352782e+07 1.690650e+07 7.513987e+06 5.759689e+06 1.771687e+07 9.966641e+06 9.983472e+06 1.295913e+07 1.530851e+07 8.857504e+06 1.867701e+07 1.029460e+07 1.493203e+07 1.058821e+07 1.501017e+07 1.531654e+07 1.764686e+07 1.544163e+07 2.244732e+07 9.722151e+06 1.608097e+07 6.475555e+06 7.967588e+06 9.198724e+06 1.380044e+07 1.812312e+07 C8 H8 O_7.47 3.875225e+06 1.650495e+06 1.575745e+06 1.561594e+06 3.381057e+05 1.404550e+06 1.800061e+06 1.245714e+06 382136.49 2.005042e+06 1.202590e+06 1.931492e+06 351359.81 1.652209e+06 1.557949e+06 1.622820e+06 2.179725e+05 1.549459e+06 1.506354e+06 1.713053e+06 1.350009e+05 1.310122e+06 1.562007e+06 2.189894e+06 123758.285 1.302193e+06 1.575959e+06 1.498150e+06 3.456946e+04 1.606772e+06 1.587634e+06 1.664102e+06 178061.35 1.505093e+06 1.666298e+06 1.517053e+06 1.496738e+05 1.559223e+06 1.554047e+06 1.846455e+06 1.936616e+05 1.432257e+06 1.544440e+06 1.821497e+06 1.906138e+05 1.500977e+06 1.517043e+06 1.595676e+06 1.722168e+06 1.095526e+06 2.024456e+06 2.373596e+06 2.047842e+06 1.776986e+06 2.208450e+06 2.882393e+06 2.255340e+06 2.533790e+06 2.341600e+06 2.142697e+06 2.458412e+06 2.780467e+06 1.678613e+06 1.831958e+06 2.197386e+06 1.662243e+06 1.397941e+06 1.574613e+06 2.484935e+06 1.457198e+06 2.658342e+06 3.115627e+06 2.270480e+06 9.909078e+05 2.529055e+06 1.248732e+06 2.524514e+06 1.360551e+06 1.100922e+06 8.682167e+05 1.262185e+06 2.057404e+06 1.129808e+06 2.051676e+06 8.368105e+05 1.074771e+06 1.375924e+06 7.280362e+05 1.926036e+06 1.844882e+06 1.927490e+06 1.461278e+06 1.130529e+06 1.742542e+06 1.073863e+06 1.806455e+06 1.779336e+06 1.869638e+06 1.392679e+06 1.251143e+06 1.199099e+06 1.240592e+06 1.720401e+06 1.833746e+06 1.765165e+06 1.530760e+06 1.792563e+06 1.522292e+06 1.463148e+06 1.849876e+06 1.434852e+06 8.516065e+05 1.772256e+06 1.750598e+06 9.048750e+05 1.800528e+06 1.630431e+06 1.361720e+06 5.649032e+05 1.667695e+06 9.424282e+05 2.406237e+06 1.039821e+06 1.756704e+06 2.093257e+06 1.466378e+06 1.726651e+06 1.528504e+06 8.825592e+05 1.303511e+06 1.844366e+06 1.988862e+06 9.983935e+05 1.925361e+06 2.174418e+06 8.746390e+05 1.796772e+06 1.377507e+06 1.374642e+06 8.313477e+05 1.392232e+06 1.642004e+06 1.706588e+06 2.113672e+06 3.394308e+06 1.445756e+06 1.773065e+06 1.760414e+06 1.198162e+06 1.195931e+06 1.330736e+06 1.565451e+06 2.089515e+06 1.388023e+06 9.631008e+05 2.649130e+06 1.883816e+06 2.282577e+06 1.685848e+06 8.385422e+05 2.381226e+06 9.282261e+05 1.684612e+06 1.962293e+06 7.299632e+05 8.982711e+05 1.747945e+06 2.421526e+06 1.080838e+06 2.060142e+06 6.958415e+05 1.322946e+06 1.732997e+06 1.678370e+06 2.045634e+06 9.335315e+05 2.484244e+06 1.343177e+06 1.857583e+06 1.621614e+06 7.731585e+05 1.805993e+06 1.513419e+06 1.493304e+06 1.332481e+06 1.294762e+06 1.010103e+06 1.925327e+06 1.506771e+06 1.916992e+06 1.321205e+06 8.956669e+05 1.460804e+06 1.955225e+06 8.631249e+05 1.258538e+06 2.693254e+06 1.451992e+06 2.037160e+06 1.502028e+06 3.288682e+06 1.529619e+06 1.629768e+06 2.378464e+06 1.687788e+06 9.453379e+05 1.547646e+06 4.382458e+05 1.616481e+06 1.211678e+06 1.688700e+06 1.309811e+06 1.717927e+06 1.861518e+06 1.874801e+06 2.611883e+06 1.330862e+06 1.467491e+06 1.623714e+06 1.665110e+06 1.211204e+06 1.145325e+06 1.305439e+06 1.198804e+06 1.342479e+06 8.177834e+05 2.003245e+06 1.697893e+06 2.093295e+06 2.876747e+06 2.025022e+06 1.656533e+06 1.096780e+06 2.010834e+06 2.590535e+06 1.600921e+06 3.922477e+06 2.390456e+06 1.116743e+06 8.173495e+05 2.469894e+06 1.331045e+06 1.291231e+06 1.559338e+06 1.905655e+06 1.089525e+06 2.562032e+06 1.418349e+06 2.113889e+06 1.236119e+06 1.970382e+06 1.941380e+06 3.524712e+06 2.019238e+06 3.450123e+06 1.196560e+06 2.121996e+06 8.990753e+05 1.559605e+06 1.174189e+06 1.818897e+06 2.376739e+06 TYROSINE 1.903164e+09 8.863977e+08 9.020358e+08 8.801066e+08 2.796785e+05 7.905560e+08 9.081476e+08 8.089687e+08 252057.07 1.067365e+09 5.681658e+08 1.062798e+09 205390.52 8.348612e+08 9.640546e+08 8.709133e+08 1.844290e+05 8.447554e+08 8.526286e+08 8.584715e+08 1.433412e+05 8.136568e+08 9.051187e+08 1.006004e+09 79582.058 8.259198e+08 8.650747e+08 8.299442e+08 6.442857e+04 8.660414e+08 8.599875e+08 9.364252e+08 205560.47 8.727966e+08 8.464260e+08 8.518600e+08 1.610077e+05 8.345958e+08 8.917617e+08 9.876649e+08 2.052149e+05 8.022676e+08 8.909615e+08 9.424944e+08 1.988875e+05 8.030347e+08 8.111614e+08 9.204828e+08 8.730911e+08 6.375841e+08 1.067148e+09 1.209208e+09 1.302279e+09 9.324761e+08 1.191372e+09 1.563574e+09 1.166688e+09 1.323270e+09 1.263543e+09 1.090834e+09 1.316976e+09 1.550085e+09 6.219422e+08 1.092461e+09 1.149734e+09 8.842831e+08 1.327994e+09 9.075183e+08 1.074052e+09 8.531385e+08 1.414638e+09 1.534215e+09 1.025114e+09 5.910566e+08 1.409174e+09 7.224237e+08 1.167570e+09 7.842168e+08 5.881083e+08 5.326494e+08 7.505760e+08 1.230535e+09 6.034455e+08 1.092642e+09 5.058342e+08 6.849205e+08 7.578923e+08 5.242433e+08 1.051782e+09 9.561419e+08 8.586057e+08 7.731717e+08 6.238906e+08 5.720139e+08 5.491270e+08 8.891914e+08 1.009849e+09 8.537973e+08 8.542034e+08 7.413800e+08 7.838834e+08 8.048025e+08 9.530926e+08 9.859138e+08 9.407052e+08 9.451469e+08 1.021260e+09 9.252662e+08 7.425918e+08 1.066743e+09 8.091919e+08 5.330094e+08 1.073658e+09 9.541694e+08 5.521694e+08 1.089744e+09 8.684695e+08 6.832867e+08 3.743375e+08 9.618379e+08 5.226283e+08 1.241128e+09 4.512427e+08 9.793970e+08 1.087025e+09 7.041713e+08 9.977275e+08 7.684211e+08 6.620800e+08 8.297011e+08 9.267711e+08 1.068664e+09 4.948745e+08 1.029681e+09 1.095931e+09 4.692769e+08 9.058898e+08 7.755979e+08 8.759920e+08 5.974886e+08 7.365694e+08 9.366082e+08 7.793697e+08 1.098297e+09 1.501107e+09 6.536178e+08 9.383899e+08 9.427430e+08 8.547825e+08 5.838320e+08 7.551040e+08 8.383828e+08 1.325725e+09 8.100054e+08 5.792944e+08 1.559960e+09 1.151574e+09 1.407542e+09 9.729995e+08 4.460362e+08 1.210268e+09 5.613031e+08 8.325632e+08 1.039181e+09 4.324893e+08 3.537522e+08 9.330642e+08 1.264020e+09 7.091551e+08 1.200221e+09 3.838900e+08 7.285724e+08 1.039705e+09 9.451913e+08 9.088264e+08 6.319557e+08 1.242067e+09 7.503870e+08 1.095176e+09 8.116026e+08 4.376943e+08 1.047166e+09 7.381544e+08 8.532295e+08 8.075724e+08 6.473292e+08 1.523465e+08 9.822016e+08 8.997783e+08 1.059532e+09 7.015313e+08 6.355590e+08 6.614509e+08 1.087422e+09 4.390886e+08 7.677355e+08 1.105836e+09 8.880129e+08 1.067798e+09 8.183150e+08 1.969758e+09 8.638800e+08 8.780708e+08 1.195560e+09 8.161018e+08 5.385297e+08 9.025872e+08 3.326194e+08 9.823067e+08 6.913963e+08 9.579464e+08 7.165519e+08 9.700051e+08 1.042729e+09 9.869568e+08 1.309917e+09 7.023329e+08 7.761189e+08 9.299144e+08 8.741311e+08 5.453242e+08 6.572264e+08 8.667396e+08 6.618656e+08 7.554903e+08 5.516660e+08 1.033839e+09 8.330232e+08 9.916006e+08 1.340822e+09 1.081665e+09 9.383327e+08 7.623576e+08 9.962758e+08 1.305219e+09 7.207062e+08 1.628727e+09 1.210678e+09 6.726612e+08 5.370363e+08 1.276607e+09 7.084785e+08 7.087067e+08 8.888807e+08 1.071915e+09 6.858807e+08 1.366041e+09 7.881807e+08 1.164886e+09 7.569461e+08 1.085912e+09 1.103700e+09 1.255233e+09 1.091899e+09 1.549631e+09 7.257216e+08 1.147781e+09 5.631764e+08 6.169898e+08 7.015407e+08 1.019104e+09 1.317799e+09 C6 H4 Cl N7 P2_7.482 1.154334e+07 7.930123e+06 6.203648e+06 7.484178e+06 4.082953e+05 7.265989e+06 7.063370e+06 6.279091e+06 387192.26 8.856287e+06 6.980567e+06 7.291787e+06 347733.92 7.565419e+06 7.368206e+06 7.620999e+06 3.463321e+05 7.014063e+06 7.094238e+06 7.161661e+06 2.909609e+05 6.993680e+06 7.250876e+06 7.474672e+06 75741.607 7.822719e+06 6.956393e+06 6.802276e+06 1.053620e+05 8.072265e+06 7.033258e+06 7.170264e+06 425262.51 6.745806e+06 7.298687e+06 6.507278e+06 3.492652e+05 9.031594e+06 7.376042e+06 7.005739e+06 4.192387e+05 6.508929e+06 7.698609e+06 6.873865e+06 3.977605e+05 7.956022e+06 7.024493e+06 7.308825e+06 6.403271e+06 4.486111e+06 6.119668e+06 6.742164e+06 8.959276e+06 6.678546e+06 7.618869e+06 9.489177e+06 5.796931e+06 6.690443e+06 7.533979e+06 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2.942196e+06 2.666874e+06 3.934587e+04 3.241832e+06 2.721529e+06 2.700513e+06 201867.91 2.776473e+06 2.916340e+06 2.463686e+06 1.499508e+05 4.060296e+06 2.609122e+06 2.736049e+06 2.076415e+05 2.609940e+06 3.116399e+06 2.623112e+06 2.028554e+05 3.184843e+06 2.813287e+06 2.913023e+06 2.591272e+06 1.858790e+06 2.602270e+06 2.525927e+06 2.488824e+06 3.452436e+06 2.039414e+06 3.041819e+06 2.290115e+06 3.290838e+06 3.491190e+06 2.021498e+06 2.922690e+06 3.642565e+06 2.111971e+06 2.009500e+06 1.795282e+06 3.149397e+06 2.357050e+06 1.993466e+06 3.368891e+06 2.555221e+06 3.592637e+06 2.813296e+06 2.323376e+06 2.008204e+06 3.681863e+06 3.220157e+06 3.141155e+06 2.374682e+06 3.362142e+06 2.649210e+06 3.406488e+06 5.419652e+06 2.181433e+06 3.444822e+06 2.238393e+06 2.422013e+06 3.744037e+06 3.439338e+06 3.440024e+06 3.207523e+06 3.143145e+06 3.334218e+06 1.414097e+06 4.644229e+06 1.749765e+06 2.516211e+06 2.862277e+06 3.252811e+06 2.496810e+06 2.123722e+06 3.710100e+06 3.329326e+06 3.363979e+06 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1.282536e+06 2.152970e+06 2.218609e+06 3.280082e+06 2.829219e+06 1.162986e+06 1.716044e+06 4.109791e+06 3.004992e+06 2.822220e+06 1.912158e+06 2.754102e+06 2.493526e+05 2.462082e+06 1.733202e+06 3.814360e+06 3.348562e+06 2.503061e+06 3.611721e+06 2.215218e+06 4.635995e+06 2.567889e+06 2.679706e+06 3.741797e+06 2.681125e+06 2.130231e+06 2.415758e+06 1.492232e+06 2.909424e+06 2.202375e+06 2.481888e+06 2.717767e+06 3.532982e+06 3.346103e+06 2.236080e+06 3.819907e+06 2.112086e+06 2.051274e+06 3.709149e+06 2.753610e+06 2.129068e+06 3.994286e+06 3.646981e+06 2.065566e+06 2.547862e+06 2.001698e+06 2.067784e+06 2.334840e+06 3.505537e+06 2.952673e+06 2.521499e+06 2.963280e+06 3.856907e+06 3.374582e+06 3.997340e+06 1.912031e+06 3.875331e+06 3.682489e+06 1.692338e+06 2.032633e+06 3.202858e+06 1.715292e+06 1.818518e+06 3.111969e+06 2.782131e+06 2.419366e+06 3.130899e+06 1.895656e+06 3.488812e+06 2.854412e+06 2.859742e+06 2.318265e+06 4.871345e+06 2.926933e+06 3.651996e+06 1.979596e+06 3.176055e+06 3.130344e+06 1.929164e+06 1.931014e+06 3.698548e+06 3.038221e+06 Stachydrine_7.485 8.478949e+08 9.049057e+08 9.117884e+08 9.224324e+08 5.295771e+05 8.316187e+08 1.108154e+09 3.111382e+08 546630.18 1.118403e+09 8.633019e+08 1.050378e+09 459952.26 9.615290e+08 8.779423e+08 8.891089e+08 4.709686e+05 8.504509e+08 8.745244e+08 9.111269e+08 3.686513e+05 8.590341e+08 1.055055e+09 1.275524e+09 99123.765 2.026818e+08 9.854822e+08 9.188057e+08 1.494485e+05 9.184599e+08 9.101077e+08 9.514627e+08 499520.71 8.818996e+08 8.643123e+08 8.727282e+08 3.916648e+05 8.776998e+08 9.119777e+08 9.195963e+08 4.842816e+05 8.481647e+08 9.146028e+08 9.705195e+08 4.628636e+05 8.468692e+08 8.169201e+08 9.404301e+08 1.970129e+08 1.164098e+08 2.345590e+07 7.559015e+07 6.374792e+08 2.627717e+08 1.361302e+08 1.947843e+08 5.587686e+08 3.769386e+08 1.569893e+09 6.615988e+08 1.289754e+07 1.521895e+07 1.250152e+08 9.326516e+08 1.550725e+08 3.309157e+07 2.067567e+08 6.411134e+08 4.509592e+08 5.660939e+08 1.144129e+09 3.987323e+08 6.344700e+08 1.120739e+09 2.706848e+08 1.039909e+09 2.420679e+08 2.706626e+08 3.710320e+09 2.342364e+09 2.276818e+09 1.862199e+08 1.327751e+09 7.084894e+07 1.653965e+09 1.989417e+09 2.912662e+07 8.268533e+08 2.010699e+08 7.765541e+07 4.226151e+07 8.471183e+08 5.567585e+07 5.723186e+07 5.903715e+08 1.227052e+08 6.169323e+08 6.894383e+07 7.416132e+07 1.185080e+08 5.879214e+08 1.991983e+09 1.887197e+08 3.357972e+07 2.680903e+07 3.498182e+07 7.079978e+08 2.199407e+09 4.725591e+07 1.726101e+08 9.117116e+07 6.167766e+08 1.514366e+08 4.344859e+07 1.381011e+07 1.213213e+07 6.633677e+07 5.734418e+07 4.947833e+09 8.214830e+08 1.606910e+09 2.311102e+07 3.092649e+07 1.781489e+08 1.237450e+08 9.761843e+08 2.825749e+08 1.325496e+08 3.303570e+09 3.280001e+08 3.537533e+07 1.214390e+08 1.011198e+09 5.815697e+07 1.220383e+08 3.083575e+08 5.019235e+07 4.601405e+08 1.254523e+09 2.750798e+09 4.940152e+07 8.475709e+08 8.256549e+08 3.583358e+08 2.988486e+08 7.334359e+06 4.685567e+07 2.834787e+07 4.095636e+07 8.154728e+07 3.201898e+07 3.211877e+08 3.492411e+08 1.685984e+09 2.581124e+09 5.454730e+07 4.836511e+07 4.870598e+08 1.141619e+08 3.351476e+08 2.674291e+07 3.027435e+09 2.324739e+08 1.540046e+08 2.745804e+09 7.371682e+08 1.263470e+08 1.121862e+08 1.512703e+09 6.468811e+07 4.519813e+08 2.281013e+09 3.870803e+08 1.483633e+08 1.386133e+08 1.651955e+08 5.818433e+07 2.802621e+08 6.356115e+08 4.081978e+08 1.289436e+08 5.343886e+07 4.144465e+08 6.879634e+07 1.025978e+08 3.273979e+07 1.852602e+09 2.687123e+08 6.142215e+07 6.827637e+08 1.567843e+08 1.247491e+09 1.198451e+08 1.042042e+08 1.424736e+08 6.763766e+06 2.657935e+07 1.417909e+09 8.328773e+08 7.168954e+08 9.951220e+07 1.013676e+09 3.185178e+07 1.369493e+08 2.103065e+08 2.391882e+07 4.952249e+08 2.697815e+09 3.150620e+07 3.143708e+07 2.764723e+08 1.770210e+09 5.817373e+08 2.835268e+08 2.581580e+08 3.254204e+07 2.650208e+08 1.538304e+08 6.628858e+07 3.638373e+07 4.324577e+07 3.548011e+09 4.101612e+08 8.134584e+07 1.098927e+08 1.145499e+07 8.371639e+07 4.123041e+07 2.914059e+08 1.644841e+07 3.484620e+07 3.218118e+08 2.995673e+09 7.372343e+07 1.065903e+07 6.066079e+06 5.742314e+08 7.999239e+08 1.152522e+08 3.773170e+09 3.818167e+08 6.284268e+07 1.338100e+07 2.684918e+09 4.264417e+07 4.429437e+08 1.925741e+07 5.003660e+08 4.210189e+08 1.213020e+09 1.865022e+07 6.274703e+08 1.140273e+09 5.784880e+08 1.707774e+08 1.559348e+08 4.081991e+08 2.634928e+09 8.873389e+07 5.225925e+08 4.824451e+08 5.004060e+08 N-Acetylleucylleucine_7.492 1.787346e+06 5.150084e+06 8.455815e+06 5.290293e+06 1.766163e+05 1.829286e+06 8.952750e+06 4.185385e+06 193827.42 5.489070e+06 5.102668e+06 7.163861e+06 184921.15 4.071196e+06 5.900404e+06 6.115661e+06 1.652631e+05 5.626506e+06 4.810296e+06 5.648988e+06 1.175610e+05 4.731306e+06 6.115837e+06 8.857118e+06 29674.626 3.959544e+06 5.285128e+06 4.983185e+06 3.693507e+04 5.264911e+06 4.833118e+06 6.966619e+06 216951.08 5.624873e+06 4.853049e+06 5.275281e+06 1.635326e+05 5.245456e+06 6.443233e+06 6.622729e+06 1.954973e+05 4.902704e+06 5.383070e+06 7.746758e+06 2.277713e+05 3.942592e+06 4.227739e+06 6.508493e+06 1.683065e+05 8.000758e+04 1.622312e+05 1.374906e+05 2.144636e+06 2.157572e+05 1.280262e+05 2.223311e+05 7.651290e+05 3.863520e+05 2.569973e+07 1.521324e+06 1.475095e+05 1.802080e+05 1.690217e+05 3.863623e+06 1.403363e+05 1.438567e+05 1.907758e+05 1.559457e+06 9.186189e+05 8.372980e+05 4.789737e+06 4.758438e+05 1.788164e+06 8.176480e+06 2.587416e+05 8.674699e+06 1.366448e+05 1.007310e+05 5.398283e+08 2.142693e+08 1.062203e+08 1.136362e+05 2.321959e+07 1.099380e+05 4.458952e+07 1.168296e+08 1.345638e+05 4.229138e+07 1.425981e+05 9.457934e+04 1.250214e+05 1.213430e+07 1.049531e+05 1.072360e+05 2.470885e+06 1.109464e+05 2.095790e+06 1.262471e+05 9.577858e+04 3.903421e+05 5.200812e+06 1.045207e+08 9.742209e+04 1.262961e+05 1.304666e+05 1.174637e+05 1.791499e+06 1.048997e+08 9.731672e+04 1.242685e+05 1.162314e+05 1.095749e+06 1.305975e+05 1.270045e+05 8.887813e+04 9.916158e+04 9.049307e+04 1.105759e+05 9.298935e+08 5.190722e+06 5.834739e+07 1.423244e+05 9.753837e+04 1.350530e+05 1.395281e+05 5.158383e+06 1.321554e+05 1.490164e+05 3.819080e+08 4.873562e+05 1.083993e+05 1.402202e+05 1.264026e+07 1.176783e+05 1.166863e+05 1.308169e+06 1.049425e+06 5.770907e+05 1.065451e+07 2.224397e+08 1.130669e+05 2.686672e+06 1.579409e+07 4.554484e+05 2.210855e+05 1.121907e+05 1.257164e+05 1.218147e+05 1.020528e+05 9.693969e+04 1.103701e+05 1.487782e+05 3.400508e+05 4.077144e+07 1.896055e+08 1.397096e+05 1.262773e+05 5.975205e+05 1.014818e+05 1.968625e+06 1.433444e+05 3.473567e+08 1.602936e+05 1.763355e+05 3.159128e+08 4.674760e+06 1.217774e+05 1.034315e+06 3.656949e+07 1.307197e+05 5.416422e+06 1.106983e+08 4.915380e+05 9.969985e+04 1.597599e+05 1.133830e+05 1.552454e+05 1.844307e+05 2.428410e+06 5.492670e+05 9.856283e+04 1.566453e+05 5.085820e+05 1.118688e+05 8.214299e+04 1.044726e+05 1.552006e+07 2.234543e+05 1.081684e+05 2.275341e+06 1.109076e+05 2.287377e+07 1.196610e+05 1.207504e+05 8.685869e+04 8.605126e+04 1.633211e+05 1.783112e+07 4.335895e+06 2.079967e+06 1.728752e+05 5.698131e+06 1.116251e+05 1.398752e+05 1.044416e+05 7.138137e+04 6.570942e+05 1.732556e+08 8.880444e+04 1.079646e+05 1.670490e+05 4.271772e+07 1.054553e+06 2.195975e+05 3.109117e+05 1.157850e+05 1.314353e+05 1.235281e+05 1.015140e+05 9.215161e+04 9.750483e+04 4.385869e+08 6.577361e+05 1.010816e+05 8.728894e+04 1.032078e+05 1.269648e+05 1.236663e+05 2.966112e+05 1.274576e+05 9.399704e+04 2.841614e+05 3.568592e+08 1.056818e+05 1.262189e+05 1.146155e+05 7.693484e+05 4.209952e+06 9.764706e+04 2.563927e+08 3.564142e+05 1.414217e+05 9.350108e+04 2.078183e+08 1.270666e+05 5.193228e+05 1.411874e+05 8.495066e+05 6.096704e+05 3.486349e+07 1.291485e+05 1.521692e+06 7.243418e+06 6.854243e+05 1.657637e+05 9.105719e+04 3.071440e+05 3.327070e+08 8.722634e+04 1.101144e+06 7.888645e+05 1.115346e+06 C12 H22 N2 O5_7.495 2.995896e+05 2.195108e+06 2.315360e+06 1.986356e+06 2.459552e+05 1.944878e+06 2.495243e+06 1.836830e+06 222666.74 2.162928e+06 1.853823e+06 2.471245e+06 164997.08 1.910670e+06 2.164676e+06 2.140616e+06 1.278361e+05 1.962445e+06 2.299826e+06 2.304049e+06 8.566339e+04 1.831082e+06 2.145861e+06 2.533757e+06 20989.310 1.832353e+06 2.114166e+06 2.010462e+06 2.148366e+04 2.109553e+06 2.335882e+06 1.763429e+06 123455.03 2.341504e+06 2.410008e+06 2.131993e+06 1.003693e+05 1.569815e+06 2.303621e+06 1.765906e+06 1.250745e+05 2.221123e+06 2.398480e+06 2.491680e+06 1.139381e+05 2.022817e+06 1.926004e+06 2.058611e+06 3.493060e+06 3.284287e+06 3.020910e+06 5.804768e+06 2.125505e+06 2.701194e+06 3.638407e+06 6.021705e+06 2.910506e+06 2.552320e+06 2.301944e+06 3.048148e+06 4.558150e+06 3.336112e+06 5.499399e+06 4.923092e+06 6.798057e+06 5.849775e+06 4.525804e+06 2.495648e+06 2.540502e+06 3.752858e+06 5.035399e+06 3.309462e+06 3.422056e+06 3.387051e+06 4.439797e+06 1.600973e+06 2.748296e+06 2.291413e+06 2.516539e+05 8.104048e+05 8.876626e+05 3.719184e+06 2.034334e+06 7.585919e+06 8.141991e+05 8.103103e+05 1.576935e+06 9.608947e+04 2.952779e+06 2.055380e+06 8.123738e+06 2.012664e+06 6.280822e+06 2.539654e+06 3.663696e+06 4.206977e+06 4.746203e+06 2.094070e+06 1.939922e+06 2.227332e+06 1.190041e+06 1.340859e+06 1.226762e+06 5.168789e+06 5.884873e+06 4.226045e+06 2.457786e+06 1.259662e+06 2.403202e+06 2.675723e+06 3.050996e+06 5.350824e+06 3.902029e+06 3.234318e+06 2.543523e+06 1.649207e+06 5.474531e+06 1.629123e+06 2.705016e+05 1.951291e+06 4.526400e+05 3.086921e+06 8.335710e+05 7.725646e+04 2.204851e+06 1.159756e+06 1.036404e+07 2.450287e+06 3.179377e+05 2.862488e+06 2.002570e+06 2.054267e+05 7.566464e+05 1.732508e+06 2.586087e+06 1.134034e+06 1.618143e+06 1.489683e+06 7.468858e+05 6.641569e+05 2.520782e+06 9.525218e+04 1.890045e+06 1.869400e+06 4.686416e+06 2.443943e+06 1.594934e+06 3.118211e+06 1.044955e+05 7.669230e+06 4.884158e+06 4.859350e+06 3.762246e+06 1.746385e+06 5.269098e+05 3.070955e+06 1.584698e+07 2.575293e+07 2.104210e+07 1.593048e+06 5.916605e+06 1.165477e+06 2.467023e+06 2.065141e+06 1.119939e+06 1.189439e+06 3.373199e+06 2.403892e+06 1.521185e+06 2.730523e+06 5.498238e+05 8.446287e+05 3.788691e+06 3.332175e+06 4.342096e+06 4.501526e+06 5.237623e+06 2.395089e+06 5.009276e+06 3.509661e+06 9.875890e+05 1.111075e+05 1.205257e+06 8.719737e+06 6.057363e+04 2.346293e+06 3.890810e+05 9.283166e+05 8.882919e+06 9.646928e+05 3.816280e+06 1.345816e+05 7.010229e+05 3.053734e+06 2.559270e+05 1.119269e+06 1.018021e+06 5.646796e+05 1.032024e+06 3.076021e+06 9.874182e+06 6.463162e+06 4.150714e+06 2.560349e+06 9.117588e+05 8.071553e+05 2.170796e+06 2.318340e+05 2.637019e+06 3.759172e+06 1.657594e+06 5.717195e+05 1.427548e+06 1.467088e+06 7.638039e+04 1.892048e+06 1.000113e+07 3.223099e+06 3.500953e+06 1.658390e+06 2.144642e+06 2.332841e+05 1.611675e+06 1.915980e+06 3.105244e+06 2.333964e+06 2.163719e+06 8.225796e+05 1.541108e+06 2.445065e+06 3.685415e+06 2.249167e+05 1.340385e+05 2.909576e+06 2.067951e+06 1.665402e+06 4.232827e+06 1.020490e+05 1.796608e+06 3.717260e+05 4.448815e+06 5.917994e+06 9.647871e+06 2.077249e+06 7.256009e+06 1.094148e+07 9.932677e+06 6.803875e+06 4.597082e+06 3.574052e+06 1.086072e+07 2.227149e+06 5.682754e+06 5.540628e+06 2.041688e+07 1.463850e+06 3.342493e+06 3.204542e+05 6.845349e+04 8.283450e+04 5.546432e+06 6.505369e+06 Allysine_7.498 4.898730e+07 6.336119e+06 8.108892e+06 8.319648e+06 1.874438e+05 6.895205e+06 5.332017e+06 6.904974e+06 181144.47 9.344757e+06 4.732898e+06 8.804299e+06 145368.72 7.274696e+06 7.216798e+06 6.954843e+06 1.284776e+05 6.952527e+06 7.766134e+06 6.699523e+06 9.980593e+04 6.859493e+06 7.208928e+06 8.670476e+06 39282.166 7.330949e+06 5.662570e+06 7.327515e+06 2.774329e+04 7.780624e+06 5.763206e+06 8.146502e+06 155111.15 7.905106e+06 5.738243e+06 7.397455e+06 1.179917e+05 7.284702e+06 7.791961e+06 7.451048e+06 1.457845e+05 7.751414e+06 6.166279e+06 5.910503e+06 1.529509e+05 8.761594e+06 6.028475e+06 8.019418e+06 9.020498e+06 7.906767e+06 3.258425e+05 2.382642e+07 6.944069e+06 1.617803e+07 6.978301e+06 7.114091e+06 1.693509e+06 1.634015e+06 2.659985e+06 6.273197e+07 1.575354e+07 1.519799e+07 2.555335e+06 1.171066e+06 1.592456e+06 6.801830e+05 7.809580e+05 2.349890e+05 1.160391e+07 1.438437e+06 5.272687e+06 4.690063e+05 2.249865e+05 1.387656e+07 2.953909e+06 3.933658e+06 9.992058e+05 2.356662e+07 1.898164e+05 1.490646e+05 1.838056e+05 1.451101e+07 1.243117e+05 9.703077e+05 7.826349e+05 5.990634e+05 4.116162e+06 6.328422e+07 3.319244e+06 6.551532e+06 1.058372e+06 1.496267e+05 4.063088e+06 6.855830e+06 6.141595e+07 2.270875e+07 4.014211e+06 5.604676e+05 3.869569e+06 1.424208e+06 1.348649e+05 1.164789e+06 8.302079e+06 6.121324e+05 1.928329e+06 1.383711e+06 5.669527e+06 2.216896e+06 5.568285e+06 3.982022e+06 4.583973e+07 4.701937e+06 1.865053e+08 1.000470e+07 5.125863e+06 4.803782e+06 4.327322e+06 1.770580e+08 2.175982e+05 2.475062e+05 2.510587e+05 2.786412e+07 1.194741e+08 2.185336e+06 1.291387e+06 1.296986e+06 1.913884e+07 1.240080e+06 1.781577e+05 4.318271e+06 4.950289e+07 1.449263e+08 2.592440e+06 1.489236e+06 2.646655e+06 4.386301e+06 1.822629e+08 1.308669e+07 1.039337e+06 2.558570e+05 7.154159e+06 2.540250e+07 3.197748e+05 3.578140e+06 1.790883e+07 1.382197e+06 1.182557e+06 3.555179e+06 3.007455e+06 1.584561e+06 4.067024e+06 3.504164e+07 2.684056e+06 6.220924e+06 1.371007e+05 1.259740e+06 5.744004e+06 8.130574e+05 3.761845e+06 4.877174e+05 2.391922e+05 1.741738e+05 2.077045e+07 2.067985e+06 3.939130e+05 1.387636e+06 1.110564e+06 1.391703e+06 2.051047e+06 1.141721e+06 1.025843e+06 4.274015e+05 5.558344e+05 3.080863e+07 5.472700e+06 1.661113e+07 3.374807e+06 3.347235e+06 1.479854e+06 1.061385e+07 2.189297e+06 2.196988e+06 5.383554e+05 2.615248e+06 9.916592e+05 1.673428e+07 2.275471e+05 1.371429e+06 5.308789e+06 6.500653e+05 8.576319e+05 5.810445e+06 3.983343e+05 2.155893e+06 4.780663e+05 5.716397e+05 8.691177e+06 1.270352e+05 1.395610e+06 1.414025e+06 7.631642e+06 2.185547e+06 2.412689e+06 1.152165e+07 2.129623e+06 9.596504e+05 3.908250e+06 1.301198e+06 3.646856e+06 1.101750e+06 2.834638e+05 1.170075e+05 3.171442e+06 4.417742e+06 1.891439e+05 2.299346e+07 2.209790e+06 2.769782e+06 6.025086e+06 6.183982e+06 3.876868e+05 1.993054e+05 2.350215e+07 2.713195e+07 1.887635e+07 6.068206e+06 1.300471e+07 1.040654e+06 6.899859e+06 9.340462e+05 2.540540e+06 4.734136e+07 6.058645e+05 2.229119e+07 6.400135e+06 6.807351e+06 7.802508e+06 7.767582e+06 3.643462e+06 2.268920e+05 1.241694e+07 3.173011e+06 7.085821e+06 2.010750e+06 4.226001e+07 1.417095e+07 2.677957e+06 2.989017e+07 8.099493e+06 2.580711e+07 6.823953e+07 4.083239e+07 1.339150e+06 6.908839e+06 3.438718e+07 7.204982e+06 5.362918e+06 3.393282e+05 2.667546e+07 6.493913e+06 8.706908e+06 3.473592e+05 TRIGONELLINE 1.830713e+08 6.604964e+06 6.472305e+06 4.960872e+06 1.932753e+05 5.760410e+06 6.785885e+06 5.407836e+06 188020.87 7.139528e+06 4.739737e+06 7.557531e+06 161739.73 5.954154e+06 5.711108e+06 6.639490e+06 1.499119e+05 5.736206e+06 6.083384e+06 6.234373e+06 1.137584e+05 4.688748e+06 6.502626e+06 7.798113e+06 30691.853 5.480422e+06 5.982486e+06 6.009891e+06 2.751930e+04 5.703174e+06 6.112437e+06 6.451670e+06 158424.75 6.127291e+06 5.956164e+06 5.610093e+06 1.248550e+05 5.988297e+06 6.469684e+06 6.136007e+06 1.464883e+05 5.932250e+06 6.122719e+06 6.957042e+06 1.469377e+05 5.672679e+06 5.900890e+06 6.038807e+06 6.099477e+06 1.081441e+07 1.579579e+07 2.564654e+06 2.911516e+06 1.014454e+07 8.849131e+06 6.090152e+06 1.403331e+07 1.551104e+07 4.356870e+06 7.824860e+06 2.441559e+07 1.107272e+07 7.716415e+06 6.521711e+06 2.166189e+07 1.954890e+06 8.740992e+06 3.379282e+06 5.138029e+06 4.696622e+06 3.821587e+07 2.495948e+06 8.998092e+06 4.019871e+06 9.850620e+06 3.844482e+06 6.395717e+06 1.379320e+07 3.502101e+06 2.050021e+06 4.468283e+06 5.487531e+06 1.432173e+06 6.632822e+06 1.683725e+06 1.535311e+06 2.607271e+07 3.742909e+06 2.288685e+07 5.562617e+06 2.638159e+06 4.032111e+06 2.458347e+07 4.633424e+06 4.567087e+06 2.349751e+07 7.490788e+06 2.510420e+06 2.346428e+06 7.306489e+05 1.522789e+06 2.920921e+06 2.924129e+06 5.659096e+06 4.332803e+07 2.848790e+06 8.277557e+06 5.321479e+06 9.943058e+06 2.219467e+06 1.764285e+06 9.466845e+06 1.555544e+07 4.349949e+06 1.376494e+06 2.076696e+06 6.626730e+06 1.288465e+07 3.453267e+06 1.214366e+06 1.209082e+06 8.522062e+06 2.205203e+07 6.225824e+06 4.229981e+06 5.879455e+06 8.359455e+06 1.657416e+07 4.713641e+06 3.492762e+06 5.511335e+06 2.454657e+06 1.262050e+07 8.259108e+06 6.029089e+06 1.715041e+06 6.547969e+06 1.728985e+07 6.257824e+06 3.876645e+06 2.002284e+07 1.081834e+07 1.327019e+06 3.458707e+07 1.128895e+07 9.092044e+06 2.618713e+06 3.779662e+07 4.013559e+07 9.093609e+06 2.466564e+07 1.974633e+07 9.620914e+06 6.921236e+06 2.127186e+06 2.867716e+07 1.305398e+07 1.457331e+07 1.210446e+06 4.536933e+06 3.005596e+06 4.931535e+06 6.915373e+06 4.586986e+06 2.739711e+06 8.207075e+06 3.552076e+06 3.065044e+06 1.409449e+06 2.176963e+07 1.640425e+06 1.024972e+06 1.134052e+07 3.991298e+06 1.137295e+07 4.187937e+06 1.812046e+07 4.153537e+06 1.265761e+07 1.335492e+06 2.068367e+06 3.133110e+06 4.897775e+07 6.568659e+06 5.285355e+06 9.885895e+06 3.747934e+06 1.565713e+06 2.107872e+06 1.308500e+06 5.432625e+07 2.361619e+06 6.486296e+06 2.991478e+07 3.038627e+05 6.528791e+06 2.164212e+07 1.337317e+05 2.979095e+06 2.424480e+06 1.442243e+07 2.907752e+06 1.377569e+07 4.049231e+07 1.360887e+07 2.053029e+06 1.524270e+06 3.806536e+06 3.489554e+06 5.734064e+06 3.691281e+06 2.971501e+07 1.717774e+07 2.690801e+06 1.562046e+06 4.968241e+06 3.455583e+06 8.063474e+06 1.797617e+07 4.205375e+06 2.733362e+06 3.467472e+06 1.015510e+07 1.762857e+06 1.873531e+06 1.714029e+06 1.901817e+07 5.933129e+06 9.161975e+06 3.656882e+06 8.691369e+06 1.783796e+07 1.490990e+06 1.974109e+06 1.266600e+06 7.298182e+06 3.333615e+06 7.011860e+06 6.674584e+06 3.337660e+06 1.317475e+07 1.338651e+06 3.600706e+07 2.469950e+06 3.490396e+06 1.422000e+07 2.629662e+07 1.279402e+06 2.491037e+07 2.138837e+06 1.399935e+07 9.098421e+06 5.020163e+06 5.838658e+07 3.330880e+06 3.762189e+06 9.782290e+06 1.667049e+06 2.481186e+07 5.907491e+06 3.802920e+06 2.795784e+07 C4 H8 N6 O4_7.501 3.082375e+04 1.192331e+05 2.355929e+05 3.057084e+05 3.171849e+04 2.859399e+04 1.989226e+05 1.456414e+05 39544.06 1.642257e+05 1.590877e+05 1.038769e+05 40337.03 3.285925e+05 1.278799e+05 1.362777e+05 4.439587e+04 1.971397e+05 1.783309e+05 2.183608e+05 4.063388e+04 1.847202e+05 1.490543e+05 1.263878e+05 13337.720 1.777848e+05 2.147299e+05 1.674222e+05 1.305727e+04 1.454468e+05 2.427225e+05 2.141837e+05 77083.48 1.670581e+05 1.519911e+05 1.865592e+05 6.059813e+04 1.689404e+05 1.753599e+05 2.173550e+05 8.735444e+04 2.106690e+05 1.316242e+05 1.441828e+05 1.191588e+05 1.349245e+05 1.321682e+05 2.474389e+05 7.048472e+04 1.688655e+04 7.776117e+04 5.404500e+04 5.275196e+04 4.299334e+04 3.029923e+04 9.554353e+04 1.943708e+05 7.730892e+04 7.089484e+04 3.235655e+04 5.281972e+04 8.435209e+04 2.516223e+04 6.843263e+04 5.369457e+04 6.455018e+04 3.356966e+04 5.144460e+04 3.325183e+04 4.787897e+04 3.094577e+04 4.440494e+04 9.049366e+04 4.132745e+04 5.320359e+04 5.255519e+04 3.308897e+04 3.170839e+04 5.561850e+04 7.651407e+04 4.297926e+04 2.809023e+04 5.606713e+04 2.676148e+04 3.995651e+04 1.012490e+05 5.827275e+04 2.609725e+04 3.553821e+04 3.819788e+04 4.303758e+04 2.358105e+04 3.797649e+04 2.010636e+04 6.867240e+04 2.774089e+04 5.793216e+04 5.078616e+04 2.197671e+04 1.939781e+04 2.666610e+04 7.100594e+04 4.048710e+04 4.083008e+04 4.188172e+04 3.781672e+04 5.554065e+04 7.453382e+04 4.115949e+04 4.020809e+04 3.865214e+04 3.968174e+04 5.069493e+04 5.196209e+04 1.752531e+04 1.562510e+04 3.428665e+04 4.498260e+04 1.087605e+05 4.835293e+04 7.400026e+04 6.622238e+04 4.739011e+04 4.556457e+04 6.977046e+04 5.091967e+04 2.431382e+04 5.973602e+04 4.646801e+04 2.330730e+04 4.510797e+04 4.706440e+04 8.069238e+04 4.021533e+04 2.300436e+04 2.954949e+04 8.780062e+04 4.591363e+04 5.338566e+04 6.408886e+04 5.417875e+04 6.657062e+04 2.512704e+04 4.695533e+04 2.437741e+04 3.684134e+04 5.145373e+04 3.948030e+04 1.998568e+04 3.017175e+04 2.063439e+04 4.742051e+04 4.224030e+04 6.284896e+04 5.997716e+04 2.431880e+04 4.034415e+04 2.637510e+04 3.790345e+04 1.833646e+04 4.556861e+04 8.558231e+04 3.240627e+04 8.557207e+04 7.356014e+04 2.911721e+04 4.235498e+04 7.998773e+04 7.589203e+04 4.997911e+04 3.037863e+04 5.559077e+04 5.201971e+04 4.256309e+04 6.825810e+04 1.929027e+04 5.564259e+04 4.503455e+04 3.297140e+04 2.990922e+04 1.117104e+06 3.135790e+05 1.679529e+06 3.871080e+05 8.672136e+05 6.586897e+05 4.329839e+04 1.616526e+06 4.683522e+05 8.653618e+05 8.503901e+05 2.354296e+05 1.087885e+05 5.935446e+05 9.204321e+05 6.397334e+05 1.248299e+06 3.650057e+05 1.204617e+06 5.441735e+05 1.618424e+06 7.497269e+05 3.563761e+04 9.371929e+05 7.502682e+05 1.603882e+05 7.115104e+05 3.574188e+05 1.062209e+06 1.470298e+06 6.138653e+05 2.528030e+05 9.498011e+05 1.203455e+06 9.689211e+05 1.474723e+06 8.381288e+05 1.055523e+06 8.624727e+05 1.158769e+06 6.656938e+05 6.018207e+05 9.821637e+05 1.004897e+06 1.133201e+06 5.673856e+05 8.509231e+05 2.718773e+06 6.705761e+05 1.069357e+06 1.665026e+06 7.657274e+05 7.407319e+04 1.021032e+06 1.714652e+06 6.094016e+05 1.211411e+06 6.649559e+05 4.395757e+05 3.773786e+04 5.006961e+04 2.236701e+04 3.739017e+04 3.925931e+04 2.260489e+04 7.852301e+04 5.428634e+04 4.634211e+04 3.682124e+04 2.855696e+04 2.226795e+04 5.578036e+04 3.288787e+04 2.719478e+04 2.706557e+04 2.165450e+04 2.449084e+04 7.530096e+04 2.083963e+04 4.448488e+04 5.307906e+04 3.747020e+04 C10 H20 N2 O3_7.51 3.686232e+06 6.728975e+05 7.379826e+05 6.874224e+05 1.687620e+05 5.438154e+05 7.166313e+05 5.694350e+05 161515.93 7.845386e+05 7.789781e+05 7.105688e+05 145120.22 6.072385e+05 5.322904e+05 8.485028e+05 1.368460e+05 7.154222e+05 6.216116e+05 6.127502e+05 1.060559e+05 5.430341e+05 7.585015e+05 9.735288e+05 23595.781 5.028802e+05 6.175846e+05 7.547289e+05 2.172092e+04 5.631061e+05 6.884978e+05 8.207206e+05 135084.48 6.328857e+05 6.321282e+05 6.141829e+05 1.055348e+05 6.418798e+05 7.403058e+05 7.439420e+05 1.233057e+05 6.287834e+05 6.921181e+05 7.351163e+05 1.239735e+05 6.442837e+05 5.687242e+05 7.486643e+05 1.680053e+05 2.240907e+05 3.146841e+05 4.885822e+05 3.688796e+05 2.635669e+05 1.736772e+06 1.782300e+06 1.093790e+06 1.192426e+06 4.511130e+06 8.713779e+05 2.570793e+06 1.218764e+06 1.952910e+06 4.260506e+05 1.017792e+06 9.040464e+05 8.544540e+05 4.841566e+05 8.715053e+05 7.695604e+05 1.214949e+06 4.998488e+05 2.112804e+06 8.181952e+05 1.157307e+06 8.947803e+05 6.018780e+05 1.751900e+06 2.460880e+05 2.288588e+05 1.652076e+05 1.897212e+05 1.115078e+06 1.682794e+06 4.129195e+05 1.272890e+06 7.371447e+05 8.981930e+04 1.090645e+06 9.819547e+05 1.285100e+06 4.572067e+05 6.018860e+05 1.966851e+06 6.389945e+05 8.811402e+05 4.410953e+05 1.567826e+06 1.375496e+06 1.604668e+06 5.570456e+05 1.302059e+05 5.681759e+05 3.476943e+05 1.255161e+06 1.704085e+06 3.199968e+06 5.262299e+05 9.504212e+06 3.816729e+05 1.246170e+06 1.877359e+06 3.839690e+06 1.741122e+06 6.902149e+05 6.533182e+05 1.394578e+06 8.590893e+05 1.881938e+05 1.468796e+06 8.843420e+05 2.049073e+05 5.601387e+05 3.849825e+05 2.286514e+05 4.487445e+05 4.592164e+05 9.618967e+05 1.684975e+05 6.372655e+05 1.600649e+06 1.517445e+06 4.435012e+05 1.668555e+06 9.900326e+05 8.324216e+05 1.091426e+05 7.893675e+04 5.431623e+05 2.019385e+05 8.430908e+05 1.208044e+06 1.399821e+05 3.112239e+05 3.010269e+05 9.807181e+05 1.083234e+06 1.135593e+06 1.189086e+06 2.538269e+05 3.079339e+05 1.318516e+06 1.902403e+06 6.701600e+05 1.402373e+05 3.103035e+06 3.907352e+05 1.172796e+06 2.868597e+05 6.837383e+05 4.525018e+05 1.524361e+05 2.553780e+05 3.544687e+05 1.539840e+05 1.468895e+06 1.100509e+06 1.006506e+05 1.561266e+06 3.505192e+05 1.323354e+05 1.938460e+05 2.439411e+05 2.403133e+05 1.749238e+06 3.379876e+06 8.036983e+05 1.632976e+06 4.113949e+05 3.185383e+05 6.864827e+04 9.037498e+05 9.906140e+04 8.029250e+05 1.659421e+06 4.838602e+05 1.377430e+05 5.498193e+05 1.464962e+06 8.140800e+05 1.066816e+06 4.027748e+05 1.661684e+05 5.462796e+05 2.866813e+05 1.077117e+06 3.848084e+06 1.100039e+06 2.174292e+05 1.164475e+06 4.674718e+06 1.134604e+06 2.029412e+06 5.861213e+05 8.443490e+04 8.041541e+04 8.264148e+05 1.286934e+05 1.505363e+05 2.387776e+05 3.639701e+05 3.999803e+05 5.509578e+05 5.823001e+05 5.366792e+05 1.101247e+06 1.191516e+06 1.166790e+05 2.964409e+05 1.242311e+06 1.665447e+05 2.364759e+05 4.212787e+05 3.352638e+05 3.773522e+05 1.235731e+05 7.706835e+05 5.506062e+05 1.697175e+05 5.830777e+05 3.076586e+06 1.136631e+06 1.692962e+05 4.668288e+05 4.984568e+05 2.792321e+05 9.008933e+05 6.714447e+05 1.177559e+06 1.801900e+05 3.852281e+06 7.588574e+05 3.574138e+05 1.753583e+05 1.508868e+06 2.512514e+05 1.669928e+05 3.382803e+05 1.145841e+06 9.693278e+04 1.529704e+06 1.311540e+06 5.509411e+05 6.955559e+05 6.749228e+05 1.334639e+06 1.326603e+06 2.036127e+05 1.071967e+06 7.887033e+05 9.584118e+05 1.601652e+06 C7 H15 N O3_7.514 1.317696e+09 7.046973e+08 6.979915e+08 7.654466e+08 1.838711e+05 7.524782e+08 9.707062e+05 2.497076e+08 198791.87 8.765123e+08 8.281741e+08 7.749823e+08 163142.32 7.093203e+08 7.450755e+08 7.009112e+08 1.548552e+05 6.715769e+08 6.871730e+08 7.148702e+08 1.256663e+05 6.601340e+08 7.206109e+08 7.688546e+08 30274.131 6.752997e+08 7.074126e+08 6.844384e+08 2.821552e+04 7.056802e+08 6.939028e+08 7.335474e+08 179271.87 7.345425e+08 6.823265e+08 6.640926e+08 1.440142e+05 6.970479e+08 7.468435e+08 6.853617e+08 1.781458e+05 7.175031e+08 7.136895e+08 7.194899e+08 1.868580e+05 7.099436e+08 6.677134e+08 7.232064e+08 7.285869e+08 7.236021e+08 6.211930e+08 8.049097e+08 7.736341e+08 7.477436e+08 9.679884e+08 8.419070e+08 8.010117e+08 8.533821e+08 9.519787e+08 7.694066e+08 1.010012e+09 8.389531e+08 5.181287e+08 7.620028e+08 7.359389e+08 6.625490e+08 7.852014e+08 7.830491e+08 7.980002e+08 7.881375e+08 1.006932e+09 8.612163e+08 8.796110e+08 6.912285e+08 8.036580e+08 7.507487e+08 1.366012e+08 8.211759e+08 9.403364e+08 7.546578e+08 9.528584e+08 7.323416e+08 5.227277e+08 6.460602e+08 6.849499e+08 7.117931e+08 5.864619e+08 7.209573e+08 7.588405e+08 6.330356e+08 8.307341e+08 5.831759e+08 8.083399e+08 7.023237e+08 5.644871e+08 7.245164e+08 6.803884e+08 8.612176e+08 7.349300e+08 5.199696e+08 4.266960e+08 7.216783e+08 7.387873e+08 6.931412e+08 6.260171e+08 6.070504e+08 7.254889e+08 7.653937e+08 2.447651e+06 7.235752e+08 6.118819e+08 6.986878e+08 6.948146e+08 7.311535e+08 8.083276e+08 9.879099e+08 6.656307e+08 7.729687e+08 7.517520e+08 6.803660e+08 6.495146e+08 7.705068e+08 4.757495e+08 6.982729e+08 6.993642e+08 5.547938e+08 7.356530e+08 6.348290e+08 8.675113e+08 8.235318e+08 8.199704e+08 8.230075e+08 5.683876e+08 7.214762e+08 7.919977e+08 4.335296e+08 6.943270e+08 7.263450e+08 6.329375e+08 7.335903e+08 6.927000e+08 7.711211e+08 5.835202e+08 7.766981e+08 8.743577e+08 7.840135e+08 7.417820e+08 7.523311e+08 9.451713e+08 6.064370e+08 5.331302e+08 7.224925e+08 2.400629e+06 8.308722e+08 6.610959e+08 9.099996e+08 8.418907e+08 8.974962e+08 7.064105e+08 5.706041e+08 6.541298e+08 9.187669e+08 6.467489e+08 7.165710e+08 7.100134e+08 4.487474e+08 7.837696e+08 7.755884e+08 6.339133e+08 8.142278e+08 9.232685e+08 7.387367e+08 7.138238e+08 7.729383e+08 8.560291e+08 5.885581e+08 8.165298e+08 3.289263e+07 6.367001e+08 6.452660e+08 5.392646e+08 6.803823e+08 6.960914e+08 3.578491e+08 5.863327e+08 5.640499e+08 7.191258e+08 6.279555e+08 1.000522e+09 8.000236e+08 7.175412e+08 1.076865e+09 2.796325e+05 7.078859e+08 4.613978e+08 9.066225e+08 8.789770e+08 7.427985e+08 8.222339e+08 6.811846e+08 9.863639e+08 7.134062e+08 7.490468e+08 8.537157e+08 6.429882e+08 7.024057e+08 7.110042e+08 1.097908e+09 7.847537e+08 1.362514e+06 6.069180e+08 6.134276e+08 7.591817e+08 7.208209e+08 1.917333e+08 7.479203e+08 5.537037e+08 6.886412e+08 7.262111e+08 6.960574e+08 4.949789e+08 7.976058e+08 7.775882e+08 6.212830e+08 6.389363e+08 6.871453e+08 7.336755e+08 6.557220e+08 7.080851e+08 1.059020e+09 7.665232e+08 6.474857e+08 8.356642e+08 7.720090e+08 7.284767e+08 6.169771e+08 1.088653e+09 7.728426e+08 8.102161e+08 1.248551e+09 8.934775e+08 8.694672e+08 6.673071e+08 1.158104e+09 6.437827e+08 6.611671e+08 8.108315e+08 7.599021e+08 8.004265e+08 1.947530e+08 7.441889e+08 9.241212e+08 7.771331e+08 9.579128e+08 1.204690e+09 1.421817e+08 9.263506e+08 7.286211e+08 8.201427e+08 6.871318e+08 8.217960e+08 8.034097e+08 C7 H13 N O3_7.549 1.033714e+07 1.715864e+07 1.565648e+07 1.609922e+07 1.720033e+05 1.591235e+07 1.637250e+07 1.502161e+07 204750.77 1.890314e+07 1.754991e+07 1.873211e+07 152793.10 1.515167e+07 1.620145e+07 1.652024e+07 1.936879e+05 1.572823e+07 1.629854e+07 1.639485e+07 1.129368e+05 1.491206e+07 1.757976e+07 1.910130e+07 31316.618 1.580080e+07 1.637919e+07 1.608687e+07 5.577140e+04 1.576191e+07 1.621178e+07 1.746846e+07 154862.21 1.666720e+07 1.677179e+07 1.666497e+07 1.216736e+05 1.761158e+07 2.002175e+07 4.977268e+06 1.643198e+05 1.907822e+07 1.882731e+07 1.898850e+07 1.506373e+05 1.678498e+07 1.468014e+07 1.722096e+07 8.980127e+05 6.590185e+05 1.403275e+05 2.633980e+05 4.223238e+05 2.014786e+06 4.709235e+05 1.330449e+06 3.985468e+06 3.260834e+06 1.621072e+07 2.845514e+06 4.284559e+05 1.031224e+05 8.601939e+05 5.975368e+06 1.901292e+06 4.137081e+05 7.471448e+05 8.732029e+06 1.681354e+06 4.676660e+06 4.398569e+06 3.681261e+06 1.915953e+06 2.304425e+07 2.229670e+06 6.125185e+06 1.034557e+06 3.026463e+06 8.986063e+07 5.203127e+07 3.702797e+07 7.146451e+05 3.053462e+07 2.983437e+05 3.993002e+07 3.150235e+07 1.007887e+05 2.288002e+07 6.005476e+05 4.733220e+05 3.805885e+05 3.887163e+06 8.868400e+05 3.135372e+05 3.412380e+06 6.351471e+05 8.434633e+06 2.613144e+05 8.850394e+05 1.064397e+06 9.883277e+05 4.103577e+07 1.124107e+06 3.516146e+05 2.613839e+05 2.870169e+05 9.999566e+06 4.659698e+07 1.999794e+05 2.614469e+06 5.317400e+05 4.070335e+06 1.693380e+06 4.052479e+05 4.811730e+05 8.630323e+05 1.636773e+06 5.335949e+05 1.193834e+08 3.760130e+06 5.832710e+07 1.315681e+05 6.774417e+05 8.716601e+05 8.193530e+05 1.019502e+07 2.967799e+06 1.712823e+06 9.910306e+07 1.145588e+06 4.979118e+05 6.444684e+05 3.210540e+07 2.762464e+05 2.100544e+06 8.511116e+05 4.425689e+06 1.532740e+06 1.135486e+07 7.311433e+07 9.829954e+05 3.372312e+06 1.329789e+07 1.460498e+06 1.409830e+06 3.838135e+04 2.795448e+05 9.172978e+04 8.301527e+04 4.356410e+05 1.140906e+05 1.923587e+06 1.092363e+06 3.198371e+07 5.693408e+07 1.316779e+06 7.368028e+05 3.975162e+06 1.006229e+06 7.147010e+05 1.634715e+05 5.388119e+07 3.976486e+05 8.999626e+05 6.445299e+07 5.324695e+06 1.227160e+06 1.699203e+06 1.197588e+07 3.170048e+05 2.719823e+07 1.669362e+07 1.046987e+06 1.097492e+06 2.499005e+05 7.743318e+05 3.994170e+05 1.028556e+06 2.817582e+06 5.716434e+06 4.664731e+05 3.366360e+05 9.670792e+06 5.604971e+05 4.689117e+05 8.650820e+05 1.685357e+07 1.312400e+06 9.866427e+05 6.493701e+06 6.051495e+05 1.589527e+07 1.656316e+06 3.719671e+05 9.803949e+05 2.620507e+05 3.392988e+05 5.223926e+06 2.982177e+06 4.654582e+06 8.113203e+05 3.124545e+06 1.982601e+05 5.616493e+05 1.135706e+06 1.336026e+05 3.299353e+06 8.062407e+07 1.898944e+05 6.418451e+04 1.807871e+06 8.100686e+06 2.738104e+06 8.433933e+05 3.619877e+06 6.043592e+05 9.620782e+05 1.070369e+06 5.191855e+05 1.067042e+05 3.125185e+05 9.920901e+07 2.878234e+06 1.862244e+06 7.869155e+05 1.637140e+05 1.444070e+06 5.874260e+05 5.398759e+06 7.318012e+05 6.623712e+05 2.644498e+06 5.645710e+07 3.972774e+05 6.462485e+04 1.234228e+05 3.086975e+06 5.224479e+06 4.302626e+05 8.411910e+07 5.405258e+06 1.279035e+06 4.209321e+05 5.004307e+07 1.442883e+05 5.582256e+06 2.970198e+05 4.440759e+06 2.178408e+06 3.025247e+07 2.926492e+05 1.815174e+06 1.201021e+07 1.975541e+06 1.914263e+06 7.972476e+05 3.558720e+06 4.620748e+07 5.973450e+05 3.898298e+06 1.588502e+06 3.099974e+06 C4 H11 N O2_7.574 3.221440e+06 9.697731e+05 8.867896e+05 8.953037e+05 1.762412e+05 9.419832e+05 7.431246e+05 6.082980e+05 190458.27 1.124358e+06 1.037351e+06 9.812526e+05 129126.19 9.470444e+05 8.743439e+05 8.879985e+05 1.400175e+05 8.242343e+05 9.034438e+05 8.783372e+05 1.182143e+05 8.788942e+05 9.430617e+05 9.054179e+05 168183.617 9.468307e+05 8.655208e+05 9.052814e+05 1.611505e+05 9.110385e+05 9.052707e+05 9.237309e+05 134339.35 9.472470e+05 8.835518e+05 7.968108e+05 2.157880e+05 9.310076e+05 9.057742e+05 9.506973e+05 1.965731e+05 8.572500e+05 9.645645e+05 8.406311e+05 1.317966e+05 9.781395e+05 8.372514e+05 9.309037e+05 8.513581e+05 5.171752e+05 1.175028e+06 9.483356e+05 1.426128e+06 1.379313e+06 1.651052e+06 2.246662e+06 7.054206e+05 1.093653e+06 1.321619e+06 1.043901e+06 1.713061e+06 1.203551e+06 7.965369e+05 5.873978e+05 8.059037e+05 7.421553e+05 9.878777e+05 1.123981e+06 8.605447e+05 6.080701e+05 6.659970e+05 8.964959e+05 6.792103e+05 7.207282e+05 1.493697e+06 8.730982e+05 1.125935e+06 6.757374e+05 6.867168e+05 5.977598e+05 1.463893e+06 1.298180e+06 1.226392e+06 8.939913e+05 2.899380e+05 4.208477e+05 1.185880e+06 2.846061e+06 5.432915e+05 6.100698e+05 1.349030e+06 7.660863e+05 1.160347e+06 3.645145e+05 4.729404e+05 9.224793e+05 5.599067e+05 1.248165e+06 7.387821e+05 3.076695e+05 4.656500e+05 8.606310e+05 9.825556e+05 1.190078e+06 2.980450e+06 6.959956e+05 1.063207e+06 3.637130e+05 6.219629e+05 1.206590e+06 7.961332e+05 1.118646e+06 1.529055e+06 6.297510e+05 3.759817e+05 9.946996e+05 1.174186e+06 1.102685e+06 5.449668e+05 8.348457e+05 9.338738e+05 1.135398e+06 6.258899e+05 4.509068e+05 4.737674e+05 4.735022e+05 6.350264e+05 7.568952e+05 1.133818e+06 1.178982e+06 1.302205e+06 6.645227e+05 1.033764e+06 1.530243e+06 3.661328e+05 8.226007e+05 8.643769e+05 1.106114e+06 7.193338e+05 5.966180e+05 1.897184e+06 1.602829e+06 3.238277e+05 1.508449e+06 1.078308e+06 1.018979e+06 8.874332e+05 1.852111e+06 1.369105e+06 7.610995e+05 7.029254e+05 1.238100e+06 1.485312e+06 7.957610e+05 1.305861e+06 1.616501e+06 1.739829e+06 6.542859e+05 1.152329e+06 7.226302e+05 5.341885e+05 4.686917e+05 7.691324e+05 1.376270e+06 8.935440e+05 3.929867e+05 1.069615e+06 1.291111e+06 8.600506e+05 7.744977e+05 7.538295e+05 4.910873e+05 7.128027e+05 1.249624e+06 1.357263e+06 7.377304e+05 1.352484e+06 7.530008e+05 1.497926e+06 1.168465e+06 5.901311e+05 8.999295e+05 1.214121e+06 1.243206e+06 6.636379e+05 8.507640e+05 1.285076e+06 1.139564e+06 8.215246e+05 8.373738e+05 7.445987e+05 4.020861e+05 5.820606e+04 1.181121e+06 5.597831e+05 1.639840e+06 1.871829e+06 1.246651e+06 1.772796e+06 1.270671e+06 1.142684e+06 1.356320e+06 1.705928e+06 6.867009e+05 9.262347e+05 6.825278e+05 1.243626e+06 6.642359e+05 6.561052e+05 8.197801e+05 7.575578e+05 6.167437e+05 1.532602e+06 1.000568e+06 7.924589e+05 1.185079e+06 4.652544e+05 8.011548e+05 7.025973e+05 1.635828e+06 5.831984e+05 8.630941e+05 8.534809e+05 7.889167e+05 1.377747e+06 6.366472e+05 1.657553e+06 4.304330e+05 8.569298e+05 1.156613e+06 1.959322e+06 9.771236e+05 5.549396e+05 1.277316e+06 1.139844e+06 7.314210e+05 8.834216e+05 8.866002e+05 1.097176e+06 7.390239e+05 2.169467e+06 5.851223e+05 8.215006e+05 9.807098e+05 1.433188e+06 2.939950e+05 1.573469e+06 7.812901e+05 1.868370e+06 7.186872e+05 1.491971e+06 9.858714e+05 6.858018e+05 6.157368e+05 9.805219e+05 3.192498e+05 1.013068e+06 3.720457e+05 6.456141e+05 9.230297e+05 1.213448e+06 7.216673e+05 C9 H22 N2 O4_7.602 2.599359e+06 4.565402e+05 6.564347e+05 5.086126e+05 8.663072e+04 5.102791e+05 5.785058e+05 4.989619e+05 129778.78 4.811065e+05 5.745013e+05 5.622678e+05 97097.10 4.627107e+05 6.207604e+05 5.516402e+05 8.915068e+04 5.051006e+05 4.664867e+05 5.290542e+05 7.275888e+04 4.493700e+05 5.934588e+05 8.009117e+05 17698.756 4.257412e+05 4.745427e+05 4.699626e+05 1.989515e+04 4.684306e+05 5.073612e+05 7.160204e+05 125294.80 4.993367e+05 4.843781e+05 4.837433e+05 9.655359e+04 4.925767e+05 5.833008e+05 6.263017e+05 1.220639e+05 5.128656e+05 4.946274e+05 6.493499e+05 1.622169e+05 4.613939e+05 3.716869e+05 6.412757e+05 5.671726e+05 2.738627e+05 4.592665e+05 5.469547e+05 6.480428e+05 8.768255e+05 7.732293e+05 2.062041e+06 7.455183e+05 1.039769e+06 1.291935e+06 1.481294e+06 5.638908e+05 1.055826e+06 5.534802e+05 5.011189e+05 4.469341e+05 2.243887e+05 7.972975e+05 6.302339e+05 6.889598e+05 6.290315e+05 7.375909e+05 5.549059e+05 8.627891e+05 2.754467e+05 9.891135e+05 4.120738e+05 5.434318e+05 3.039325e+05 1.629040e+06 9.882596e+05 7.239394e+05 6.495042e+05 2.675499e+05 4.195946e+05 1.442025e+05 3.960579e+05 3.068050e+05 1.715182e+06 2.258074e+05 5.375165e+05 5.349847e+05 3.556674e+05 7.655127e+05 7.824597e+04 4.118136e+05 5.135061e+05 2.483604e+05 5.998741e+05 2.973719e+05 7.871140e+04 2.524340e+05 6.237548e+05 3.628542e+05 4.126791e+05 1.640433e+06 3.286052e+05 7.467331e+05 3.261386e+05 4.785919e+05 4.656380e+05 2.987494e+05 8.200212e+05 6.701843e+05 4.611324e+05 2.338145e+05 5.176713e+05 6.092504e+05 4.703551e+05 8.686529e+05 5.791514e+05 2.551311e+05 4.996693e+05 4.897758e+05 3.504962e+05 1.617979e+05 1.564374e+05 2.415412e+05 1.978868e+05 9.905525e+05 3.127260e+05 1.089549e+06 6.598024e+05 1.075003e+06 1.294572e+06 2.580022e+05 4.487956e+05 5.339996e+05 7.067014e+05 5.850986e+05 3.477937e+05 5.063065e+05 1.031409e+06 1.928481e+05 6.141384e+05 1.566944e+06 8.784646e+05 4.587817e+05 8.722245e+05 7.184160e+05 3.125545e+05 3.490519e+05 1.100923e+06 8.706705e+05 2.115323e+05 1.527026e+06 5.273978e+05 1.143214e+06 2.932333e+05 5.309353e+05 7.276499e+05 2.304604e+05 1.199353e+06 3.220442e+05 3.855995e+05 5.878870e+05 2.975381e+05 5.661946e+05 8.799269e+05 4.489193e+05 5.230530e+05 3.745325e+05 4.397163e+05 4.472228e+05 7.821517e+05 2.594947e+05 2.656489e+05 9.667757e+05 3.147087e+05 1.070651e+06 5.186512e+05 4.862377e+04 4.275109e+05 4.720245e+05 3.485050e+05 1.713060e+05 3.551434e+04 7.295094e+05 4.059479e+05 1.120573e+05 6.056409e+05 7.332675e+05 3.480997e+05 3.925172e+05 5.850789e+05 1.177459e+05 8.677690e+05 1.260596e+06 4.529315e+05 9.807896e+05 8.224441e+05 1.027744e+06 7.052105e+05 3.705432e+05 3.334700e+05 3.832898e+05 3.412846e+05 7.940061e+05 4.374094e+05 3.023487e+05 5.968173e+05 3.529822e+05 9.385706e+05 9.313154e+05 4.019867e+05 2.434662e+05 9.564914e+05 8.985731e+04 4.711674e+05 4.600297e+05 6.605988e+05 3.469532e+05 9.916327e+05 4.412618e+05 3.251678e+05 5.349936e+05 2.381299e+05 6.966301e+05 7.188660e+04 5.003187e+05 5.099729e+05 2.921917e+05 6.238331e+05 6.111221e+05 3.741154e+05 4.252155e+05 1.762772e+05 2.491750e+05 4.222365e+05 1.212162e+05 7.832729e+05 1.186196e+06 3.099456e+05 2.964001e+05 7.933627e+05 5.060720e+05 1.637957e+05 5.824577e+05 4.876553e+05 1.468985e+06 4.543973e+05 3.511563e+05 6.359201e+05 5.720386e+05 8.138971e+05 6.636592e+05 6.616934e+04 3.746655e+05 3.851390e+05 3.266567e+05 4.239911e+05 8.988514e+05 8.140599e+05 BETAINE 1.749649e+09 8.155235e+08 8.772220e+08 8.305936e+08 6.456709e+05 8.783469e+08 1.032057e+09 1.691233e+08 1481798.40 9.889662e+08 1.008504e+09 9.612539e+08 1099648.04 8.351467e+08 8.436408e+08 8.362348e+08 8.487450e+05 7.978374e+08 8.581995e+08 8.113464e+08 7.132485e+05 7.505432e+08 8.474491e+08 9.596869e+08 80904.530 8.331558e+08 8.303072e+08 7.775365e+08 1.258624e+06 8.722928e+08 7.825504e+08 9.008565e+08 521526.38 8.058498e+08 8.445841e+08 7.784660e+08 7.499448e+05 8.851697e+08 8.318837e+08 8.159536e+08 4.863552e+05 8.466607e+08 8.520427e+08 9.167426e+08 5.423186e+05 7.879413e+08 7.791076e+08 8.678525e+08 8.932297e+08 5.588955e+08 7.450092e+08 9.899297e+08 1.035455e+09 1.116315e+09 8.916523e+08 1.222611e+09 1.426775e+09 1.421777e+09 1.116437e+09 1.299102e+09 8.780013e+08 1.171394e+09 6.723174e+08 9.653878e+08 8.232168e+08 7.485345e+08 1.176654e+09 9.464745e+08 1.063975e+09 1.087011e+09 1.500904e+09 1.048808e+09 1.171650e+09 5.963941e+08 1.003467e+09 7.462629e+08 8.657489e+08 8.434997e+08 1.252552e+09 1.147616e+09 9.544151e+08 8.771729e+08 4.939719e+08 8.739845e+08 6.553956e+08 8.802745e+08 6.505012e+08 8.341876e+08 8.126533e+08 1.303732e+09 8.250564e+08 6.660929e+08 1.000708e+09 6.379035e+08 7.165872e+08 8.333868e+08 9.189318e+08 9.120205e+08 6.957396e+08 4.364654e+08 4.424879e+08 8.770433e+08 7.165707e+08 7.665100e+08 9.200010e+08 8.169594e+08 9.619688e+08 1.101116e+09 1.031171e+09 7.879324e+08 8.331902e+08 1.000276e+09 7.671759e+08 1.039844e+09 9.022671e+08 7.594142e+08 8.827496e+08 7.785823e+08 1.194383e+09 1.064311e+09 5.315129e+08 8.333125e+08 7.642920e+08 1.028193e+09 7.508740e+08 6.630050e+08 1.021616e+09 6.323750e+08 9.247449e+08 8.175475e+08 1.196173e+09 1.217118e+09 8.698539e+08 1.200969e+09 9.976639e+08 5.517688e+08 8.486335e+08 9.518358e+08 8.907101e+08 8.775364e+08 7.571029e+08 9.523437e+08 4.690563e+08 7.823540e+08 1.657708e+09 1.046468e+09 8.502338e+08 9.366744e+08 1.072492e+09 7.533312e+08 9.284286e+08 1.069171e+09 9.007503e+08 5.944674e+08 1.009694e+09 1.076179e+09 1.084871e+09 1.053816e+09 8.466118e+08 7.099179e+08 8.906173e+08 1.001176e+09 8.669719e+08 6.653277e+08 6.521932e+08 3.867362e+08 8.968927e+08 8.874447e+08 7.588113e+08 1.020900e+09 9.497313e+08 8.665051e+08 9.933678e+08 8.795811e+08 6.452674e+08 5.691098e+08 1.081942e+09 8.296151e+08 9.358407e+08 7.414105e+08 3.812947e+08 8.498225e+08 7.206052e+08 5.577476e+08 6.128561e+08 2.903030e+08 1.163028e+09 6.078075e+08 9.164034e+08 9.010950e+08 1.074167e+09 5.483265e+08 1.252072e+09 1.012338e+09 4.818783e+08 1.090325e+09 9.216841e+08 6.155164e+08 8.447363e+08 8.617598e+08 1.402663e+09 7.787008e+08 6.189410e+08 1.074875e+09 6.820272e+08 5.432024e+08 8.297402e+08 1.007318e+09 8.745297e+08 8.876154e+08 7.249004e+08 1.174523e+09 9.346018e+08 7.314895e+08 5.356937e+08 1.146824e+09 6.304078e+08 8.274697e+08 1.182515e+09 8.632592e+08 7.086078e+08 1.085250e+09 7.143472e+08 6.001519e+08 7.147460e+08 5.836502e+08 8.028480e+08 6.375774e+08 8.676531e+08 7.124737e+08 4.851236e+08 9.129524e+08 9.182118e+08 7.150599e+08 6.991289e+08 6.634173e+08 1.360934e+09 8.445118e+08 6.661898e+08 8.904068e+08 8.799139e+08 1.135399e+09 6.853954e+08 1.139924e+09 6.920993e+08 7.734882e+08 9.210627e+08 8.691633e+08 1.095986e+09 4.995126e+08 7.589600e+08 1.114293e+09 1.304658e+09 1.579532e+09 1.762971e+09 3.442795e+08 1.191845e+09 9.159957e+08 1.000534e+09 7.810120e+08 1.001653e+09 1.238838e+09 C12 H24 N2 O4_7.617 1.210403e+06 7.180762e+05 1.104004e+06 8.930615e+05 1.577917e+05 8.246838e+05 1.285181e+06 7.373307e+05 212447.68 6.830707e+05 1.110134e+06 1.039923e+06 188312.00 5.382921e+05 1.014660e+06 1.013204e+06 1.138669e+05 8.983582e+05 8.025613e+05 9.077849e+05 8.213565e+04 6.526723e+05 1.047435e+06 1.455252e+06 18228.528 7.013802e+05 8.061508e+05 7.666243e+05 2.133660e+04 8.106362e+05 8.604843e+05 1.158421e+06 142419.65 9.218998e+05 8.099962e+05 8.028471e+05 1.113551e+05 8.580763e+05 9.124024e+05 1.020880e+06 1.433763e+05 9.322758e+05 8.757966e+05 1.204326e+06 1.891548e+05 7.440357e+05 6.830441e+05 9.924933e+05 1.071137e+05 9.519464e+04 7.866126e+04 1.365705e+05 6.084563e+05 3.029105e+05 7.213809e+04 3.102344e+05 9.648135e+05 5.959439e+05 3.422190e+06 1.336505e+06 6.136459e+04 9.212534e+04 8.831041e+04 1.286713e+06 6.452560e+04 7.244220e+04 2.382268e+05 6.726235e+05 5.592901e+05 6.160643e+05 1.891103e+06 3.980893e+05 1.242302e+06 6.481270e+05 1.987483e+05 8.401409e+05 1.267912e+05 1.352544e+05 2.337490e+07 9.976606e+06 3.145866e+06 9.211404e+04 5.346396e+05 6.612511e+04 1.526106e+06 4.439579e+06 7.731630e+04 3.271047e+06 1.269000e+05 5.084532e+04 6.257515e+04 5.976783e+05 6.419719e+04 1.264204e+05 8.219083e+05 5.706867e+04 6.712651e+05 7.355810e+04 5.115569e+04 5.556295e+04 5.488347e+05 3.254902e+06 5.921719e+04 5.632954e+04 6.072862e+04 5.547743e+04 7.918089e+05 3.830540e+06 8.326882e+04 5.201712e+04 6.923698e+04 5.606366e+05 1.993381e+05 7.352400e+04 9.016178e+04 8.053205e+04 4.288719e+04 8.908670e+04 3.255506e+07 1.286836e+06 1.130684e+06 6.583277e+04 6.557895e+04 1.041872e+05 1.269736e+05 5.545964e+05 1.367916e+05 8.706469e+04 7.881369e+06 9.926478e+04 5.692910e+04 1.032521e+05 1.599433e+06 8.035619e+04 8.544277e+04 2.537834e+05 4.045121e+05 3.849452e+05 1.428996e+06 5.209582e+06 6.417021e+04 7.318705e+05 1.218589e+06 1.878111e+05 4.273519e+05 5.650618e+04 8.759273e+04 6.096182e+04 9.342610e+04 9.475739e+04 7.706045e+04 3.439699e+05 3.076925e+05 1.111991e+06 7.270952e+06 9.189614e+04 7.173205e+04 2.234222e+05 4.642416e+04 7.819701e+05 5.814572e+04 1.519545e+07 2.294735e+05 9.488992e+04 4.802941e+06 1.065676e+06 6.103569e+04 4.509324e+05 1.760669e+06 8.986376e+04 1.239423e+06 4.526983e+06 4.143607e+05 7.468095e+04 8.599048e+04 9.360036e+04 9.321418e+04 1.106692e+05 7.298528e+05 2.090591e+05 4.561402e+04 1.193633e+05 2.203909e+05 6.800485e+04 5.283757e+04 4.880835e+04 3.543648e+06 1.039601e+05 1.042816e+05 7.149052e+05 1.030083e+05 1.860170e+06 6.817326e+04 6.556877e+04 4.691759e+04 1.120584e+05 8.105783e+04 6.898974e+05 7.714017e+05 7.432291e+05 2.096869e+05 8.439517e+05 5.591597e+04 1.023128e+05 8.285935e+04 5.730482e+04 3.284610e+05 8.075442e+06 4.341111e+04 8.967240e+04 1.492402e+05 4.528201e+06 4.206712e+05 9.899443e+04 8.566905e+04 9.299697e+04 7.071161e+04 6.126333e+04 1.135201e+05 5.331780e+04 7.170751e+04 1.206704e+07 2.099355e+05 5.549695e+04 7.512835e+04 6.513211e+04 6.938536e+04 5.970809e+04 1.885929e+05 8.693637e+04 3.863451e+04 1.935050e+05 9.086677e+06 5.107877e+04 4.784215e+04 5.381175e+04 3.538064e+05 6.989106e+05 9.638477e+04 1.388393e+07 3.406403e+05 9.151913e+04 4.069152e+04 6.885290e+06 6.980966e+04 2.137720e+05 5.436352e+04 4.140842e+05 5.061703e+05 1.272300e+06 9.313905e+04 8.892355e+05 1.558725e+06 6.988055e+05 1.030470e+05 5.746772e+04 1.249983e+05 9.201912e+06 7.246165e+04 3.925005e+05 4.619686e+05 6.990437e+05 C10 H22 N2 O4_7.625 1.339222e+08 2.516573e+07 3.171470e+07 2.885553e+07 2.955609e+05 2.842600e+07 3.860403e+07 2.481799e+07 356580.37 2.600563e+07 3.207525e+07 3.383864e+07 306186.93 1.963242e+07 3.378068e+07 3.271746e+07 1.904908e+05 2.806789e+07 2.368384e+07 2.920295e+07 1.383522e+05 2.317690e+07 3.234986e+07 4.782537e+07 26919.847 2.161954e+07 2.723385e+07 2.557065e+07 3.456643e+04 2.533542e+07 2.856344e+07 3.423531e+07 224036.78 2.966630e+07 2.779596e+07 2.724154e+07 1.691777e+05 2.764948e+07 2.975756e+07 3.428894e+07 2.124780e+05 2.741445e+07 2.740973e+07 3.884248e+07 2.619802e+05 2.476686e+07 2.199837e+07 3.258929e+07 3.609348e+07 1.430423e+07 1.429853e+07 4.023826e+07 3.091623e+07 5.034648e+07 3.752295e+07 9.013521e+07 9.937518e+07 9.796495e+07 6.638560e+07 8.903504e+07 2.729971e+07 6.845299e+07 3.097083e+07 4.579915e+07 2.644944e+07 1.207239e+07 7.162493e+07 3.978133e+07 5.802159e+07 6.528641e+07 9.458220e+07 4.855087e+07 8.782553e+07 1.146238e+07 5.217243e+07 2.089857e+07 2.926986e+07 2.742477e+07 1.092809e+08 8.410073e+07 2.364331e+07 2.602275e+07 5.644967e+06 2.705361e+07 1.538544e+07 4.334247e+07 9.882766e+06 3.205608e+07 2.313852e+07 6.678984e+07 2.521242e+07 1.618213e+07 5.005145e+07 9.029675e+06 3.301358e+07 2.739812e+07 2.929622e+07 3.318451e+07 1.755319e+07 5.100841e+06 1.406110e+07 3.010259e+07 1.730399e+07 1.959542e+07 3.468591e+07 2.391502e+07 4.632713e+07 4.195064e+07 5.190497e+07 2.294941e+07 2.801958e+07 4.119694e+07 2.539881e+07 4.614310e+07 2.018352e+07 3.130867e+07 3.399565e+07 2.444445e+07 5.704807e+07 5.249945e+07 7.763219e+06 2.258614e+07 3.163403e+07 3.851826e+07 1.906756e+07 1.486489e+07 1.957903e+07 8.472320e+06 3.702400e+07 9.259010e+06 7.347741e+07 8.444400e+07 4.049938e+07 6.709009e+07 4.636716e+07 1.483170e+07 2.737287e+07 3.992764e+07 3.969132e+07 2.727195e+07 1.504065e+07 3.362978e+07 1.614427e+07 2.589160e+07 1.243762e+08 4.830643e+07 3.106068e+07 3.794887e+07 3.669645e+07 1.968071e+07 2.309034e+07 6.254565e+07 3.728010e+07 1.045331e+07 4.974123e+07 2.606322e+07 5.603023e+07 2.696839e+07 2.792952e+07 2.495664e+07 3.149369e+07 7.312184e+07 2.874954e+07 1.064588e+07 1.727677e+07 2.517212e+07 3.492136e+07 3.622801e+07 2.291028e+07 4.921310e+07 2.899817e+07 3.755227e+07 4.787640e+07 3.489585e+07 9.523971e+06 1.082728e+07 5.512163e+07 2.452829e+07 4.383768e+07 2.015323e+07 2.064838e+06 2.763510e+07 1.600703e+07 6.852384e+06 1.016759e+07 9.582205e+05 3.457036e+07 1.123373e+07 9.737079e+06 3.850006e+07 6.014638e+07 3.037036e+07 5.086930e+07 3.098425e+07 4.119045e+06 3.233976e+07 3.753264e+07 1.050708e+07 2.774998e+07 3.666068e+07 9.646144e+07 2.377067e+07 9.456749e+06 4.409775e+07 1.715287e+07 1.523430e+07 3.104803e+07 3.965785e+07 2.797887e+07 4.215728e+07 1.821715e+07 8.339596e+07 3.411754e+07 1.674789e+07 8.810470e+06 6.867087e+07 1.003357e+07 2.395378e+07 4.977805e+07 2.550888e+07 2.201607e+07 5.487052e+07 2.110179e+07 1.395594e+07 1.809963e+07 9.795781e+06 2.124894e+07 9.625831e+06 3.236282e+07 2.673541e+07 5.442291e+06 3.374049e+07 4.475224e+07 1.831770e+07 1.859330e+07 1.081044e+07 3.282053e+07 3.151683e+07 4.730685e+06 3.634991e+07 3.391061e+07 2.726229e+07 1.443480e+07 4.341367e+07 1.644165e+07 1.809800e+07 2.474804e+07 3.146214e+07 5.938441e+07 1.366401e+07 1.089970e+07 5.444181e+07 6.416104e+07 1.010439e+08 8.483492e+07 3.054255e+06 3.562457e+07 4.468195e+07 3.843009e+07 2.529380e+07 4.970363e+07 7.862657e+07 C8 H16 N8 O2_7.625 8.516726e+06 7.964367e+05 1.430819e+06 1.046985e+06 1.035453e+05 1.149805e+06 1.681312e+06 1.107778e+06 140107.64 1.012381e+06 1.427025e+06 1.093515e+06 136124.73 5.009899e+05 1.454073e+06 1.483987e+06 7.898013e+04 9.941050e+05 9.600437e+05 1.165841e+06 5.271121e+04 7.789028e+05 1.297255e+06 2.249946e+06 10048.483 6.683776e+05 1.108880e+06 1.029034e+06 1.438491e+04 7.681351e+05 1.105329e+06 1.429992e+06 97655.43 1.212175e+06 1.056475e+06 1.113356e+06 7.366530e+04 1.169288e+06 1.166823e+06 1.378080e+06 9.810332e+04 9.758987e+05 1.023258e+06 1.878685e+06 1.281747e+05 8.542174e+05 8.240539e+05 1.241945e+06 1.438341e+06 4.390608e+05 3.680511e+05 1.837538e+06 1.290238e+06 2.418954e+06 1.760085e+06 4.701462e+06 5.378955e+06 5.265566e+06 3.996611e+06 4.933907e+06 1.013580e+06 2.965087e+06 1.416098e+06 2.112184e+06 8.313862e+05 2.384030e+05 3.338150e+06 1.719512e+06 2.814273e+06 3.017088e+06 5.112699e+06 2.405517e+06 4.704193e+06 2.939215e+05 2.481712e+06 6.903362e+05 1.290554e+06 1.048357e+06 6.451363e+06 4.631881e+06 9.744898e+05 9.329032e+05 1.229862e+05 1.004260e+06 4.594848e+05 2.097815e+06 2.205143e+05 1.510744e+06 9.152914e+05 3.232598e+06 8.477169e+05 5.558499e+05 2.314718e+06 2.448488e+05 1.347896e+06 9.597757e+05 1.257251e+06 1.361318e+06 4.483565e+05 1.532366e+05 6.566142e+05 1.132185e+06 5.886080e+05 6.510618e+05 1.615408e+06 7.913688e+05 2.215056e+06 1.927684e+06 2.463455e+06 7.788770e+05 1.006045e+06 1.689207e+06 9.573887e+05 1.819799e+06 6.205602e+05 1.254361e+06 1.226176e+06 8.454779e+05 3.190586e+06 2.382426e+06 1.825390e+05 7.869668e+05 1.273289e+06 1.659344e+06 5.995815e+05 4.986612e+05 4.590915e+05 2.084669e+05 2.009008e+06 3.297515e+05 3.468606e+06 4.863660e+06 2.017904e+06 3.083645e+06 2.427865e+06 4.298596e+05 9.524523e+05 1.564940e+06 1.745796e+06 1.100718e+06 4.743992e+05 1.372072e+06 7.053804e+05 9.971126e+05 7.890848e+06 2.075137e+06 1.069416e+06 1.458243e+06 1.642438e+06 7.389999e+05 6.424184e+05 2.902109e+06 1.624766e+06 2.835031e+05 2.418803e+06 9.722696e+05 2.587024e+06 9.638077e+05 9.976010e+05 1.000164e+06 1.158764e+06 1.507533e+06 1.022706e+06 2.865170e+05 5.748249e+05 9.885994e+05 1.318952e+06 1.542166e+06 7.903675e+05 2.168493e+06 1.249747e+06 1.603938e+06 2.119534e+06 1.440301e+06 1.366334e+05 2.900369e+05 2.659178e+06 8.606848e+05 2.090922e+06 5.462092e+05 4.629515e+04 1.048130e+06 5.203354e+05 1.285805e+05 2.746291e+05 3.293258e+04 1.470116e+06 3.016786e+05 1.068454e+05 1.526218e+06 2.699922e+06 2.081693e+06 4.551969e+04 1.275347e+06 6.121051e+04 1.356044e+06 1.459900e+06 3.141357e+05 1.052202e+06 1.496536e+06 6.525529e+06 8.491406e+05 2.178911e+05 2.299508e+06 7.363941e+05 6.401782e+05 1.362947e+06 1.827860e+06 1.109623e+06 2.251322e+06 5.125274e+05 4.299152e+06 1.492386e+06 5.676193e+05 1.588434e+05 3.370655e+06 1.895671e+05 7.385842e+05 2.458302e+06 1.029750e+06 1.004316e+06 3.464016e+06 7.512110e+05 4.469321e+05 6.499766e+05 2.653763e+05 8.088786e+05 2.299443e+05 1.247187e+06 1.202887e+06 1.507390e+05 1.228817e+06 2.182123e+06 5.981709e+05 6.230573e+05 2.664280e+05 1.584793e+06 1.294688e+06 8.526902e+04 2.836244e+06 1.414013e+06 8.534021e+05 4.157386e+05 1.829204e+06 5.737159e+05 5.523880e+05 1.018508e+06 1.291357e+06 2.817445e+06 5.644165e+05 3.821308e+05 2.584276e+06 3.497644e+06 5.234849e+06 5.211887e+06 9.278140e+04 1.563242e+06 2.053988e+06 1.851817e+06 9.629166e+05 2.206018e+06 4.393568e+06 C2 H8 Cl N6 O2 P S_7.666 1.291599e+07 7.646055e+06 7.759263e+06 7.511131e+06 2.033277e+05 5.601284e+06 7.513456e+06 4.753888e+06 163395.02 8.758464e+06 7.778828e+06 8.288281e+06 245355.93 7.689299e+06 6.784365e+06 6.775766e+06 1.776072e+05 7.228899e+06 7.166227e+06 7.409732e+06 1.350070e+05 6.766865e+06 6.449621e+06 8.928458e+06 29524.115 6.789769e+06 6.598106e+06 7.164253e+06 3.215865e+04 7.837345e+06 7.178616e+06 7.469919e+06 220754.63 7.307327e+06 7.308654e+06 7.440459e+06 1.763897e+05 5.869540e+06 8.127472e+06 7.669601e+06 2.089585e+05 5.857364e+06 7.908249e+06 7.285716e+06 2.079278e+05 7.430813e+06 6.809854e+06 7.474048e+06 5.534356e+06 4.290403e+06 5.580006e+06 9.183893e+06 1.069640e+07 9.056386e+06 8.502119e+06 8.691811e+06 1.012228e+07 1.052175e+07 1.061515e+07 5.800940e+06 9.060730e+06 9.307907e+06 3.406263e+06 6.328238e+06 5.371148e+06 4.476047e+06 9.564266e+06 1.109682e+07 8.384190e+06 7.758960e+06 7.741614e+06 1.096384e+07 6.057562e+06 6.401433e+06 7.836085e+06 6.289149e+06 5.643687e+06 8.678638e+06 7.504927e+06 8.001592e+06 8.233262e+06 5.344593e+06 6.889879e+06 4.720126e+06 6.118606e+06 8.167446e+06 6.746228e+06 7.008498e+06 8.401225e+06 9.744525e+06 5.975253e+06 5.879222e+06 7.250342e+06 7.162614e+06 4.722842e+06 7.372861e+06 8.352407e+06 8.589987e+06 5.519548e+06 3.629106e+06 5.295847e+06 9.639529e+06 7.579059e+06 7.504145e+06 6.967014e+06 7.840597e+06 6.781622e+06 1.229038e+07 6.489926e+06 5.934406e+06 6.378289e+06 7.120917e+06 7.647866e+06 8.955520e+06 5.481305e+06 8.900471e+06 5.600738e+06 7.640079e+06 1.328231e+07 1.025062e+07 6.760790e+06 7.366264e+06 5.971058e+06 7.704231e+06 7.464323e+06 7.191823e+06 7.838015e+06 5.869787e+06 9.061115e+06 7.117910e+06 7.844642e+06 8.795505e+06 4.563395e+06 8.590482e+06 9.682719e+06 2.077539e+06 6.220771e+06 5.232325e+06 7.658033e+06 8.790845e+06 6.638202e+06 7.130144e+06 4.616977e+06 1.001117e+07 1.010211e+07 6.781154e+06 6.905512e+06 6.408045e+06 7.341098e+06 6.525425e+06 6.662563e+06 6.712212e+06 1.300871e+07 7.789557e+06 8.251849e+06 9.995280e+06 8.244939e+06 9.449222e+06 7.160201e+06 3.722802e+06 8.669310e+06 9.056074e+06 8.785212e+06 6.524507e+06 6.159179e+06 4.483970e+06 7.316590e+06 7.325836e+06 4.933796e+06 7.257879e+06 9.216624e+06 7.444888e+06 1.084543e+07 6.701249e+06 6.581057e+06 3.986535e+06 8.759486e+06 8.100968e+06 7.832076e+06 5.531614e+06 4.294824e+06 7.690681e+06 8.557165e+06 4.756524e+06 6.179494e+06 7.615429e+06 9.101890e+06 1.021443e+07 7.121759e+06 6.341349e+06 5.718947e+06 4.535956e+06 3.083686e+06 9.443675e+06 3.642696e+06 9.243522e+06 1.011725e+07 5.728423e+06 1.061252e+07 6.980173e+06 1.065087e+07 1.108201e+07 7.502713e+06 1.195464e+07 5.036916e+06 7.470341e+06 7.992979e+06 7.774045e+06 7.608617e+06 9.858093e+06 7.046288e+06 6.562997e+06 7.375045e+06 5.606059e+06 3.969539e+06 7.785386e+06 6.064434e+06 4.454587e+06 6.507379e+06 6.741302e+06 3.754841e+06 1.113400e+07 5.845479e+06 4.522266e+06 7.651332e+06 2.637063e+06 7.652752e+06 7.331255e+06 8.317173e+06 1.159525e+07 7.889102e+06 5.047361e+06 8.659410e+06 7.164950e+06 6.100949e+06 6.886498e+06 1.525210e+07 1.004661e+07 1.331365e+07 4.276873e+06 1.111389e+07 6.229921e+06 5.870091e+06 1.163452e+07 7.496772e+06 8.522117e+06 9.274317e+06 5.501131e+06 7.704505e+06 4.169742e+06 1.078054e+07 1.201610e+07 8.884682e+06 6.507536e+06 9.029149e+06 2.977418e+06 1.331920e+07 1.142933e+07 1.154928e+07 9.379865e+06 7.538514e+06 6.589705e+06 C10 H11 N O2_7.667 1.208996e+06 1.037398e+06 1.244839e+06 1.005195e+06 1.643962e+05 1.313667e+06 1.058107e+06 9.445795e+05 146882.53 1.217258e+06 1.341111e+06 1.084412e+06 200253.64 1.198139e+06 1.151933e+06 1.178018e+06 1.250726e+05 1.080168e+06 1.039338e+06 1.134923e+06 1.012881e+05 9.842184e+05 1.358509e+06 1.306299e+06 21298.183 1.032037e+06 1.136799e+06 1.143688e+06 2.448550e+04 9.908946e+05 1.154358e+06 1.219852e+06 156699.67 1.116498e+06 1.156238e+06 1.047578e+06 1.244954e+05 1.211799e+06 1.139012e+06 1.113663e+06 1.576994e+05 1.129354e+06 1.193675e+06 1.174678e+06 1.798071e+05 1.160459e+06 9.459370e+05 1.256373e+06 7.717855e+05 2.173078e+06 1.787256e+06 1.234732e+06 1.878342e+06 1.593496e+06 1.691559e+06 2.374793e+06 3.545215e+06 2.598896e+06 1.618530e+06 1.315910e+06 2.511595e+06 1.644113e+06 6.736388e+05 1.238410e+06 2.031722e+06 1.028802e+06 1.645568e+06 6.447123e+05 7.108664e+05 1.935363e+06 1.118310e+06 1.888604e+06 1.682551e+06 9.532565e+05 1.107307e+06 8.347264e+05 1.287091e+06 8.454345e+05 1.396568e+06 8.863853e+05 1.056851e+06 1.184729e+06 1.078129e+06 5.337344e+05 1.153682e+06 5.344564e+05 5.418759e+05 1.603614e+06 2.029151e+06 4.261289e+05 8.006441e+05 4.447758e+05 1.742861e+06 7.216588e+05 4.777135e+05 1.052305e+06 1.618199e+06 1.056054e+06 1.437036e+06 3.694878e+05 4.674104e+05 6.120747e+05 4.703231e+05 9.217877e+05 7.424762e+05 1.248271e+06 1.593397e+06 1.100433e+06 1.818602e+06 2.874023e+06 8.418491e+05 3.110349e+06 9.883770e+05 1.635845e+06 1.512012e+06 9.530868e+05 2.207697e+06 5.229061e+05 5.901692e+05 1.543548e+06 1.113472e+06 1.011739e+06 1.088557e+06 1.656623e+06 1.420607e+06 1.299898e+06 1.679607e+06 4.520142e+05 8.120816e+05 7.375164e+05 4.580298e+05 1.474423e+06 8.007765e+05 1.175276e+06 9.302526e+05 1.557433e+06 1.934772e+06 1.027596e+06 1.541953e+06 7.020980e+05 5.816258e+05 2.536675e+06 1.109310e+06 1.038314e+06 1.946185e+06 1.058893e+06 1.034278e+06 1.333410e+06 2.798904e+06 1.274031e+06 5.336480e+05 9.793514e+05 1.411755e+06 2.060768e+06 1.067243e+06 1.260250e+06 1.468912e+06 8.696182e+05 7.165863e+05 8.118288e+05 1.789250e+06 9.878895e+05 8.102041e+05 1.800844e+06 6.483675e+05 7.432167e+05 5.905333e+05 1.427461e+06 4.658545e+05 1.702600e+06 1.546944e+06 1.107354e+06 1.805359e+06 6.629999e+05 1.352725e+06 8.339826e+05 2.049486e+06 1.120135e+06 7.302897e+05 1.032346e+06 2.897002e+05 1.255271e+06 7.810720e+05 1.121906e+05 5.838268e+05 4.702207e+05 4.629514e+05 1.231777e+06 1.192227e+06 6.835766e+05 5.093142e+05 1.481903e+06 2.058918e+05 6.025090e+05 6.446247e+05 7.380085e+05 2.348393e+06 1.407667e+06 2.074750e+06 9.280199e+05 1.194640e+06 1.031463e+06 2.795760e+06 1.392359e+06 1.700922e+06 1.078709e+06 1.310583e+06 2.094271e+06 8.581891e+05 7.371728e+05 1.039992e+06 8.346702e+05 9.539928e+05 9.592320e+05 1.142954e+06 1.608534e+06 6.088793e+05 7.952740e+05 1.013874e+06 7.805188e+05 7.628929e+05 5.706791e+05 1.477141e+06 4.375031e+05 6.341307e+05 7.498883e+05 1.174346e+06 5.738091e+05 1.391601e+06 1.031384e+06 1.914288e+06 5.686617e+05 1.764529e+06 1.596299e+06 1.064434e+06 1.406241e+06 2.460723e+06 1.086847e+06 1.581309e+06 3.265055e+06 2.140856e+06 1.314303e+06 1.121554e+06 2.762458e+06 1.777887e+06 1.109633e+06 2.339975e+06 6.807341e+05 1.022259e+06 7.348034e+05 1.371517e+06 1.234069e+06 9.259741e+05 1.464023e+06 1.324034e+06 1.013035e+06 1.028271e+06 2.468411e+06 5.587740e+05 1.557053e+06 7.036185e+05 1.268979e+06 C4 H7 N_7.669 6.034422e+07 2.897243e+07 3.475752e+07 2.874089e+07 2.798722e+05 2.035475e+06 6.889878e+06 1.006616e+07 225947.79 2.974954e+07 2.742821e+07 2.604970e+07 285139.78 2.178078e+07 2.094026e+07 2.130490e+07 1.534076e+05 1.988922e+07 2.041961e+07 2.147174e+07 1.228762e+05 1.916508e+07 2.299076e+07 2.672274e+07 507711.169 1.945938e+07 2.090698e+07 2.081690e+07 1.107568e+06 1.965898e+07 2.187562e+07 2.349873e+07 856713.84 2.201698e+07 2.109666e+07 2.063954e+07 9.500649e+05 2.050380e+07 2.140069e+07 2.348351e+07 8.772286e+05 2.112560e+07 2.126517e+07 2.257119e+07 8.695244e+05 2.106305e+07 1.967465e+07 2.278392e+07 2.229057e+07 3.299056e+06 1.584295e+07 5.531613e+06 2.928841e+07 2.796839e+07 3.289791e+07 3.702501e+07 3.564177e+07 3.925510e+07 3.717536e+07 2.159074e+07 3.057928e+07 2.988901e+07 1.833862e+07 1.751590e+07 1.219137e+07 1.158179e+07 3.123353e+07 3.507167e+07 2.573946e+07 1.940641e+07 2.931202e+07 3.504177e+07 2.149491e+07 1.640048e+07 4.219075e+06 1.850092e+07 1.500733e+07 2.715298e+07 3.543024e+07 2.569799e+07 2.860672e+07 1.614165e+07 1.690160e+07 1.122276e+07 1.466855e+07 2.282743e+07 1.988004e+07 2.251242e+07 1.995155e+07 3.140141e+07 1.831985e+07 2.106386e+07 2.507477e+07 3.081488e+07 1.161191e+07 2.477582e+07 1.940912e+07 2.751175e+07 1.621099e+07 1.463850e+07 1.636038e+07 3.338132e+07 2.244373e+07 1.978787e+07 2.250324e+07 2.049639e+07 2.010973e+07 3.935338e+07 2.319426e+07 1.513461e+07 1.540327e+07 1.794305e+07 2.305161e+07 2.347499e+07 1.418500e+07 3.545077e+07 1.368406e+07 2.079625e+07 4.174907e+07 3.363728e+07 1.711396e+07 2.160311e+07 1.781870e+07 2.415334e+07 2.064272e+07 1.629966e+07 5.174821e+06 1.647943e+07 3.040377e+07 2.156558e+07 2.812168e+07 2.954668e+07 1.268119e+07 2.539350e+07 4.097397e+07 4.229333e+06 1.617302e+07 1.888147e+07 2.124022e+07 2.835183e+07 1.961501e+07 2.054669e+07 2.303971e+07 3.292961e+07 3.691477e+07 1.632163e+07 1.945392e+07 2.351641e+07 2.301442e+07 1.557245e+07 1.951942e+07 1.629122e+07 2.635922e+07 1.992245e+07 2.427649e+07 3.918605e+07 2.704969e+07 3.254534e+07 2.060723e+07 1.322200e+07 2.110765e+07 2.255135e+07 2.722568e+07 2.416497e+07 1.688541e+07 6.638665e+06 1.734265e+07 1.960742e+07 1.631562e+07 2.398578e+07 3.121386e+07 2.561617e+07 2.756877e+07 2.178970e+07 1.934077e+07 1.214472e+07 2.455505e+07 1.970167e+07 2.196939e+07 1.552408e+07 9.840886e+06 2.353729e+07 3.930288e+07 1.597739e+07 1.387362e+07 2.090334e+07 3.285156e+07 3.018053e+07 2.387050e+07 1.501812e+07 1.538748e+07 7.350436e+06 2.159969e+07 2.708102e+07 8.561802e+06 2.916169e+07 3.343192e+07 1.455922e+07 2.705093e+07 1.813761e+07 4.133543e+07 1.960027e+07 2.140987e+07 4.374935e+07 3.830190e+07 6.782322e+06 2.588187e+07 2.624855e+07 2.050746e+07 3.850957e+07 1.475661e+07 2.947526e+06 2.073754e+07 2.064015e+07 1.486059e+07 2.251898e+07 1.608799e+07 1.014489e+07 2.053780e+07 2.645902e+07 3.918410e+06 3.553776e+07 1.512744e+07 1.207335e+07 2.038878e+07 1.036716e+07 2.046973e+07 1.606028e+07 2.199787e+07 5.369478e+07 2.417185e+07 1.299375e+07 3.418903e+07 2.120616e+07 1.691870e+07 1.735297e+07 6.627056e+07 2.749368e+07 5.066815e+07 4.823427e+07 3.688280e+07 2.484891e+07 1.401778e+07 5.590024e+07 2.583422e+07 2.555847e+07 3.255525e+07 1.564808e+07 2.320551e+07 1.884141e+07 3.745602e+07 4.128007e+07 2.907439e+07 2.242265e+07 5.265362e+07 1.222580e+07 5.415000e+07 3.397022e+07 3.909826e+07 2.489679e+07 2.516127e+07 2.221637e+07 PROLINE 1.431276e+09 7.276568e+08 7.827388e+08 7.180367e+08 1.662679e+05 7.777963e+08 7.647259e+08 6.675416e+08 1405710.18 7.991116e+08 8.406530e+08 8.306134e+08 1052535.53 7.262405e+08 7.472120e+08 7.760936e+08 8.661483e+05 7.013717e+08 7.307200e+08 7.644406e+08 6.959255e+05 7.016052e+08 8.030502e+08 9.038898e+08 25300.991 6.843859e+08 7.424157e+08 7.444004e+08 5.269513e+05 7.277058e+08 7.442832e+08 8.323344e+08 612140.12 7.488198e+08 7.266524e+08 7.401647e+08 4.649270e+05 7.488501e+08 7.695697e+08 8.004236e+08 1.756026e+05 7.358006e+08 7.759767e+08 7.923497e+08 5.351776e+05 7.210440e+08 6.950785e+08 8.087289e+08 7.642318e+08 5.623535e+08 5.177788e+08 9.535834e+08 1.051608e+09 1.058038e+09 1.114530e+09 1.317299e+09 1.227345e+09 1.396868e+09 1.333224e+09 7.369695e+08 1.121014e+09 1.051345e+09 6.397494e+08 6.005618e+08 4.409482e+08 3.733742e+08 1.119164e+09 1.300556e+09 9.213549e+08 7.072583e+08 7.179993e+08 1.196116e+09 7.474700e+08 5.806299e+08 8.274173e+08 6.614053e+08 5.491190e+08 9.338893e+08 1.239107e+09 9.188084e+08 8.239004e+08 5.676583e+08 5.762640e+08 4.005919e+08 5.206602e+08 8.082439e+08 7.041019e+08 7.939296e+08 7.265385e+08 1.083429e+09 6.461176e+08 6.185241e+08 8.444448e+08 9.043609e+08 4.015522e+08 8.810371e+08 7.079767e+08 9.327581e+08 5.637213e+08 5.177274e+08 7.545154e+08 1.264612e+09 7.635403e+08 7.091167e+08 8.145867e+08 7.541820e+08 6.795810e+08 1.444723e+09 8.303042e+08 5.512468e+08 5.360752e+08 6.320818e+08 8.187577e+08 8.386742e+08 4.759655e+08 8.405762e+08 5.031605e+08 7.277520e+08 1.558266e+09 1.263895e+09 5.537965e+08 7.402036e+08 6.569309e+08 8.644358e+08 7.158505e+08 5.997753e+08 6.218826e+08 5.993476e+08 9.689216e+08 6.572551e+08 1.011727e+09 1.009812e+09 4.269363e+08 8.760504e+08 1.306166e+09 1.359648e+08 5.498578e+08 6.402720e+08 7.955570e+08 1.005764e+09 6.763104e+08 7.304736e+08 8.022272e+08 1.115602e+09 8.986887e+08 5.901892e+08 6.673734e+08 8.695982e+08 7.237737e+08 5.531228e+08 6.431677e+08 5.546628e+08 9.510191e+08 7.260925e+08 8.819030e+08 8.659071e+08 9.884128e+08 8.079296e+08 7.256161e+08 4.097448e+08 7.563635e+08 8.685787e+08 9.469823e+08 8.419636e+08 5.848136e+08 5.251186e+08 6.260407e+08 7.368384e+08 5.704421e+08 8.632786e+08 8.942997e+08 7.464074e+08 1.000500e+09 7.537964e+08 7.415925e+08 4.246744e+08 8.756157e+08 7.107170e+08 8.075373e+08 5.547645e+08 3.548521e+08 8.494046e+08 1.348941e+09 5.682088e+08 4.650670e+08 7.419823e+08 7.790869e+08 1.088665e+09 1.359927e+08 5.159117e+08 5.242705e+08 6.443239e+08 8.541507e+08 9.454425e+08 2.901838e+08 8.649706e+08 1.182741e+09 4.991253e+08 8.669017e+08 6.526199e+08 1.268623e+09 6.976164e+08 7.442529e+08 1.367169e+09 9.432586e+08 9.523882e+08 9.258267e+08 6.184956e+08 7.684825e+08 8.324986e+08 5.295805e+08 6.186948e+08 6.545680e+08 7.625586e+08 4.971353e+08 8.562997e+08 5.403448e+08 3.380903e+08 7.237859e+08 9.477738e+08 5.158581e+08 1.140997e+09 5.090565e+08 4.449306e+08 7.167920e+08 3.748646e+08 7.129448e+08 5.656476e+08 7.779154e+08 1.303135e+09 8.101581e+08 4.419875e+08 1.246579e+09 7.534293e+08 5.868982e+08 5.628240e+08 1.520474e+09 9.794091e+08 1.173328e+09 1.046606e+09 1.309357e+09 6.287269e+08 4.809256e+08 1.256972e+09 8.684631e+08 8.872354e+08 1.175796e+09 5.424126e+08 8.091821e+08 6.898456e+08 1.216009e+09 1.454405e+09 7.922661e+08 5.729772e+08 1.190608e+09 4.529046e+08 1.251236e+09 1.205987e+09 1.356281e+09 8.729940e+08 8.591966e+08 7.922359e+08 C16 H21 N3 O7 S_7.675 5.178375e+06 1.214731e+06 1.485881e+06 1.582163e+06 2.137096e+05 1.669358e+06 1.574148e+06 1.090067e+06 161605.23 1.635427e+06 1.487706e+06 1.803238e+06 215686.92 1.222071e+06 1.559639e+06 1.585221e+06 1.019565e+05 1.475260e+06 1.343094e+06 1.418744e+06 7.942372e+04 1.322157e+06 1.587436e+06 2.032191e+06 17685.160 1.206845e+06 1.414634e+06 1.473898e+06 2.107118e+04 1.434823e+06 1.350209e+06 1.656893e+06 134610.12 1.434782e+06 1.393218e+06 1.409191e+06 9.421445e+04 1.445687e+06 1.586141e+06 1.542423e+06 1.184411e+05 1.486408e+06 1.554386e+06 1.660810e+06 1.399995e+05 1.353878e+06 1.113789e+06 1.711483e+06 1.405730e+06 8.742723e+05 7.121479e+05 1.937882e+06 2.800002e+06 2.316557e+06 2.511647e+06 2.977615e+06 2.991348e+06 3.069389e+06 3.349943e+06 1.716270e+06 2.998784e+06 1.929545e+06 9.888493e+05 9.558692e+05 5.052952e+05 3.389260e+05 2.233555e+06 3.302545e+06 1.902083e+06 1.475561e+06 1.349883e+06 2.818148e+06 1.233789e+06 9.772463e+05 1.732608e+06 1.139569e+06 7.940786e+05 1.647004e+06 2.355464e+06 1.816666e+06 1.519871e+06 8.150508e+05 8.613106e+05 5.294734e+05 7.881402e+05 1.542634e+06 1.142539e+06 1.887058e+06 1.514632e+06 2.407499e+06 1.185005e+06 7.459852e+05 1.641982e+06 2.125559e+06 3.319538e+05 1.918356e+06 9.497458e+05 1.882721e+06 7.787042e+05 6.612668e+05 1.298003e+06 3.168129e+06 1.609858e+06 1.449157e+06 1.629791e+06 1.577205e+06 1.161701e+06 3.937517e+06 1.784941e+06 7.889675e+05 8.229143e+05 1.117610e+06 1.727243e+06 1.613959e+06 5.527527e+05 1.571924e+06 7.611599e+05 1.531089e+06 4.504412e+06 3.219558e+06 8.562860e+05 1.341350e+06 8.921248e+05 1.880784e+06 1.337741e+06 9.526601e+05 7.998581e+05 7.836769e+05 2.272419e+06 1.174430e+06 2.071369e+06 2.097600e+06 4.771814e+05 1.985468e+06 4.295706e+06 3.116863e+05 8.057530e+05 1.215519e+06 1.472011e+06 2.249527e+06 1.072838e+06 1.424881e+06 1.572747e+06 2.690107e+06 2.685456e+06 1.074913e+06 1.012375e+06 1.842343e+06 1.061697e+06 9.450592e+05 1.171029e+06 1.039596e+06 2.080253e+06 1.561123e+06 1.857631e+06 1.991552e+06 2.315385e+06 1.676426e+06 1.300638e+06 4.737998e+05 1.633941e+06 1.255765e+06 1.918841e+06 1.488322e+06 8.263968e+05 7.631342e+05 1.237735e+06 1.414650e+06 9.583186e+05 1.749189e+06 2.412888e+06 1.346981e+06 2.067171e+06 1.529191e+06 1.098752e+06 2.936580e+05 1.879218e+06 1.088076e+06 1.701534e+06 7.190810e+05 2.939913e+05 1.716715e+06 3.726155e+06 5.894785e+05 7.204823e+05 1.517731e+06 1.408674e+06 2.153620e+06 8.878843e+05 6.463158e+05 8.096496e+05 1.210108e+06 6.049155e+04 2.182736e+06 1.526056e+05 1.758623e+06 2.729592e+06 7.282268e+05 2.353634e+06 1.223216e+06 3.625884e+06 1.351405e+06 1.540223e+06 3.779296e+06 1.815796e+06 1.313609e+06 1.871579e+06 1.337176e+06 1.514051e+06 2.481549e+06 8.139691e+05 1.052110e+06 1.099115e+06 1.522361e+06 5.657356e+05 1.686038e+06 5.821501e+05 3.146158e+05 1.653236e+06 2.063963e+06 6.062676e+05 2.408182e+06 7.829746e+05 4.313665e+05 1.401631e+06 2.275507e+05 1.372270e+06 7.929066e+05 1.614934e+06 3.344763e+06 1.847022e+06 4.883518e+05 3.391182e+06 1.468627e+06 1.070752e+06 8.972894e+05 5.738075e+06 2.274421e+06 2.957924e+06 2.337579e+06 3.780921e+06 9.008294e+05 6.981845e+05 4.297458e+06 2.109492e+06 1.739089e+06 3.064009e+06 7.316653e+05 1.659683e+06 1.091983e+06 3.537068e+06 3.714964e+06 1.617462e+06 8.144880e+05 3.840958e+06 4.022060e+05 3.512520e+06 2.986573e+06 3.756981e+06 1.854156e+06 1.944037e+06 1.417791e+06 C7 H11 Cl N8 O P2_7.675 5.082093e+06 1.711388e+06 1.721330e+06 1.744277e+06 2.059411e+05 1.906325e+06 1.590555e+06 1.632942e+06 155821.71 1.836423e+06 1.834501e+06 2.105391e+06 222479.11 1.561158e+06 1.896559e+06 1.686708e+06 1.506554e+05 1.830079e+06 1.591681e+06 1.705965e+06 1.102947e+05 1.602298e+06 1.908287e+06 2.123756e+06 24247.312 1.612825e+06 1.680282e+06 1.678200e+06 2.796775e+04 1.845243e+06 1.698976e+06 1.839808e+06 179639.89 1.695294e+06 1.768801e+06 1.647928e+06 1.260389e+05 1.821660e+06 1.858631e+06 1.735311e+06 1.613739e+05 1.723385e+06 1.765267e+06 1.880106e+06 1.793277e+05 1.820049e+06 1.618303e+06 1.790091e+06 1.777721e+06 1.229331e+06 1.191305e+06 2.255614e+06 2.857717e+06 2.412157e+06 2.388404e+06 2.882048e+06 1.933307e+06 3.023954e+06 3.225020e+06 1.757600e+06 2.996496e+06 2.275185e+06 1.023022e+06 1.374229e+06 9.690797e+05 7.655199e+05 2.480273e+06 2.407621e+06 2.130737e+06 1.730099e+06 1.536988e+06 2.550837e+06 1.610204e+06 1.375957e+06 2.105991e+06 1.654704e+06 1.189163e+06 2.161577e+06 2.424243e+06 2.307433e+06 1.917398e+06 1.391182e+06 1.333955e+06 9.804685e+05 1.185386e+06 1.916917e+06 1.561746e+06 1.729459e+06 1.733329e+06 2.683703e+06 1.754019e+06 1.250591e+06 1.907550e+06 2.080919e+06 7.449097e+05 1.943394e+06 1.767256e+06 2.381644e+06 1.128550e+06 8.748534e+05 1.426259e+06 3.078666e+06 1.929062e+06 1.762509e+06 2.065386e+06 2.079252e+06 1.527168e+06 3.517195e+06 1.962043e+06 1.174657e+06 1.237352e+06 1.589795e+06 1.955789e+06 1.971487e+06 8.635780e+05 1.984382e+06 1.154971e+06 1.811735e+06 4.137795e+06 2.840068e+06 1.285056e+06 1.650918e+06 1.328140e+06 1.937857e+06 1.508299e+06 1.556133e+06 1.418748e+06 1.156284e+06 2.305107e+06 1.470613e+06 2.476965e+06 2.112202e+06 8.948427e+05 2.299288e+06 3.101587e+06 5.677982e+05 1.127050e+06 1.610950e+06 1.901777e+06 2.738550e+06 1.544448e+06 1.708957e+06 1.544792e+06 2.046347e+06 2.681012e+06 1.575758e+06 1.374058e+06 2.141617e+06 1.318090e+06 1.322559e+06 1.560326e+06 1.441393e+06 2.316072e+06 1.841738e+06 1.992101e+06 2.250972e+06 2.465736e+06 1.914156e+06 1.591869e+06 7.447632e+05 1.863859e+06 1.627199e+06 2.409369e+06 1.831422e+06 1.244979e+06 1.075334e+06 1.494932e+06 1.786706e+06 1.220589e+06 2.002707e+06 2.519620e+06 1.741943e+06 2.289859e+06 1.854447e+06 1.805945e+06 6.107638e+05 2.688681e+06 1.632262e+06 1.975367e+06 1.024990e+06 6.866958e+05 2.033466e+06 3.037814e+06 9.253455e+05 1.162256e+06 1.846564e+06 1.856437e+06 2.874779e+06 1.455804e+06 1.205752e+06 1.252853e+06 1.292047e+06 1.408897e+05 2.542705e+06 4.595968e+05 1.803179e+06 2.856364e+06 1.126952e+06 2.476015e+06 1.530943e+06 2.619534e+06 1.785171e+06 1.830609e+06 3.219568e+06 1.989717e+06 1.993174e+06 2.082235e+06 1.675408e+06 1.708282e+06 2.781942e+06 1.302832e+06 1.284583e+06 1.591758e+06 1.846346e+06 9.136850e+05 1.789138e+06 1.132171e+06 7.153992e+05 1.638684e+06 2.260121e+06 9.151692e+05 2.566408e+06 1.223722e+06 7.471864e+05 1.713601e+06 5.072875e+05 1.582064e+06 1.203771e+06 1.705394e+06 3.375025e+06 2.076040e+06 9.180201e+05 3.172458e+06 1.543986e+06 1.515930e+06 1.439585e+06 4.427948e+06 2.389317e+06 3.097515e+06 2.151495e+06 3.321808e+06 1.437911e+06 1.234810e+06 3.299994e+06 1.944674e+06 1.982504e+06 3.005175e+06 1.134948e+06 1.910443e+06 1.613351e+06 2.741419e+06 3.233438e+06 1.995331e+06 1.238102e+06 3.157356e+06 6.538030e+05 3.449606e+06 2.640480e+06 2.915169e+06 2.227863e+06 2.239344e+06 1.589763e+06 230.12636_7.677 8.774867e+05 2.472091e+05 3.341577e+05 2.758787e+05 1.066429e+05 3.152114e+05 2.707886e+05 2.730712e+05 74901.62 3.363224e+05 3.223927e+05 3.277230e+05 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8.375901e+05 5.810534e+05 5.259855e+05 7.492313e+05 1.433269e+05 3.072417e+05 3.636495e+05 9.771399e+05 9.122780e+05 2.616184e+05 5.121457e+04 6.978949e+05 1.314981e+05 8.222666e+05 6.472491e+05 1.053659e+06 4.084922e+05 3.364476e+05 2.689568e+05 C8 H Cl N3 P_7.678 4.318196e+06 1.785033e+06 1.870229e+06 2.437383e+06 1.869652e+05 1.900522e+06 1.617419e+06 1.511027e+06 146290.48 2.291985e+06 2.347089e+06 2.162304e+06 218631.16 2.040108e+06 1.824011e+06 2.005480e+06 1.578175e+05 1.791182e+06 1.926815e+06 2.017970e+06 1.176919e+05 1.845966e+06 2.071725e+06 1.966719e+06 26262.548 2.051778e+06 2.083631e+06 1.824472e+06 2.949954e+04 2.002423e+06 1.739269e+06 2.156200e+06 179343.37 1.859134e+06 2.009377e+06 2.382056e+06 1.246438e+05 1.780856e+06 1.859581e+06 1.980133e+06 1.625596e+05 1.776136e+06 2.008213e+06 1.844376e+06 1.678437e+05 2.430780e+06 1.695540e+06 2.037692e+06 1.757611e+06 1.261026e+06 1.498941e+06 2.199547e+06 2.553332e+06 2.305099e+06 2.138511e+06 2.704503e+06 2.897622e+06 2.916257e+06 2.970594e+06 1.941412e+06 2.727091e+06 2.626508e+06 1.123587e+06 1.676347e+06 1.445349e+06 1.124813e+06 2.599626e+06 2.804090e+06 2.383347e+06 2.099633e+06 1.979572e+06 2.875851e+06 1.848326e+06 1.719623e+06 2.176676e+06 1.997121e+06 1.511814e+06 2.249892e+06 2.419173e+06 2.250013e+06 2.027663e+06 1.576832e+06 1.641207e+06 1.215940e+06 1.624962e+06 2.071306e+06 1.884935e+06 1.873216e+06 1.672679e+06 2.594335e+06 1.981195e+06 1.507333e+06 2.066730e+06 2.260550e+06 1.066775e+06 2.048388e+06 1.911771e+06 2.188066e+06 1.556168e+06 1.064879e+06 2.141888e+06 2.799804e+06 2.136356e+06 1.847832e+06 2.033093e+06 2.000330e+06 1.722681e+06 3.670709e+06 1.885922e+06 1.623319e+06 1.650050e+06 2.001592e+06 2.048506e+06 2.253731e+06 1.315879e+06 2.160758e+06 1.548358e+06 1.790532e+06 3.337579e+06 2.530380e+06 1.678532e+06 1.810660e+06 1.386763e+06 2.270917e+06 1.835707e+06 1.713515e+06 2.091726e+06 1.676549e+06 2.535102e+06 1.739962e+06 2.736018e+06 3.698668e+06 1.245984e+06 2.254011e+06 2.547398e+06 8.549411e+05 1.528088e+06 1.836445e+06 2.205356e+06 2.503987e+06 1.950380e+06 1.964730e+06 1.347718e+06 2.859596e+06 2.542536e+06 1.730115e+06 1.783108e+06 2.345364e+06 1.912561e+06 1.384843e+06 1.959376e+06 1.743453e+06 2.399211e+06 1.875565e+06 2.285003e+06 2.682242e+06 2.257365e+06 2.316263e+06 1.971931e+06 8.708763e+05 2.132072e+06 1.935615e+06 2.273703e+06 2.190601e+06 1.332041e+06 1.123410e+06 1.672964e+06 1.946585e+06 1.550846e+06 2.190990e+06 2.267894e+06 2.199724e+06 2.343133e+06 1.983460e+06 2.033023e+06 9.146520e+05 2.274101e+06 1.979817e+06 2.352302e+06 1.437873e+06 8.742658e+05 1.835600e+06 2.744149e+06 1.357544e+06 1.506153e+06 1.780186e+06 2.285009e+06 2.851482e+06 1.912322e+06 1.512036e+06 1.477239e+06 1.407216e+06 6.044501e+05 2.236958e+06 1.015003e+06 2.713678e+06 2.485875e+06 1.567347e+06 2.253436e+06 1.811687e+06 3.044292e+06 2.009050e+06 2.011402e+06 3.119401e+06 1.821711e+06 1.426538e+06 1.911686e+06 1.958020e+06 2.079281e+06 2.514216e+06 1.583201e+06 1.767499e+06 1.707553e+06 2.050172e+06 1.267444e+06 2.174164e+06 1.516182e+06 1.148041e+06 1.632198e+06 2.565806e+06 1.112411e+06 2.952204e+06 1.598039e+06 1.003906e+06 1.888307e+06 8.985040e+05 1.772140e+06 1.538530e+06 1.990472e+06 2.973230e+06 2.104988e+06 1.236251e+06 2.747550e+06 1.804954e+06 1.696656e+06 1.740804e+06 4.013553e+06 2.332673e+06 3.229970e+06 2.266403e+06 3.011049e+06 2.161389e+06 1.544964e+06 2.930826e+06 2.050159e+06 2.329521e+06 2.678345e+06 1.590123e+06 2.158884e+06 1.161727e+06 2.892899e+06 3.190446e+06 2.642388e+06 1.704217e+06 2.918113e+06 8.925815e+05 3.413442e+06 3.328500e+06 2.742442e+06 2.120168e+06 2.129448e+06 1.881578e+06 C9 H18 N2 O3_7.685 7.780453e+05 8.674774e+04 1.310846e+05 1.198523e+05 1.531536e+05 1.284069e+05 9.168012e+04 8.383823e+04 88054.25 1.821378e+05 1.108739e+05 1.046806e+05 137012.52 1.220669e+05 1.368096e+05 1.195723e+05 9.238643e+04 1.281105e+05 8.344699e+04 1.236943e+05 6.339707e+04 9.556895e+04 1.197610e+05 1.925242e+05 11862.101 7.985977e+04 1.032975e+05 8.137022e+04 1.544258e+04 1.276176e+05 1.403864e+05 1.279749e+05 95161.01 1.272760e+05 1.078372e+05 6.935111e+04 7.569713e+04 1.408110e+05 5.398243e+04 1.107908e+05 1.033175e+05 1.561465e+05 8.950794e+04 1.015968e+05 1.212046e+05 1.533799e+05 1.070981e+05 1.155656e+05 7.640228e+04 8.370941e+04 8.317045e+04 7.225843e+04 6.013392e+04 7.419969e+04 2.185825e+05 3.191585e+05 7.502627e+04 1.459809e+05 1.209006e+06 1.462460e+05 1.472838e+05 1.703148e+05 1.231541e+05 9.150958e+04 5.900723e+04 9.292912e+04 1.157530e+05 6.517978e+04 5.458760e+04 9.902151e+04 1.426577e+05 1.489771e+05 2.842707e+05 2.432515e+05 6.890575e+04 1.086425e+05 9.302719e+04 1.523566e+05 1.403589e+05 2.582529e+05 5.691410e+04 3.819201e+04 2.828606e+05 6.833316e+04 9.239502e+04 9.941836e+05 5.875908e+04 7.650955e+04 1.239267e+05 5.599105e+04 7.502550e+04 7.706222e+04 1.074000e+05 2.652559e+05 6.090971e+04 6.694686e+04 5.079895e+04 3.386097e+05 1.661388e+05 1.170640e+05 8.900833e+04 9.140315e+04 7.576308e+04 9.129511e+04 1.798466e+05 2.064785e+05 5.325930e+05 2.708937e+05 1.713039e+06 5.726792e+04 3.670147e+04 1.131514e+05 8.034878e+05 1.886894e+05 4.914822e+04 1.381741e+05 1.078597e+05 9.133879e+04 3.415584e+05 1.457434e+05 7.992111e+05 6.277093e+04 8.975825e+04 1.073325e+05 7.094494e+04 5.018473e+04 5.636207e+04 7.650736e+04 5.529021e+04 4.727473e+04 5.537939e+04 1.427940e+05 4.882234e+04 9.505018e+04 6.208436e+04 1.152075e+05 5.471625e+04 4.465378e+04 5.283487e+04 5.580035e+05 6.739926e+04 1.520467e+05 4.517968e+04 6.986412e+04 1.233596e+05 7.106250e+04 1.285457e+05 4.719928e+04 9.372976e+04 5.239068e+04 6.785883e+04 4.151591e+04 2.443987e+05 8.144297e+04 1.029514e+05 3.130585e+05 5.563975e+04 7.503841e+04 4.597360e+04 4.433811e+04 6.932612e+04 1.182002e+05 8.337589e+04 9.731814e+04 2.293832e+05 8.258470e+04 1.442680e+05 5.362961e+04 5.351357e+05 1.093465e+05 5.569845e+04 9.991836e+04 9.261848e+04 6.136403e+04 1.176177e+05 4.158537e+05 5.547520e+04 2.994214e+05 7.191456e+04 4.438300e+04 3.201309e+04 7.920098e+04 6.161748e+04 1.046065e+05 3.728588e+05 4.825555e+04 8.900665e+04 1.600851e+05 1.681983e+05 1.523390e+05 4.569240e+04 1.729738e+05 5.225811e+04 5.617736e+04 4.233531e+04 8.098049e+04 4.708731e+05 1.298192e+05 4.781298e+04 1.538096e+05 4.281626e+05 5.374675e+04 2.264117e+05 6.626810e+04 1.315778e+05 1.181586e+05 2.731277e+05 9.579035e+04 6.366959e+04 1.175192e+05 8.796614e+04 5.556783e+04 5.704176e+04 7.805970e+04 7.078842e+04 8.522766e+04 2.818364e+05 4.061017e+04 4.954923e+04 1.698949e+05 4.117570e+04 2.979719e+05 4.212217e+04 4.156181e+04 6.660813e+04 3.387000e+04 6.652779e+04 1.229586e+05 6.288444e+04 1.759565e+05 3.571638e+05 2.082453e+05 1.169857e+05 6.275729e+04 7.398754e+04 4.344694e+04 2.136239e+05 5.226655e+04 2.957239e+05 1.589876e+05 5.433270e+05 5.958994e+04 4.817426e+04 2.225925e+05 2.577428e+05 6.559459e+04 8.728977e+04 4.495086e+04 9.237555e+04 4.511383e+04 2.812154e+05 1.084232e+05 9.934507e+04 1.238026e+05 1.320692e+05 2.902193e+04 2.216542e+05 7.060489e+04 9.001031e+04 1.406924e+05 1.009764e+05 1.235390e+05 4-chlorobenzenesulfonylurea_7.701 2.407591e+06 1.196780e+06 9.378157e+05 8.225661e+05 1.204041e+05 1.067273e+06 7.907918e+05 8.848058e+05 109386.85 1.173898e+06 1.103213e+06 1.197283e+06 153824.59 9.827391e+05 9.548322e+05 1.027780e+06 1.200072e+05 8.873239e+05 9.649272e+05 9.923144e+05 8.228012e+04 8.369662e+05 1.108456e+06 1.202554e+06 14066.313 9.996768e+05 8.915771e+05 9.001940e+05 2.122796e+04 1.040318e+06 1.053139e+06 1.133126e+06 130487.44 9.266062e+05 9.740440e+05 8.938106e+05 9.780463e+04 1.034255e+06 9.776474e+05 1.207324e+06 1.261106e+05 9.054392e+05 1.102640e+06 9.071285e+05 1.275826e+05 9.347493e+05 9.523346e+05 1.091948e+06 9.065190e+05 5.023072e+05 1.677451e+06 1.722827e+06 1.452414e+06 1.299655e+06 9.485584e+05 1.363390e+06 8.708473e+05 9.381452e+05 1.347892e+06 6.228738e+05 1.575579e+06 1.236488e+06 1.081993e+06 8.610615e+05 7.150051e+05 2.057110e+06 9.429269e+05 5.178841e+05 7.600024e+05 1.426336e+06 8.254356e+05 1.194865e+06 8.282655e+05 7.950085e+05 9.826489e+05 1.131004e+06 1.242632e+06 6.043778e+05 1.286876e+06 1.387406e+06 1.670201e+06 7.591825e+05 3.491456e+05 1.597003e+06 4.550036e+05 5.960263e+05 1.077915e+06 1.699962e+06 8.746419e+05 8.370317e+05 7.826429e+05 1.779182e+06 1.118582e+06 7.666728e+05 9.884594e+05 1.061522e+06 1.009775e+06 8.791547e+05 6.629283e+05 4.458012e+05 1.049330e+06 6.716652e+05 5.868752e+05 1.081468e+06 1.816949e+06 1.924423e+06 8.763182e+05 8.274657e+05 5.668739e+05 1.213486e+06 8.046344e+05 4.833301e+05 8.352795e+05 7.079241e+05 1.269834e+06 1.870628e+06 1.244955e+06 1.389387e+06 1.184328e+06 5.787205e+05 1.479530e+06 1.996985e+06 7.021461e+05 5.792730e+05 6.052163e+05 5.832326e+05 1.973034e+06 1.321777e+06 8.891743e+05 1.290513e+06 1.180972e+06 1.219523e+06 7.440436e+05 9.163625e+05 5.976822e+05 8.231049e+05 8.518317e+05 4.864233e+05 6.437037e+05 1.534380e+06 5.547263e+05 5.474119e+05 6.796054e+05 9.145282e+05 1.282938e+06 1.245449e+06 1.156557e+06 7.545946e+05 1.204713e+06 1.091742e+06 7.043476e+05 1.329461e+06 1.082601e+06 6.620682e+05 7.259560e+05 1.714454e+06 1.289142e+06 1.945678e+06 1.595551e+06 5.363454e+05 8.902334e+05 1.370732e+06 3.688455e+05 1.050122e+06 1.506365e+06 6.259045e+05 1.274314e+06 1.056297e+06 6.627930e+05 1.254739e+06 9.857688e+05 7.670204e+05 1.703572e+06 7.489786e+05 7.580966e+05 5.440456e+05 2.063774e+06 1.347578e+06 9.399889e+05 1.422568e+06 2.767809e+05 5.885828e+05 6.594082e+05 4.378512e+05 5.721392e+05 7.050564e+05 1.508306e+06 1.203473e+06 1.733773e+06 1.405730e+06 2.801529e+05 7.032763e+05 1.266621e+05 6.815243e+05 4.962666e+05 8.206956e+05 1.354349e+06 1.215634e+06 7.734728e+05 1.390921e+06 1.059139e+06 1.509704e+06 7.314916e+05 1.209050e+06 5.406630e+05 9.358121e+05 1.379031e+06 6.969792e+05 1.817751e+06 1.776482e+06 1.559842e+06 1.254931e+06 6.105546e+05 1.063842e+06 7.145347e+05 1.046507e+06 5.167254e+05 4.707350e+05 9.827888e+05 1.937962e+06 1.075304e+06 1.017016e+06 1.867558e+06 1.313507e+06 9.834370e+05 9.134115e+05 1.456259e+06 6.622170e+05 3.702231e+05 1.348333e+06 1.157767e+06 1.304977e+06 9.714769e+05 1.263034e+06 3.162211e+06 1.876003e+06 1.322370e+06 1.000168e+06 5.383226e+05 1.533555e+06 1.270051e+06 1.220357e+06 7.290183e+05 1.298377e+06 1.005987e+06 1.695799e+06 1.449637e+06 1.646790e+06 1.626754e+06 4.986905e+05 5.161977e+05 1.881191e+06 1.150516e+06 1.328291e+06 2.384597e+06 5.168167e+05 2.053836e+06 1.005190e+06 9.208378e+05 6.712963e+05 1.486501e+06 1.537178e+06 N-METHYL-ALANINE 4.679487e+07 4.985610e+06 3.385595e+07 2.281194e+07 3.035640e+05 2.164833e+07 1.965361e+07 2.133252e+07 134665.70 2.358630e+07 2.266776e+07 2.218784e+07 196540.21 2.004768e+07 2.105673e+07 2.175179e+07 2.055994e+05 2.021108e+07 1.997023e+07 2.157317e+07 9.356157e+04 1.900733e+07 2.225565e+07 2.657552e+07 15942.047 1.867186e+07 2.087214e+07 2.052791e+07 1.595714e+05 2.060741e+07 2.056808e+07 2.301887e+07 164497.78 2.053828e+07 2.106582e+07 2.038053e+07 1.460097e+05 2.233171e+07 2.082786e+07 2.225989e+07 1.540054e+05 2.031447e+07 2.181684e+07 2.219430e+07 1.594939e+05 1.994909e+07 1.964338e+07 2.270835e+07 2.107789e+07 1.207669e+07 2.815707e+07 3.514343e+07 3.529042e+07 3.046968e+07 3.475615e+07 3.294273e+07 2.134616e+07 2.742851e+07 2.931352e+07 1.807780e+07 3.226126e+07 2.878438e+07 2.886568e+07 1.863741e+07 1.388390e+07 3.360425e+07 2.280458e+07 1.587597e+07 1.803022e+07 2.855456e+07 1.791952e+07 2.943480e+07 2.079410e+07 1.462352e+07 1.958015e+07 2.440354e+07 2.396064e+07 1.801033e+07 3.463909e+07 3.085480e+07 4.082496e+07 3.534529e+07 8.038010e+06 2.897866e+07 1.204003e+07 1.471323e+07 1.955666e+07 3.848373e+07 2.086239e+07 1.965453e+07 1.742654e+07 3.443785e+07 2.500446e+07 1.817405e+07 1.859251e+07 2.274510e+07 1.830404e+07 2.088373e+07 1.379637e+07 1.733761e+07 2.175082e+07 1.777302e+07 1.264312e+07 6.075173e+07 4.392368e+07 3.541832e+07 1.597050e+07 2.269394e+07 1.287035e+07 2.483586e+07 1.665260e+07 1.219908e+07 1.715891e+07 1.656063e+07 2.153794e+07 5.162211e+07 2.239267e+07 3.082029e+07 4.406611e+07 1.685387e+07 2.726082e+07 4.335660e+07 1.481007e+07 1.265003e+07 1.412877e+07 1.117407e+07 3.078347e+07 2.419745e+07 1.939125e+07 2.589741e+07 4.902745e+06 2.815706e+07 1.586808e+07 1.979778e+07 2.344734e+07 2.033218e+07 1.629106e+07 1.143938e+07 1.250552e+07 3.347009e+07 1.216995e+07 1.509958e+07 1.853892e+07 2.278398e+07 2.655376e+07 2.286758e+07 2.334206e+07 1.812998e+07 2.209547e+07 2.013190e+07 1.624143e+07 2.140533e+07 2.092621e+07 1.243607e+07 1.888342e+07 2.842619e+07 2.741092e+07 3.457689e+07 3.119566e+07 1.509820e+07 2.006479e+07 3.245133e+07 1.241323e+07 2.069792e+07 3.223889e+07 1.789698e+07 2.538376e+07 1.998349e+07 1.473307e+07 2.601994e+07 2.708215e+07 1.673282e+07 3.725225e+07 1.772454e+07 1.691418e+07 1.240142e+07 4.216104e+07 2.584746e+07 2.373359e+07 2.820269e+07 6.685018e+06 1.278692e+07 1.743615e+07 1.169276e+07 1.114478e+07 1.555883e+07 2.755312e+07 2.596215e+07 2.490177e+07 2.896542e+07 6.243728e+06 2.029566e+07 1.906520e+08 1.392005e+07 1.087219e+07 1.962596e+07 3.465965e+07 2.254769e+07 1.646501e+07 2.735401e+07 2.880551e+07 2.921293e+07 1.618255e+07 2.729728e+07 1.984267e+07 2.526702e+07 2.957586e+07 1.549003e+07 4.556678e+07 4.640457e+07 2.822074e+07 2.481804e+07 1.499358e+07 1.924682e+07 1.543681e+07 1.947695e+07 1.341936e+07 1.031936e+07 1.967638e+07 3.600599e+07 2.297518e+07 2.496202e+07 3.400541e+07 3.007604e+07 1.778215e+07 1.454905e+07 2.766522e+07 1.383087e+07 1.020182e+07 2.841177e+07 2.637921e+07 2.511253e+07 2.268539e+07 2.550161e+07 6.162193e+07 3.371006e+07 3.908521e+07 2.234606e+07 1.192325e+07 5.072353e+07 3.912386e+07 2.173233e+07 1.427821e+07 3.329703e+07 2.286887e+07 3.515633e+07 3.039529e+07 3.101938e+07 3.421077e+07 2.010686e+07 1.475332e+07 4.473119e+07 2.329698e+07 2.469849e+07 6.380765e+07 1.235756e+07 4.739779e+07 2.210443e+07 2.480452e+07 1.593467e+07 3.061308e+07 3.391636e+07 C14 H31 O P S_7.708 1.321851e+06 1.098365e+05 3.188712e+05 2.634117e+05 1.623835e+05 3.716099e+05 4.984571e+05 2.936096e+05 227461.28 1.283829e+05 2.778525e+05 3.673916e+05 341252.71 1.207840e+05 3.600998e+05 2.705427e+05 1.804033e+05 2.786223e+05 2.515695e+05 2.719597e+05 8.213192e+04 2.184315e+05 2.864410e+05 5.783205e+05 11943.105 1.546480e+05 2.463800e+05 2.543244e+05 2.062914e+04 1.868505e+05 2.854411e+05 3.615485e+05 133807.40 2.969557e+05 2.506268e+05 2.274568e+05 9.725764e+04 2.759123e+05 3.006262e+05 3.436172e+05 1.235766e+05 2.483183e+05 2.625378e+05 4.314152e+05 1.493386e+05 2.174379e+05 1.822398e+05 3.139490e+05 3.485313e+05 8.505717e+04 7.182223e+04 7.270829e+05 4.495567e+05 7.270378e+05 1.705062e+06 1.900933e+06 1.817233e+06 1.960779e+06 2.806139e+06 6.442624e+05 1.453955e+06 1.020189e+06 3.662150e+05 3.157536e+05 1.531417e+05 7.006691e+04 8.409090e+05 5.562385e+05 8.028643e+05 5.421426e+05 5.285212e+05 8.535445e+05 8.114657e+05 7.105015e+04 8.096841e+05 2.483046e+05 2.653316e+05 4.513772e+05 4.042351e+06 8.010000e+05 2.755433e+05 1.838987e+05 4.555515e+04 1.042443e+05 9.800131e+04 4.412717e+05 1.520031e+05 4.078583e+05 2.428707e+05 4.226437e+05 2.803337e+05 9.401144e+04 7.722115e+05 1.871395e+05 7.297211e+04 3.972595e+05 2.298488e+05 6.459338e+05 9.018381e+04 9.066098e+04 1.247640e+05 5.063771e+05 2.195540e+05 1.196254e+05 2.220208e+05 1.493108e+05 2.702841e+05 6.708406e+05 4.667549e+05 1.496980e+05 1.332177e+05 2.316105e+05 2.656185e+05 4.084639e+05 8.636558e+04 1.997228e+05 1.968687e+05 3.599566e+05 1.146507e+06 4.425725e+05 4.614142e+04 2.681372e+05 1.824073e+05 3.432292e+05 1.534325e+05 5.112842e+04 9.291013e+04 7.789904e+04 3.607838e+05 1.156139e+05 8.968399e+05 9.686825e+05 9.489462e+04 5.227555e+05 6.253257e+05 4.838743e+04 1.829749e+05 2.630211e+05 2.772990e+05 4.311988e+05 1.562432e+05 3.027396e+05 2.193701e+05 4.743061e+05 5.169509e+05 1.878522e+05 2.271356e+05 4.674940e+05 4.114757e+05 6.083064e+04 8.783177e+04 3.086039e+05 1.913918e+05 2.085232e+05 4.904172e+05 2.948454e+05 7.769095e+05 2.285761e+05 2.320461e+05 3.557529e+05 2.750177e+05 3.169617e+06 2.781162e+05 1.678570e+05 1.363953e+05 3.194147e+05 2.436312e+05 3.607444e+05 1.321029e+05 6.878060e+05 4.579523e+05 5.318468e+05 5.514018e+05 3.489941e+05 1.773411e+05 1.385383e+05 8.234481e+05 2.639277e+05 3.164264e+05 6.906547e+04 3.524513e+04 3.098007e+05 2.421840e+05 7.822679e+04 6.293092e+04 4.936425e+04 2.432174e+05 1.084517e+05 1.342812e+05 2.812886e+05 3.392380e+05 4.377884e+05 7.375136e+04 2.747647e+05 4.063580e+04 4.224622e+05 1.096702e+06 7.685925e+04 4.974349e+05 3.255174e+05 1.899201e+06 2.067553e+05 7.407974e+04 7.447576e+05 1.544118e+05 2.838517e+05 3.508788e+05 3.589967e+05 3.518756e+05 4.445267e+05 1.289537e+05 3.622329e+05 2.075611e+05 2.233575e+05 6.591211e+04 5.786410e+05 8.790809e+04 4.215530e+04 4.207299e+05 3.382570e+05 1.448155e+05 7.368879e+05 2.735729e+05 1.510463e+05 1.628333e+05 6.587825e+04 2.037631e+05 5.923945e+04 2.359138e+05 4.693621e+05 1.300128e+05 1.222089e+05 8.519366e+05 2.229314e+05 2.299746e+05 8.176652e+04 3.742680e+05 4.644666e+05 1.252595e+05 9.824130e+05 1.151648e+06 9.992509e+04 4.704213e+04 7.157092e+05 1.023781e+05 1.467475e+05 6.559418e+05 2.569628e+05 6.346819e+05 1.591377e+05 1.368235e+05 1.745476e+06 2.771014e+05 3.970768e+05 1.291396e+06 6.249845e+04 3.601825e+05 5.959019e+05 7.345004e+05 1.799983e+05 6.124709e+05 7.001579e+05 C7 H13 N O3_7.73 1.097852e+05 8.447202e+05 6.602663e+05 9.468309e+05 1.468198e+05 7.479111e+05 7.056039e+05 9.025910e+05 160324.76 8.969397e+05 9.855988e+05 9.229450e+05 186089.03 9.404718e+05 8.420872e+05 8.881085e+05 1.659915e+05 9.026498e+05 8.269845e+05 8.040294e+05 1.006424e+05 8.014174e+05 1.247645e+06 1.021922e+06 27065.952 7.964947e+05 8.008488e+05 7.601265e+05 2.585641e+04 8.762692e+05 9.532828e+05 1.051302e+06 156453.13 9.279627e+05 8.408617e+05 9.440299e+05 1.294042e+05 7.736591e+05 8.657450e+05 9.345507e+05 1.774819e+05 9.068417e+05 1.035674e+06 8.364496e+05 1.897189e+05 7.743388e+05 8.014296e+05 9.702686e+05 7.089861e+04 5.202361e+04 6.523005e+04 7.418209e+04 7.591007e+04 5.560477e+06 7.837362e+04 9.328893e+06 5.463465e+07 4.164608e+07 7.927495e+07 8.525891e+05 8.443176e+04 8.635102e+04 6.282018e+04 6.386746e+04 7.217287e+04 8.075014e+04 7.592615e+04 9.055171e+04 6.630129e+04 1.023957e+05 6.617800e+04 7.972375e+04 7.969151e+04 1.211816e+05 6.008407e+05 9.071297e+04 4.866093e+04 1.247747e+05 5.814562e+05 5.702093e+05 7.297543e+04 5.072331e+04 2.218442e+05 7.804826e+04 3.145916e+05 2.987483e+05 6.884931e+04 5.664212e+04 5.232905e+04 7.208181e+04 5.910904e+04 6.617881e+04 6.349598e+04 6.171240e+04 7.150832e+04 8.962124e+04 6.305568e+04 7.183662e+04 4.945845e+04 5.060492e+04 4.868356e+04 2.097207e+05 5.604658e+04 5.952633e+04 6.554477e+04 5.860679e+04 9.080039e+04 1.459270e+05 6.441769e+04 5.520320e+04 5.107965e+04 7.183523e+04 8.811183e+04 6.946405e+04 5.385032e+04 7.618450e+04 4.386338e+04 7.068559e+04 2.044027e+06 7.738705e+04 2.614316e+05 6.517680e+04 5.611482e+04 5.965224e+04 6.054031e+04 9.194291e+04 5.636030e+04 6.553883e+04 1.080509e+06 5.751637e+04 8.055015e+04 7.396969e+04 2.565996e+05 6.206286e+04 8.141741e+04 3.516005e+04 2.687361e+05 7.519828e+04 1.050877e+05 2.441547e+05 6.290535e+04 6.929509e+04 1.588828e+05 7.070724e+04 7.032551e+04 5.956219e+04 6.345959e+04 6.262270e+04 1.637815e+05 4.016762e+05 6.433391e+04 5.423117e+04 6.234153e+04 8.772412e+04 5.192336e+05 6.722468e+04 7.302646e+04 1.587619e+05 6.319172e+04 4.515491e+04 5.909147e+04 2.160179e+05 5.714774e+04 7.918392e+04 2.276252e+05 4.689979e+04 6.226928e+04 6.793947e+04 9.998316e+04 7.158401e+04 1.515198e+05 1.013732e+05 8.507331e+04 7.119515e+04 7.145649e+04 5.441449e+04 6.430229e+04 7.178157e+04 9.466731e+04 6.743563e+04 5.102760e+04 7.821682e+04 7.341894e+04 7.436956e+04 4.021560e+04 5.355679e+04 1.413717e+05 8.883139e+04 1.090201e+05 6.227485e+04 5.570627e+04 1.062032e+05 9.417907e+04 7.105285e+04 8.331529e+04 6.915075e+04 1.014841e+05 8.159334e+04 6.171164e+04 5.265337e+04 8.520443e+04 4.947320e+04 6.284352e+04 8.108463e+04 5.909297e+04 6.327334e+04 5.565199e+04 5.838017e+05 5.112104e+04 7.441012e+04 6.847216e+04 9.369941e+04 5.145700e+04 5.719086e+04 6.065203e+04 5.722842e+04 5.659083e+04 5.673757e+04 5.307074e+04 5.558666e+04 4.916263e+04 2.976686e+05 5.603516e+04 5.694604e+04 4.928224e+04 7.062392e+04 6.197563e+04 6.093334e+04 5.157813e+04 9.518877e+04 5.135955e+04 5.739974e+04 1.922105e+05 6.889437e+04 5.414544e+04 5.933022e+04 1.115391e+05 6.923895e+04 7.816823e+04 6.570404e+05 7.843096e+04 7.069202e+04 4.768483e+04 5.277800e+05 5.883911e+04 9.080515e+04 8.179057e+04 7.604336e+04 7.715542e+04 2.865559e+05 7.060724e+04 9.082441e+04 1.058714e+05 6.311864e+04 9.759815e+04 4.146446e+04 8.676305e+04 1.599349e+05 9.436090e+04 1.072490e+05 6.921097e+04 6.343057e+04 C10 H9 N O_7.739 2.079182e+05 4.675392e+05 4.513502e+05 5.139603e+05 2.175711e+05 4.855369e+05 4.273752e+05 4.057609e+05 301950.88 4.315977e+05 4.743231e+05 4.900350e+05 286624.16 4.932778e+05 4.555781e+05 5.384530e+05 2.057628e+05 4.330031e+05 4.034297e+05 4.601047e+05 1.573390e+05 4.250901e+05 5.237340e+05 5.314448e+05 23076.059 4.130374e+05 4.742099e+05 4.794414e+05 3.843474e+04 4.531969e+05 4.341255e+05 4.762176e+05 236490.22 4.445688e+05 4.130685e+05 4.562291e+05 1.823344e+05 5.117738e+05 4.540981e+05 4.938931e+05 2.413847e+05 4.741068e+05 4.877891e+05 4.444279e+05 2.763931e+05 4.628747e+05 4.062165e+05 5.001046e+05 2.333410e+05 1.279541e+05 2.289633e+05 7.314019e+06 5.934165e+05 7.945742e+05 3.731627e+05 2.051774e+06 4.370085e+05 1.090132e+05 1.271520e+05 2.204259e+06 5.502481e+05 2.158167e+05 1.047499e+05 1.042111e+05 2.411199e+06 1.381616e+06 1.528054e+05 1.649413e+05 8.931336e+04 1.705144e+05 6.348232e+06 2.096309e+05 6.963447e+05 1.162899e+06 8.202730e+04 1.264197e+06 1.205520e+05 1.214006e+06 3.114335e+06 4.752151e+05 1.597465e+05 6.321303e+05 6.943406e+04 5.567280e+05 9.449299e+04 1.671625e+05 1.229744e+05 1.880195e+05 1.381875e+05 1.243949e+05 1.969296e+05 3.333080e+06 1.339089e+05 9.906304e+04 2.099082e+05 2.550208e+06 1.658973e+06 9.272028e+04 3.043683e+06 1.148400e+05 7.888031e+04 1.275198e+06 7.408416e+04 4.466400e+05 1.519645e+05 2.330511e+05 1.479768e+05 1.097854e+05 7.700198e+04 4.164702e+05 1.138709e+05 1.579714e+05 8.367417e+04 2.882896e+06 4.035274e+06 1.174421e+05 7.813126e+04 4.306604e+05 1.345312e+05 1.056003e+05 1.206716e+05 1.028825e+05 7.161663e+04 8.110384e+04 8.451656e+04 7.175868e+04 1.041120e+05 9.729618e+04 1.051717e+05 1.029877e+05 1.137603e+05 4.731322e+06 9.606947e+04 1.195108e+05 1.042087e+05 7.715997e+04 1.552898e+05 7.590048e+04 7.886258e+04 8.202004e+04 8.746183e+04 9.700753e+04 8.112200e+04 1.235231e+05 1.459467e+05 9.543416e+04 3.722880e+05 2.154853e+05 1.400719e+05 8.021640e+04 8.287967e+04 1.409809e+05 7.002249e+04 6.481729e+05 7.019552e+05 1.560973e+05 1.093254e+05 1.683171e+05 2.231167e+05 3.869104e+05 2.479597e+05 3.037806e+05 3.664291e+05 1.728151e+05 2.181099e+05 9.203825e+04 2.082848e+05 2.038058e+05 1.316735e+05 2.228589e+05 3.975362e+05 2.981295e+05 8.786570e+04 1.224080e+05 2.353452e+05 4.102455e+05 4.129545e+05 5.970754e+05 1.335563e+05 6.553487e+05 1.079234e+06 1.468934e+05 1.116368e+05 4.233735e+05 3.538673e+06 1.102903e+05 1.977663e+05 1.651668e+05 1.477691e+05 9.717994e+04 8.691041e+04 1.479424e+06 1.419746e+05 7.233580e+05 7.120410e+05 2.700460e+05 2.408242e+05 1.646291e+05 9.661399e+04 1.085489e+05 1.718928e+05 1.394630e+05 1.456849e+05 1.396483e+05 1.581577e+05 1.739773e+06 1.038428e+05 1.850585e+05 7.972005e+04 1.471781e+06 3.316968e+05 1.149759e+05 7.557286e+04 9.946935e+04 7.644900e+05 9.151270e+05 8.269610e+04 1.116387e+05 1.331364e+07 3.319197e+05 1.241830e+05 1.378967e+05 1.240974e+05 1.688621e+05 8.043955e+05 1.294765e+05 1.410746e+05 7.394302e+05 1.416477e+06 2.103305e+05 4.800257e+05 8.794322e+05 1.344283e+05 2.274369e+05 4.242418e+05 8.250479e+04 1.306248e+05 1.233357e+05 1.140346e+05 4.254048e+05 1.654411e+05 1.109031e+05 4.613009e+05 1.968241e+05 1.227480e+06 2.027761e+06 2.376325e+05 1.308387e+05 8.658591e+04 5.159032e+05 1.784624e+05 1.451934e+05 7.511393e+05 3.175570e+05 1.314750e+06 2.672642e+06 3.462440e+05 1.230872e+05 1.493617e+05 9.679655e+05 1.200567e+05 2.125316e+05 L-CARNITINE 1.330913e+09 7.120624e+08 7.059993e+08 7.748996e+08 3.266103e+05 7.630779e+08 6.378330e+08 2.536341e+08 383492.47 8.889319e+08 8.341373e+08 7.769811e+08 361008.52 7.106606e+08 7.448291e+08 7.001786e+08 2.760771e+05 6.707750e+08 6.863108e+08 7.141914e+08 2.216451e+05 6.594148e+08 7.200687e+08 7.686971e+08 32853.097 6.747724e+08 7.069392e+08 6.840223e+08 8.152423e+04 7.052348e+08 6.935001e+08 7.332056e+08 299461.60 7.340879e+08 6.819064e+08 6.636850e+08 2.477388e+05 6.966251e+08 7.463827e+08 6.849769e+08 3.376278e+05 7.170879e+08 7.132834e+08 7.191185e+08 3.526445e+05 7.094949e+08 6.672688e+08 7.227991e+08 7.281954e+08 7.241559e+08 6.208023e+08 8.048419e+08 7.732398e+08 7.474501e+08 9.691431e+08 8.417531e+08 8.008343e+08 8.537707e+08 9.540062e+08 7.697840e+08 1.011387e+09 8.386300e+08 5.178131e+08 7.616747e+08 7.355026e+08 6.620671e+08 7.844930e+08 7.827350e+08 7.973763e+08 7.878213e+08 1.027345e+09 8.609855e+08 8.795260e+08 6.905560e+08 8.034869e+08 7.504441e+08 1.365609e+08 8.205849e+08 9.416176e+08 7.543239e+08 9.650725e+08 7.314960e+08 5.223136e+08 6.453886e+08 6.841895e+08 7.113912e+08 5.859914e+08 7.211427e+08 7.580978e+08 6.324712e+08 8.305522e+08 5.902117e+08 8.084106e+08 7.085123e+08 5.640270e+08 7.236864e+08 6.799934e+08 8.610936e+08 7.340385e+08 5.199831e+08 4.262980e+08 7.213009e+08 7.382642e+08 6.926682e+08 6.255783e+08 6.065871e+08 7.250997e+08 7.650965e+08 7.390766e+08 7.231731e+08 6.114477e+08 6.982498e+08 6.944548e+08 7.307406e+08 8.114803e+08 1.006688e+09 6.651423e+08 7.725757e+08 7.517842e+08 6.798398e+08 6.490144e+08 7.700354e+08 4.754036e+08 6.978117e+08 6.989637e+08 5.543515e+08 7.493377e+08 6.343659e+08 8.703887e+08 8.264723e+08 8.197016e+08 8.227789e+08 5.679781e+08 7.211127e+08 7.927338e+08 4.329320e+08 6.939088e+08 7.258380e+08 6.324769e+08 7.332346e+08 6.922457e+08 7.708184e+08 5.834208e+08 7.763537e+08 8.918206e+08 7.836830e+08 7.413601e+08 7.519402e+08 9.515674e+08 6.059886e+08 5.337873e+08 7.220826e+08 5.870845e+08 8.305518e+08 6.605272e+08 9.273676e+08 8.421222e+08 9.125868e+08 7.059148e+08 5.714404e+08 6.536747e+08 9.230923e+08 6.459991e+08 7.161063e+08 7.096742e+08 4.487126e+08 7.834160e+08 7.752877e+08 6.334365e+08 8.139121e+08 9.305420e+08 7.381877e+08 7.134476e+08 7.725159e+08 8.556410e+08 5.921550e+08 8.164418e+08 8.554679e+08 6.358830e+08 6.444261e+08 5.388543e+08 6.799473e+08 6.952334e+08 3.619354e+08 5.857262e+08 5.636094e+08 7.335086e+08 6.274650e+08 1.025700e+09 7.996681e+08 7.172079e+08 1.085841e+09 5.405379e+06 7.074704e+08 4.610335e+08 9.153476e+08 8.789832e+08 7.423913e+08 8.220627e+08 6.804069e+08 9.913119e+08 7.127820e+08 7.486341e+08 8.580271e+08 6.540236e+08 7.020209e+08 7.105922e+08 1.117671e+09 7.843260e+08 1.026642e+09 6.064747e+08 6.129298e+08 7.587977e+08 7.204191e+08 1.916440e+08 7.472000e+08 5.532789e+08 6.881439e+08 7.256927e+08 6.955312e+08 5.003366e+08 8.017867e+08 7.774195e+08 6.209250e+08 6.383041e+08 6.909612e+08 7.332270e+08 6.552575e+08 7.072829e+08 1.079657e+09 7.660793e+08 6.469940e+08 8.355964e+08 7.712294e+08 7.281020e+08 6.165056e+08 1.106781e+09 7.725720e+08 8.259832e+08 1.272954e+09 8.940965e+08 8.851199e+08 6.667668e+08 1.182010e+09 6.440912e+08 6.606494e+08 8.106388e+08 7.595527e+08 7.996895e+08 1.947627e+08 7.461912e+08 9.244151e+08 7.849616e+08 9.747962e+08 1.229029e+09 1.420695e+08 9.446735e+08 7.282537e+08 8.195347e+08 6.866801e+08 8.215317e+08 8.027574e+08 C9 H27 N10 O P_7.759 1.159147e+06 6.954017e+04 2.031718e+05 2.022183e+05 1.283196e+05 1.863505e+05 1.685270e+05 8.828990e+04 127142.93 1.328828e+05 1.866356e+05 2.688319e+05 120620.08 1.673482e+05 2.057845e+05 2.177805e+05 8.695318e+04 1.401700e+05 1.284144e+05 2.128810e+05 5.099045e+04 9.604200e+04 1.892867e+05 4.266464e+05 6155.652 1.002549e+05 1.341059e+05 1.555750e+05 1.329573e+04 1.454512e+05 1.792091e+05 2.793366e+05 85200.70 1.681336e+05 1.611187e+05 1.597314e+05 7.045368e+04 1.733579e+05 1.788719e+05 2.004284e+05 8.772538e+04 1.981487e+05 2.029562e+05 2.403102e+05 9.142810e+04 1.598561e+05 1.248600e+05 2.126848e+05 2.313026e+05 2.209055e+05 1.284797e+05 5.983856e+05 2.660440e+05 3.529876e+05 2.570156e+06 5.919659e+05 5.779753e+05 1.364382e+06 2.982015e+06 3.178226e+05 2.206310e+06 3.889528e+05 1.537666e+05 3.256270e+05 1.938403e+05 8.627690e+04 3.479954e+05 3.602734e+05 4.849543e+05 3.119034e+05 2.519788e+05 7.863856e+05 6.882321e+05 8.652279e+04 4.520185e+05 2.961104e+05 1.586081e+05 3.234617e+05 2.453654e+06 3.093291e+05 1.773445e+05 2.331524e+05 2.911269e+04 8.214446e+04 1.433363e+05 2.053124e+05 3.114173e+04 2.398746e+05 1.131791e+05 7.791159e+04 5.141555e+05 4.962090e+04 6.374381e+05 4.597061e+04 3.272777e+04 2.359786e+05 1.870100e+05 5.780309e+05 1.858337e+05 1.251842e+05 4.547911e+04 2.204277e+05 1.378738e+05 1.148094e+05 9.215106e+04 4.973352e+04 2.284601e+05 3.078947e+05 1.813881e+05 2.057586e+05 8.197248e+04 1.975515e+05 2.117731e+05 2.110497e+05 1.770482e+05 2.404297e+05 1.719484e+05 2.655083e+05 6.636507e+05 4.812969e+04 6.622133e+04 1.892182e+05 6.672260e+04 1.252467e+05 1.965375e+05 2.988140e+04 1.161217e+05 7.419007e+04 3.677635e+05 2.376699e+05 3.685986e+05 4.896970e+05 7.747742e+04 2.372933e+05 2.041304e+05 2.320600e+04 1.752439e+05 1.357372e+05 1.027839e+05 3.020655e+05 1.425275e+05 3.093612e+05 1.028894e+05 2.823759e+05 6.588333e+04 3.266459e+05 2.112245e+05 2.419007e+05 3.322247e+05 6.486473e+04 4.158279e+04 1.934873e+05 6.071496e+04 3.933166e+05 1.799797e+05 1.692316e+05 9.874078e+05 8.171561e+04 1.819263e+05 3.590125e+05 9.877440e+04 5.389983e+06 8.898823e+04 1.477402e+05 2.725135e+05 1.933116e+05 3.180865e+05 3.487565e+05 7.432096e+04 3.847143e+05 3.461706e+05 2.887343e+05 2.335208e+05 2.294227e+05 3.487583e+05 1.034333e+05 6.006520e+05 4.402185e+05 1.138193e+05 1.097863e+05 4.485602e+04 1.455539e+05 1.543181e+05 4.024604e+04 5.275863e+04 3.221982e+04 5.988585e+04 3.639529e+04 1.331541e+05 3.186392e+05 2.609751e+05 2.420445e+05 5.906945e+04 1.906249e+05 2.663059e+04 2.861820e+05 7.203826e+05 2.070567e+05 4.928215e+05 2.269922e+05 1.062709e+06 1.772647e+05 2.176471e+05 5.129955e+05 1.048428e+05 1.858618e+05 1.813907e+05 4.584157e+05 3.117476e+05 6.072757e+05 7.036940e+04 9.444964e+04 2.507498e+05 2.009281e+05 7.633841e+04 3.030723e+05 4.793203e+04 1.003112e+05 3.086798e+05 1.407463e+05 9.625727e+04 2.299775e+05 4.277816e+05 1.727092e+05 6.719375e+04 5.919504e+04 1.804113e+05 1.033688e+05 2.298974e+05 3.037361e+05 2.728300e+05 7.065704e+04 6.562282e+05 2.544098e+05 2.233343e+05 5.309965e+04 5.129518e+05 3.952022e+05 1.050233e+05 2.221186e+06 1.053560e+06 7.048752e+04 6.413822e+04 9.056593e+05 1.251233e+05 4.573857e+04 4.367119e+05 2.931128e+05 4.171507e+05 1.622332e+05 6.655015e+04 1.034570e+06 6.535199e+04 3.317592e+05 9.479927e+05 9.626207e+04 1.147752e+05 2.562259e+05 4.169705e+05 1.371270e+05 4.077846e+05 4.247926e+05 CREATINE (peak 2) 3.424855e+08 2.563668e+08 2.358907e+08 2.469283e+08 3.196937e+05 2.357428e+08 2.422233e+08 2.764196e+08 253083.27 2.534835e+08 2.646072e+08 2.607275e+08 279615.63 2.381837e+08 2.412533e+08 2.508568e+08 1.979923e+05 2.367281e+08 2.452860e+08 2.524591e+08 1.525918e+05 2.372500e+08 2.602338e+08 2.867857e+08 26051.766 2.335866e+08 2.453948e+08 2.384100e+08 8.408374e+04 2.452465e+08 2.499138e+08 2.630183e+08 204691.25 2.495347e+08 2.486072e+08 2.395548e+08 1.884992e+05 2.510881e+08 2.519527e+08 2.535304e+08 2.279662e+05 2.433442e+08 2.625645e+08 2.511675e+08 2.107660e+05 2.458646e+08 2.330313e+08 2.621242e+08 2.455410e+08 2.181309e+08 2.581778e+08 3.926576e+08 2.623697e+08 5.821385e+08 3.820397e+08 3.749985e+08 4.326044e+08 3.951756e+08 2.898513e+08 3.044791e+08 2.055847e+08 1.872216e+08 2.219892e+08 2.237140e+08 2.977717e+08 3.516887e+08 2.542554e+08 2.214005e+08 2.934679e+08 2.215259e+08 1.271874e+08 2.937062e+08 2.091922e+08 6.840172e+07 2.743167e+08 3.368327e+08 2.502748e+08 1.246946e+08 2.185236e+08 1.671054e+08 1.134654e+08 2.738013e+08 1.084851e+08 3.153168e+08 8.835932e+07 2.330986e+08 1.757202e+08 4.619087e+08 1.110950e+08 6.958930e+07 3.223842e+08 1.942179e+08 4.222087e+08 2.136053e+08 1.954192e+08 2.064421e+08 2.806205e+08 1.219956e+08 1.518141e+08 4.433999e+07 2.689678e+08 2.713155e+08 1.000346e+08 1.526631e+08 2.207688e+08 2.876236e+08 3.121302e+08 3.032732e+08 7.277099e+07 2.441842e+08 2.463366e+08 4.489208e+08 4.610152e+08 1.928566e+08 1.782415e+08 3.101714e+08 4.516477e+08 2.665489e+08 2.999021e+08 1.196509e+08 3.219360e+08 2.045062e+08 1.616207e+08 2.507251e+08 2.937018e+08 8.649211e+07 2.651313e+08 8.364866e+07 1.460889e+08 2.680516e+08 7.447181e+07 2.854013e+08 2.396357e+08 4.034791e+08 1.518963e+08 2.744037e+08 3.729108e+08 1.667765e+08 2.136425e+08 3.447644e+08 2.657055e+08 3.954060e+08 4.175177e+08 3.033807e+08 4.227068e+08 3.511419e+08 2.445228e+08 2.896894e+08 3.105496e+08 3.331076e+08 3.660260e+08 2.442693e+08 5.195242e+08 1.709339e+08 3.617576e+08 2.714300e+08 4.292210e+08 2.698678e+08 3.116948e+08 1.936190e+08 3.445614e+08 3.400342e+08 2.757127e+08 2.629716e+08 3.876787e+08 1.086219e+08 6.431460e+07 2.755893e+08 1.604667e+08 2.555698e+08 1.048485e+08 3.893457e+08 2.216938e+08 2.539713e+08 2.278627e+08 1.288474e+08 4.754392e+08 1.028009e+08 2.201368e+08 1.760512e+08 2.061071e+07 1.161673e+08 1.462280e+08 5.603754e+07 1.527193e+08 1.610396e+08 2.471559e+08 1.824329e+08 3.233867e+08 2.234267e+08 3.062270e+08 1.545632e+08 2.485614e+05 2.032229e+08 3.699653e+07 2.270080e+08 5.103920e+08 1.904852e+08 1.792291e+08 5.931909e+08 3.008780e+08 2.800685e+08 2.334895e+08 5.028534e+08 2.377546e+08 6.413644e+07 2.129447e+08 2.857175e+08 1.744029e+08 3.272720e+08 3.782734e+08 2.330870e+08 1.393442e+08 2.713703e+08 7.834825e+07 2.369725e+08 1.592342e+08 1.449863e+08 1.686878e+08 2.140997e+08 3.324828e+08 3.795409e+08 4.377549e+08 2.117177e+08 9.272305e+07 2.003743e+08 8.135641e+07 4.774806e+08 1.792308e+08 3.579090e+08 1.224152e+08 2.654235e+08 3.139847e+08 2.363912e+08 3.533583e+08 1.945625e+08 6.215181e+08 3.010703e+08 2.456771e+08 5.137289e+08 3.631151e+08 1.609258e+08 1.735460e+08 3.202514e+08 2.703594e+08 2.903115e+08 1.913866e+08 2.061048e+08 1.757939e+08 1.920461e+08 2.170259e+08 2.926631e+08 4.587823e+08 3.228626e+08 2.190119e+08 8.245957e+07 2.744399e+08 3.119422e+08 1.662532e+08 2.281147e+08 1.052139e+08 2.460825e+08 Dihydrothymine (2)_7.822 4.150726e+07 1.442222e+07 1.399656e+07 1.435783e+07 1.179214e+05 1.382733e+07 1.614478e+07 1.606443e+07 114888.04 1.465199e+07 1.503561e+07 1.576930e+07 120315.71 1.381162e+07 1.455201e+07 1.485077e+07 1.041103e+05 1.348582e+07 1.500598e+07 1.530919e+07 7.662366e+04 1.334876e+07 1.576296e+07 1.688385e+07 11075.874 1.338648e+07 1.449349e+07 1.454150e+07 2.624427e+04 1.435915e+07 1.491618e+07 1.525415e+07 105881.94 1.465998e+07 1.489926e+07 1.435433e+07 8.005401e+04 1.419098e+07 1.494217e+07 1.531061e+07 1.095683e+05 1.433840e+07 1.554575e+07 1.498263e+07 1.014339e+05 1.443949e+07 1.394269e+07 1.523062e+07 5.540570e+06 1.045646e+07 6.369983e+06 4.865365e+06 6.096054e+06 6.391623e+06 3.329127e+07 2.793200e+06 7.358488e+06 5.395158e+06 8.869268e+06 6.995229e+06 7.324455e+07 4.031030e+07 6.030268e+06 7.920354e+06 3.800366e+06 5.637086e+06 3.849649e+06 6.990986e+06 7.086431e+06 8.250061e+06 1.020056e+07 3.800347e+06 9.116073e+06 1.339527e+07 1.040915e+07 6.823627e+06 1.286483e+07 2.974454e+07 4.732342e+07 3.065108e+07 1.265097e+07 9.663665e+06 1.820434e+07 3.984269e+06 3.971283e+07 2.476022e+07 2.855395e+07 6.247603e+06 3.523036e+07 2.445169e+07 6.504109e+06 3.083582e+06 6.614801e+06 2.579200e+07 1.929709e+07 6.939656e+06 2.945641e+06 5.048289e+07 1.286738e+06 5.649493e+07 3.023340e+06 1.029598e+07 3.831839e+07 1.638321e+07 7.062748e+06 6.617187e+06 8.896926e+06 8.377261e+06 1.149085e+08 1.048292e+07 6.520982e+06 6.484800e+06 4.253089e+06 2.859620e+06 1.882927e+06 1.740275e+07 6.509328e+06 1.609471e+07 5.210731e+06 4.124811e+07 3.370168e+06 1.259848e+07 8.118311e+06 3.604498e+06 5.509882e+06 1.865456e+07 1.402844e+07 1.864234e+07 1.907989e+07 5.165778e+07 6.535088e+07 1.158081e+07 6.847581e+06 6.599858e+06 1.487431e+07 5.438240e+06 7.664254e+06 2.102819e+07 5.627864e+06 2.371758e+07 8.533351e+06 6.691194e+06 3.207945e+06 7.294504e+06 1.706024e+07 4.354540e+06 3.147008e+06 3.807320e+06 5.042441e+06 6.189032e+06 3.871568e+06 4.644523e+06 6.915689e+06 4.844023e+07 5.717633e+06 1.396005e+07 5.330783e+06 3.197060e+06 7.757010e+06 7.267326e+06 4.551281e+06 1.078336e+07 9.674116e+06 7.168114e+06 9.911218e+06 1.837331e+07 6.831095e+07 2.009215e+07 1.456259e+07 7.086881e+06 2.606895e+07 5.236184e+06 1.519273e+07 6.980428e+06 2.911017e+07 3.125998e+06 4.877267e+06 2.592250e+07 1.661695e+07 2.282221e+06 4.958815e+06 1.387198e+07 1.053921e+07 1.650640e+07 1.151439e+07 9.349718e+06 8.827211e+06 9.139413e+06 6.952515e+06 3.953711e+07 1.066468e+07 1.494263e+07 2.523670e+07 1.415360e+07 4.040326e+06 8.997997e+06 1.751327e+07 8.999871e+06 2.103853e+07 7.370302e+06 8.671636e+06 1.156840e+07 2.334519e+07 1.020026e+07 5.554199e+06 1.264017e+07 4.765168e+06 1.738118e+07 4.922463e+07 7.064635e+06 5.291948e+06 5.036023e+06 1.391166e+07 1.040850e+07 3.178379e+07 7.971710e+06 5.542827e+07 3.882987e+06 1.455550e+07 1.073149e+07 4.282004e+06 5.015464e+06 1.055216e+07 3.714513e+06 9.709100e+06 7.889971e+06 2.030186e+07 9.320245e+06 2.724970e+07 5.074341e+06 2.410408e+07 1.024009e+07 1.414156e+07 9.780715e+06 6.575453e+06 1.877447e+07 1.190448e+07 6.208964e+06 9.679500e+06 1.610068e+07 2.056643e+07 3.371219e+07 9.224752e+06 2.881265e+07 1.143442e+07 1.784675e+07 1.908033e+07 8.390068e+06 1.791097e+07 3.682428e+06 6.126799e+06 4.354782e+07 7.462942e+06 9.893655e+06 1.743990e+07 8.159982e+06 1.347500e+07 1.469388e+07 3.858940e+07 1.586079e+06 5.834589e+07 8.569134e+06 C6 H7 N_7.851 1.437117e+07 3.099161e+05 2.039411e+05 3.530681e+05 1.294976e+05 3.432456e+05 3.417025e+05 3.429745e+05 113760.12 3.029418e+05 2.659117e+05 2.999577e+05 117990.76 3.428403e+05 3.001270e+05 3.285125e+05 1.220144e+05 2.580314e+05 3.637070e+05 3.351070e+05 7.226165e+04 2.773987e+05 2.949412e+05 3.429936e+05 21108.428 2.813630e+05 3.016317e+05 3.335575e+05 3.465592e+05 2.805802e+05 3.429657e+05 2.966013e+05 351462.59 2.910935e+05 3.371660e+05 2.763735e+05 2.663797e+05 3.334614e+05 3.009366e+05 2.991851e+05 2.414156e+05 3.450711e+05 3.395337e+05 3.156787e+05 1.407284e+05 2.610398e+05 2.251857e+05 3.887004e+05 2.440233e+04 3.673020e+04 4.450386e+06 1.430015e+05 1.207557e+05 1.354631e+05 5.337571e+04 5.637578e+04 4.427798e+04 4.291192e+04 9.541534e+04 1.488069e+05 1.431748e+05 1.929167e+06 1.682774e+05 1.282029e+05 3.008446e+04 2.582746e+04 3.601729e+04 1.250096e+05 1.682490e+05 1.598080e+05 5.940422e+04 1.569111e+05 1.119240e+05 1.873907e+05 3.555321e+04 3.371339e+04 1.874351e+05 1.300438e+05 1.440521e+05 3.019670e+04 4.075469e+04 1.546959e+05 1.323263e+05 1.592505e+05 1.395752e+05 8.773677e+04 8.619872e+04 1.882500e+05 1.495980e+06 3.050111e+04 1.338163e+05 4.743686e+04 4.133288e+04 2.030611e+05 1.089645e+05 3.352492e+04 2.838153e+04 2.676564e+04 1.623558e+05 2.796107e+04 1.444387e+05 3.517180e+04 2.945463e+04 1.548130e+05 2.737197e+07 3.168142e+04 2.016640e+05 1.924907e+05 1.655171e+05 1.446476e+05 1.735621e+05 1.430180e+05 1.997702e+05 2.472274e+04 1.995035e+05 4.629360e+04 1.783280e+05 1.038992e+05 1.600710e+05 1.236182e+05 1.171871e+05 2.652431e+04 1.038256e+05 3.053277e+04 9.138888e+04 1.154327e+05 2.318828e+05 7.013427e+04 7.834522e+04 1.874395e+05 1.937455e+06 1.167292e+05 1.068718e+05 3.585814e+04 9.564304e+05 1.486180e+05 8.367935e+04 1.790637e+05 8.386570e+04 1.976441e+05 1.335206e+05 1.421398e+05 1.986942e+05 1.655466e+05 2.916176e+05 1.547447e+05 2.775814e+04 3.308947e+04 4.601364e+04 3.001030e+04 3.525605e+04 2.991186e+04 4.288044e+04 1.437068e+05 1.476550e+05 2.033665e+05 3.858598e+04 4.380623e+04 1.525278e+05 3.211707e+04 1.903958e+05 4.547181e+04 1.485305e+05 2.523500e+04 1.288039e+05 6.357259e+06 3.049570e+04 2.961195e+04 2.440648e+04 2.968561e+04 2.090741e+05 3.751974e+04 1.412940e+05 1.859562e+05 1.067822e+05 4.342416e+04 4.246292e+04 1.057709e+05 3.238340e+04 6.123908e+04 1.080234e+05 1.962160e+04 1.746316e+07 2.093482e+05 1.457324e+05 8.396536e+05 1.825817e+05 9.799807e+04 1.810739e+05 2.987223e+04 3.254944e+04 4.309813e+04 8.734529e+04 2.858591e+04 2.350897e+04 3.864752e+04 8.294573e+04 1.508168e+05 3.108528e+04 4.657532e+04 4.717952e+04 1.408479e+05 7.444454e+05 5.296047e+04 4.142189e+04 1.823327e+05 2.941204e+04 2.194139e+05 1.790253e+05 2.719521e+05 1.357567e+05 1.802372e+07 2.736808e+04 1.518898e+05 1.904625e+04 1.368073e+05 8.255207e+04 9.968127e+04 1.602795e+05 1.155299e+05 1.526560e+05 1.951446e+05 1.714105e+05 2.228516e+04 1.874912e+05 1.817279e+05 7.453293e+06 1.153225e+05 1.649564e+05 5.542941e+04 1.615418e+05 2.609001e+04 3.457689e+04 3.136765e+04 3.538654e+04 1.324734e+05 6.209638e+04 1.459688e+05 2.629726e+05 2.714323e+05 5.543137e+05 2.287133e+05 2.776451e+04 5.078950e+04 4.630653e+05 2.662357e+04 3.232954e+04 1.292741e+05 7.925034e+05 3.535813e+04 1.580040e+05 3.960766e+04 2.145000e+05 1.790899e+05 2.735427e+05 1.466927e+05 4.629962e+04 1.447140e+05 1.754003e+05 2.693913e+04 1.486666e+05 1.474355e+05 C4 H11 N O_7.852 1.870494e+05 5.986284e+05 2.360709e+05 5.009828e+05 1.221751e+05 2.027305e+05 4.729442e+05 3.632085e+05 104039.13 4.437358e+05 4.381929e+05 4.838163e+05 111682.05 3.039558e+05 4.204295e+05 5.494287e+05 2.067320e+05 2.758909e+05 3.877078e+05 3.821708e+05 7.888839e+04 3.776787e+05 3.895899e+05 4.342681e+05 109571.000 4.570528e+05 3.688087e+05 3.576679e+05 4.808686e+05 4.532128e+05 3.891449e+05 4.660157e+05 544213.95 4.085989e+05 4.043302e+05 3.382267e+05 9.302389e+04 4.161020e+05 3.891657e+05 3.927076e+05 1.122612e+05 4.502445e+05 4.048449e+05 3.682670e+05 4.402321e+05 4.081416e+05 4.649671e+05 3.721771e+05 4.644890e+05 4.435408e+05 2.316481e+05 2.983483e+05 2.380612e+05 2.890029e+05 2.306775e+05 2.961055e+05 6.184114e+05 3.811708e+05 4.045438e+05 4.287199e+05 2.188047e+05 5.085531e+05 3.785743e+05 3.835169e+05 4.424202e+05 3.091999e+05 2.536490e+05 4.397243e+05 4.929649e+05 3.002826e+05 3.196522e+05 1.254850e+06 2.993934e+05 4.276965e+05 2.472646e+05 3.419484e+05 4.023152e+05 4.909558e+05 2.598177e+05 4.924599e+05 2.293464e+05 3.845045e+05 3.001159e+05 5.776072e+05 6.108964e+05 4.771744e+05 4.035848e+05 1.103297e+06 2.759440e+05 5.252212e+05 2.405155e+05 5.482680e+05 2.479999e+05 5.618933e+05 4.566198e+05 2.976219e+05 3.691365e+05 2.829181e+05 3.111344e+05 7.160709e+05 1.708736e+05 2.175715e+05 4.837207e+05 2.644354e+05 3.219929e+05 1.099147e+06 2.172642e+05 2.967140e+05 3.422641e+05 2.608408e+05 2.249712e+05 2.913639e+05 1.665271e+05 2.572944e+05 4.335977e+05 2.550917e+05 2.106964e+05 2.119870e+05 2.186067e+05 3.737658e+05 2.409980e+05 3.350821e+05 2.107888e+05 2.141546e+05 2.616432e+05 4.020424e+05 3.377773e+05 3.054308e+05 2.409953e+05 1.814955e+05 2.016294e+05 2.520268e+05 2.439978e+05 2.495966e+05 3.314889e+05 1.965076e+05 2.670304e+05 2.814899e+05 2.197740e+05 2.075035e+05 2.524270e+05 4.261763e+05 2.601535e+05 2.578682e+05 4.324456e+05 1.879139e+05 2.220187e+05 1.910045e+05 3.102380e+05 2.826630e+05 2.805945e+05 3.672512e+05 1.550937e+05 3.241817e+05 3.454054e+06 2.514992e+05 4.734831e+05 9.836975e+05 5.231036e+05 1.970259e+05 1.079252e+06 3.347793e+05 5.303820e+05 2.198389e+06 3.373886e+05 3.646520e+05 3.224389e+05 6.630127e+05 3.860592e+05 3.236883e+05 3.193871e+05 3.239502e+05 3.803021e+05 5.889749e+05 3.064829e+05 4.048596e+05 3.474242e+05 5.115974e+05 1.628686e+06 1.060107e+06 5.709786e+05 3.095849e+05 2.640319e+05 6.515333e+05 6.101230e+05 3.257980e+05 3.529715e+05 3.324207e+05 5.152121e+05 2.402777e+05 2.966225e+05 6.893317e+05 2.247758e+05 3.502505e+05 2.031245e+06 4.084581e+05 1.357017e+05 2.238692e+05 3.409844e+05 1.298968e+05 2.381913e+05 4.197292e+05 3.185108e+05 2.219365e+05 2.466795e+05 4.579380e+05 3.161976e+05 4.351496e+05 2.886639e+05 2.570745e+05 2.057314e+05 1.583031e+05 2.048111e+05 1.900164e+05 2.256903e+05 4.250207e+05 3.035159e+05 3.702261e+05 2.142169e+05 3.052779e+05 7.615662e+04 4.748777e+05 2.774129e+05 2.345262e+05 3.217303e+05 4.143003e+05 3.553247e+05 2.144869e+05 2.912342e+05 2.281831e+05 2.453495e+05 3.339321e+05 2.630196e+05 3.425157e+05 2.589302e+05 3.440113e+05 4.312451e+05 3.878799e+05 1.473427e+06 3.768657e+05 1.658561e+05 5.111649e+05 3.483701e+05 2.343547e+05 2.569952e+05 3.076434e+05 3.160438e+05 2.363844e+05 2.010037e+05 1.737603e+05 3.542781e+05 2.527684e+05 2.171035e+05 2.650923e+05 3.774832e+05 1.115024e+05 2.071713e+05 3.346633e+05 2.607496e+05 1.957328e+05 2.173604e+05 4.653974e+05 N-METHYLGLUTAMATE 6.163082e+05 3.081436e+05 2.447361e+05 2.665313e+05 1.183419e+05 2.523632e+05 3.362193e+05 3.860681e+05 87117.10 2.766229e+05 2.992284e+05 3.277917e+05 96038.68 2.373851e+05 3.016923e+05 2.594653e+05 1.278606e+05 2.677606e+05 2.744409e+05 3.315838e+05 5.461600e+04 2.376367e+05 3.359149e+05 4.143885e+05 9120.774 2.176112e+05 2.867562e+05 2.751474e+05 1.624731e+04 2.840615e+05 2.935045e+05 2.987619e+05 93547.55 2.791701e+05 3.032031e+05 2.871062e+05 7.064358e+04 2.500882e+05 3.491117e+05 3.357105e+05 9.965680e+04 2.420031e+05 3.300785e+05 3.235881e+05 8.729358e+04 2.264845e+05 2.461133e+05 3.428365e+05 1.380823e+05 1.876730e+05 3.298722e+05 3.188373e+05 4.544117e+05 5.056588e+05 6.786071e+05 4.044657e+05 1.274082e+05 1.865036e+05 3.937548e+05 1.290203e+05 3.436228e+05 5.374893e+05 3.409119e+05 2.764917e+05 1.501237e+05 2.310149e+05 2.086927e+05 1.523136e+05 4.102171e+05 1.732249e+05 7.758003e+04 3.085616e+05 1.085645e+05 6.968473e+04 4.932389e+05 2.179868e+05 3.329261e+05 1.208494e+05 8.387919e+05 2.377728e+05 1.691402e+05 4.966627e+05 2.148273e+05 3.995279e+05 1.661322e+05 3.088283e+05 3.014781e+05 6.332506e+05 1.954653e+05 9.004074e+04 3.684087e+05 4.171470e+05 1.765259e+05 4.965025e+05 2.582900e+05 3.660680e+05 7.274490e+05 1.918220e+05 8.443085e+04 2.021999e+05 6.172756e+05 2.608005e+05 2.942345e+05 1.204214e+05 3.348526e+05 4.086319e+05 4.088447e+05 6.153231e+05 2.298514e+05 4.072660e+05 1.609943e+05 2.850192e+05 9.341279e+05 1.325683e+05 1.199635e+05 3.161493e+05 4.516699e+05 1.944524e+05 4.336832e+05 2.535300e+05 2.959341e+05 3.458074e+05 1.273925e+05 1.331529e+05 1.816611e+05 1.123095e+05 2.756770e+05 2.224990e+05 2.358285e+05 5.212906e+05 1.474721e+05 3.696183e+05 1.372142e+05 2.717482e+05 2.442892e+05 1.266811e+05 2.099142e+05 1.425809e+05 1.790760e+05 4.396318e+05 4.143408e+05 2.008142e+05 6.605173e+05 4.884573e+05 3.072666e+05 1.742039e+05 8.257355e+04 3.610434e+05 3.466096e+05 2.105353e+05 1.899487e+05 2.172400e+05 9.008248e+05 3.098472e+05 3.111048e+05 2.915785e+05 3.965715e+05 3.846907e+05 2.781061e+05 1.374970e+05 2.868366e+05 4.789999e+05 1.981100e+05 4.271023e+05 2.811554e+05 1.353145e+05 2.298747e+05 5.296520e+05 1.682554e+05 3.787311e+05 2.755721e+05 2.113020e+05 3.819831e+05 1.974235e+05 2.478492e+05 9.627352e+04 5.103227e+05 3.603856e+05 4.369424e+05 1.428663e+05 2.978546e+04 2.715379e+05 2.518651e+05 1.131055e+05 2.235724e+05 9.966640e+04 2.989962e+05 4.844702e+05 5.470110e+05 4.764656e+05 2.396832e+05 2.416504e+05 9.174930e+04 2.632616e+05 3.303143e+04 4.917778e+05 1.149775e+06 2.681333e+05 3.700257e+05 7.281292e+05 7.018495e+05 2.746243e+05 3.192443e+05 5.573508e+05 2.323526e+05 7.830331e+04 1.771961e+05 2.486167e+05 3.932406e+05 1.843734e+05 3.735497e+05 2.456348e+05 3.045336e+05 2.776850e+05 2.770154e+05 4.380680e+05 3.596501e+05 1.856805e+05 2.335275e+05 3.467227e+05 3.262224e+05 3.254321e+05 5.049804e+05 1.984355e+05 2.960285e+05 2.065187e+05 4.276899e+05 1.803690e+05 1.956084e+05 4.783257e+05 6.147829e+05 1.840670e+05 3.422456e+05 3.072273e+05 1.796650e+06 2.521709e+05 8.117362e+05 2.918946e+05 2.368348e+05 3.038179e+05 4.920015e+05 1.939653e+05 7.996997e+04 5.929981e+05 2.505007e+05 1.377234e+05 4.723220e+05 2.487703e+05 7.439212e+05 2.495712e+05 1.976645e+05 1.106062e+06 2.308398e+05 4.983429e+05 3.195789e+05 6.605507e+04 4.515358e+05 2.591059e+05 4.496988e+05 3.243524e+04 3.811163e+05 4.449796e+05 C10 H16 N2 O4_7.883 1.884959e+06 4.356767e+06 2.911708e+06 4.257675e+06 8.883330e+04 3.058856e+06 4.015252e+06 4.055007e+06 101333.55 3.657487e+06 3.846655e+06 4.071354e+06 96814.13 3.481280e+06 3.736171e+06 3.763535e+06 1.423639e+05 3.394378e+06 3.899694e+06 3.687721e+06 5.846436e+04 3.496371e+06 3.895532e+06 4.574021e+06 10704.338 3.715458e+06 3.305696e+06 3.729918e+06 1.667365e+04 3.269732e+06 4.028039e+06 4.000067e+06 90076.75 3.690582e+06 3.662002e+06 3.674247e+06 6.865630e+04 3.756106e+06 3.835078e+06 3.876113e+06 1.026345e+05 3.591932e+06 3.944255e+06 3.889233e+06 8.910373e+04 3.532469e+06 3.549480e+06 3.922798e+06 1.132475e+06 7.547961e+06 9.610912e+06 3.093102e+06 2.205326e+06 6.169969e+06 5.602494e+06 2.278436e+06 3.910741e+06 5.444185e+06 3.858095e+06 3.392283e+06 2.220800e+06 2.041081e+06 2.239168e+06 7.434129e+06 3.957636e+06 3.308528e+06 3.622951e+06 1.762957e+06 3.023602e+06 3.636801e+06 3.334483e+06 3.508374e+06 2.328680e+06 2.638464e+06 6.984624e+06 1.708987e+06 4.392863e+06 1.463746e+06 2.247572e+06 3.126096e+06 1.122964e+06 4.065707e+06 9.654900e+05 5.113440e+06 9.643115e+06 1.239750e+07 9.488933e+05 1.030682e+07 1.099784e+07 2.071358e+06 6.283505e+06 1.325914e+06 2.542990e+06 3.894106e+06 4.905842e+06 5.514947e+06 3.522558e+06 2.222434e+06 1.106992e+06 2.048554e+06 5.022484e+06 2.510781e+06 4.746815e+06 1.191241e+06 3.932484e+06 3.968471e+06 2.827018e+06 7.571058e+06 1.616568e+06 5.706823e+06 2.615067e+06 3.673566e+06 5.988565e+06 2.367244e+06 2.687821e+06 4.908717e+06 5.650141e+06 1.118959e+06 4.144544e+06 5.831256e+06 4.039093e+06 3.607688e+06 5.208996e+06 2.312529e+06 2.128802e+06 6.196171e+06 6.960347e+06 1.190046e+06 7.933882e+05 7.715686e+05 1.578012e+06 5.402613e+06 3.647714e+06 4.293567e+06 7.794329e+06 2.420876e+06 3.519655e+06 4.247920e+06 5.303755e+06 7.949673e+06 2.121802e+06 4.273816e+06 3.900997e+06 4.604695e+06 3.536867e+06 1.903224e+06 1.555736e+06 2.097980e+06 2.294422e+06 2.051757e+06 3.499195e+06 4.336856e+06 2.103539e+06 3.596708e+06 2.957532e+06 7.591128e+06 5.782784e+06 3.704601e+06 4.637450e+06 3.178489e+06 6.586012e+06 6.170907e+06 6.352895e+06 3.039857e+06 5.569656e+06 9.269794e+06 2.798374e+06 3.637928e+06 7.029680e+06 3.963135e+06 1.251275e+07 7.862347e+06 3.353769e+06 1.892087e+06 2.921030e+06 2.491539e+06 6.380555e+06 4.897487e+06 3.912892e+06 1.833706e+06 5.026892e+04 1.168711e+06 1.904488e+06 2.623839e+05 1.609491e+06 1.044834e+06 8.407911e+06 5.131178e+06 5.067065e+06 8.549112e+06 5.405601e+06 2.674424e+06 9.150796e+04 1.817403e+06 2.632572e+05 6.673464e+06 7.270900e+06 1.823999e+06 1.263854e+06 5.844106e+06 3.046972e+06 3.269255e+06 3.401656e+06 5.635606e+06 2.164030e+06 1.360879e+06 3.295449e+06 6.069278e+06 2.800753e+06 2.176312e+06 6.654373e+06 4.680800e+06 1.403486e+06 8.930475e+06 3.002649e+06 3.988735e+06 4.534090e+06 5.072260e+06 9.857600e+05 1.999708e+06 2.764212e+06 4.046940e+06 5.875704e+06 6.298809e+06 1.150619e+06 6.463605e+06 3.539558e+06 2.952109e+06 6.856854e+06 3.376657e+06 8.038993e+05 4.593345e+06 3.419070e+06 2.980370e+06 4.156531e+06 7.450164e+06 5.383065e+06 2.490575e+06 7.256575e+06 5.784472e+06 2.954683e+06 1.027988e+06 2.491289e+06 5.671626e+06 1.062322e+06 3.854137e+06 6.640967e+06 6.241891e+06 2.257998e+06 2.063208e+06 5.119929e+06 6.299484e+06 3.409643e+06 5.267985e+06 4.477149e+06 3.705662e+06 1.501662e+06 7.227555e+06 2.546159e+06 1.730626e+06 5.964509e+06 7.139863e+06 C13 H21 Cl N3 O9 P_7.884 1.489944e+07 6.881860e+06 3.720901e+06 7.552952e+06 8.175949e+04 3.816257e+06 7.681426e+06 5.349312e+06 90093.20 5.707188e+06 5.775826e+06 6.798726e+06 81369.50 5.618702e+06 5.364155e+06 5.968556e+06 1.158395e+05 5.547457e+06 5.783940e+06 5.731450e+06 4.628359e+04 5.540666e+06 6.281209e+06 6.547011e+06 8084.445 5.410596e+06 6.001090e+06 5.477545e+06 1.183967e+04 5.463153e+06 5.886051e+06 6.400612e+06 64100.32 5.952813e+06 5.823405e+06 5.813796e+06 5.119722e+04 5.243866e+06 5.886069e+06 6.191102e+06 7.523099e+04 5.673916e+06 5.961361e+06 6.621575e+06 6.619216e+04 5.059032e+06 5.628962e+06 6.024509e+06 7.133364e+06 6.718838e+06 5.001875e+06 5.758930e+06 5.688553e+06 5.275134e+06 1.072498e+07 3.802161e+06 5.021932e+06 4.735529e+06 7.629154e+06 6.251017e+06 1.167571e+07 1.179125e+07 9.881728e+06 5.604234e+06 2.718557e+06 3.626639e+06 4.097900e+06 9.064378e+06 4.634419e+06 3.072135e+06 5.082171e+06 2.696252e+06 5.545552e+06 7.035837e+06 6.790322e+06 5.851893e+06 6.567272e+06 1.029334e+07 1.430755e+07 7.261317e+06 6.482689e+06 4.800763e+06 8.363744e+06 4.070668e+06 7.202458e+06 6.526837e+06 8.094695e+06 5.507066e+06 6.482729e+06 8.147890e+06 5.288789e+06 2.576292e+06 2.158276e+06 9.504025e+06 6.454219e+06 5.587872e+06 2.091428e+06 9.751570e+06 1.592096e+06 1.121492e+07 2.671346e+06 6.826582e+06 7.695709e+06 8.704976e+06 4.796761e+06 7.151858e+06 4.181578e+06 5.863256e+06 7.198898e+06 4.429872e+06 3.405632e+06 1.867626e+06 5.363158e+06 3.651183e+06 1.495588e+06 1.060631e+07 2.209842e+06 1.291870e+07 4.575333e+06 7.711689e+06 2.375352e+06 7.533734e+06 1.577601e+06 5.069101e+06 2.943671e+06 5.796787e+06 6.401967e+06 8.857454e+06 1.002158e+07 1.104168e+07 1.536738e+07 4.652898e+06 3.067410e+06 2.801940e+06 9.920950e+06 1.805070e+06 4.066098e+06 7.746845e+06 5.252787e+06 6.756973e+06 9.411456e+06 3.503191e+06 3.916201e+06 4.908020e+06 3.674023e+06 2.445376e+06 3.591384e+06 3.757425e+06 1.940468e+06 2.562569e+06 2.108781e+06 2.069945e+06 1.887404e+06 1.071381e+07 3.365332e+06 5.177694e+06 2.765901e+06 2.889117e+06 3.152312e+06 2.773716e+06 4.374847e+06 1.390377e+05 7.441048e+06 7.601600e+06 5.848736e+06 5.398161e+06 1.123256e+07 6.565755e+06 6.335657e+06 4.040949e+06 1.027837e+07 3.575186e+06 4.553878e+06 7.656118e+06 8.953925e+06 1.805601e+06 3.639593e+06 7.931497e+06 7.367909e+06 2.673279e+06 5.507915e+05 7.382065e+06 8.790775e+06 3.868733e+06 5.878448e+06 6.259079e+06 7.833908e+06 3.690385e+06 8.028130e+06 5.994427e+06 5.113942e+06 6.506098e+06 6.676029e+04 1.025666e+07 1.607372e+06 5.581166e+06 9.231647e+06 5.167233e+06 8.032950e+06 5.552879e+06 2.797560e+06 6.262130e+06 5.526201e+06 4.938368e+06 2.629792e+06 5.643208e+06 2.251897e+06 7.264065e+06 7.309061e+06 1.624790e+06 4.347564e+06 2.567835e+06 7.658200e+06 4.652102e+06 4.426221e+06 4.282959e+06 7.718043e+06 3.831403e+06 3.152565e+06 6.014932e+06 1.170115e+06 3.334518e+06 4.513673e+06 1.669247e+06 7.089304e+06 4.015481e+06 5.229476e+06 5.906383e+06 5.829674e+06 9.376959e+06 7.535240e+06 5.824905e+06 4.756725e+06 4.362436e+06 2.860687e+06 8.141463e+06 7.203509e+06 6.588821e+06 3.775923e+06 4.836182e+06 1.183351e+07 8.657693e+06 3.466588e+06 1.005776e+07 7.039547e+06 3.906166e+06 7.090379e+06 5.031276e+06 9.729356e+06 5.597834e+06 6.282850e+06 7.658143e+06 5.475614e+06 3.993508e+06 9.700077e+06 1.981739e+06 7.281840e+06 5.100629e+06 1.496894e+07 3.443074e+06 8.592857e+06 5.818534e+06 CREATININE 4.007160e+08 2.220314e+08 1.757170e+08 2.316154e+08 1.695078e+05 1.680698e+08 2.359263e+08 2.185448e+08 301372.08 2.009316e+08 2.061523e+08 2.157152e+08 196659.16 1.952200e+08 2.052937e+08 2.069085e+08 2.876031e+05 1.985566e+08 2.066967e+08 2.061428e+08 1.177268e+05 1.946047e+08 2.155956e+08 2.337971e+08 55811.387 1.951911e+08 2.033459e+08 1.968157e+08 6.154100e+04 2.045471e+08 2.047581e+08 2.166977e+08 172141.25 2.111376e+08 2.025500e+08 1.975038e+08 1.359017e+05 2.069646e+08 2.074044e+08 2.110038e+08 2.029930e+05 2.038910e+08 2.099517e+08 2.118712e+08 1.793811e+05 2.067772e+08 1.935069e+08 2.129611e+08 2.304337e+08 2.239141e+08 1.832516e+08 2.147406e+08 2.090529e+08 1.936760e+08 3.850865e+08 1.687221e+08 1.922834e+08 1.907419e+08 2.825852e+08 2.102040e+08 3.726512e+08 3.950903e+08 3.769860e+08 2.060124e+08 1.377982e+08 1.585965e+08 1.814919e+08 2.887172e+08 1.733440e+08 1.443182e+08 2.067103e+08 1.368322e+08 2.113073e+08 2.306074e+08 2.284823e+08 2.126605e+08 2.199017e+08 3.330253e+08 4.957941e+08 2.469792e+08 2.355566e+08 1.916914e+08 2.900710e+08 1.678623e+08 2.466866e+08 2.213768e+08 2.668812e+08 1.936414e+08 2.284472e+08 2.663552e+08 1.896735e+08 1.529360e+08 1.181899e+08 2.886620e+08 2.117263e+08 1.907606e+08 1.183683e+08 2.957325e+08 1.082066e+08 3.761952e+08 1.296146e+08 2.380497e+08 2.477176e+08 2.684497e+08 1.966908e+08 2.457461e+08 1.764839e+08 2.183963e+08 2.372732e+08 1.786829e+08 1.528240e+08 1.115209e+08 2.015961e+08 1.588748e+08 1.092257e+08 2.905432e+08 1.186405e+08 3.718790e+08 1.697105e+08 2.667501e+08 1.359325e+08 2.325799e+08 1.098106e+08 2.171318e+08 1.574178e+08 2.109011e+08 2.051527e+08 2.669392e+08 3.144694e+08 3.302970e+08 4.875754e+08 1.873598e+08 1.456224e+08 1.408299e+08 2.994290e+08 1.131426e+08 1.596477e+08 2.825258e+08 1.964580e+08 2.319613e+08 2.821522e+08 1.407908e+08 1.470694e+08 1.780545e+08 1.481503e+08 1.279211e+08 1.623756e+08 1.604484e+08 1.259392e+08 1.421207e+08 1.186975e+08 1.202412e+08 1.213510e+08 3.388327e+08 1.583410e+08 2.121000e+08 1.414206e+08 1.399675e+08 1.418281e+08 1.455414e+08 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2.237120e+08 1.654550e+08 1.745517e+08 3.411539e+08 2.450944e+08 1.457294e+08 2.776716e+08 2.192870e+08 1.634850e+08 2.521443e+08 1.898762e+08 3.285419e+08 2.177274e+08 2.130925e+08 2.591722e+08 1.808881e+08 1.620656e+08 2.812545e+08 1.220372e+08 2.128173e+08 1.923100e+08 4.175898e+08 1.737575e+08 2.932673e+08 2.117832e+08 C6 H11 Cl O4 P2_7.886 3.574393e+06 2.604438e+06 1.624902e+06 2.446661e+06 8.519568e+04 1.725148e+06 2.375468e+06 2.260653e+06 103397.13 2.145359e+06 2.172571e+06 2.409936e+06 97175.45 2.028270e+06 2.113266e+06 2.050832e+06 1.478843e+05 2.171437e+06 2.239472e+06 2.149249e+06 1.264835e+05 2.058523e+06 2.172287e+06 2.268685e+06 11612.617 2.134787e+06 2.195319e+06 2.173727e+06 1.737752e+04 2.202181e+06 2.268664e+06 2.488228e+06 102045.17 1.782613e+06 1.818763e+06 2.269526e+06 1.247271e+05 2.180082e+06 2.230150e+06 2.345827e+06 1.082093e+05 2.059409e+06 2.265365e+06 2.158293e+06 9.345669e+04 2.020649e+06 2.266117e+06 2.124973e+06 2.181507e+06 2.210945e+06 1.847949e+06 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2.380982e+06 1.694489e+06 2.333970e+06 2.512328e+06 1.475935e+06 2.431659e+06 1.725010e+06 2.469149e+06 2.073580e+06 1.874463e+06 1.984595e+06 2.337327e+06 1.887097e+06 2.299453e+06 2.359471e+06 1.156303e+06 1.706551e+06 2.384927e+06 1.432202e+06 2.526503e+06 1.946612e+06 2.143219e+06 2.090401e+06 2.303705e+06 2.671314e+06 2.862303e+06 2.141171e+06 2.205044e+06 2.053630e+06 1.804342e+06 3.064608e+06 1.945476e+06 2.381575e+06 2.074404e+06 2.076283e+06 3.135648e+06 2.497309e+06 1.908625e+06 2.441802e+06 2.175768e+06 1.968678e+06 2.506528e+06 2.450102e+06 3.141743e+06 2.338410e+06 2.236776e+06 2.926264e+06 1.979967e+06 1.904643e+06 2.301487e+06 1.354912e+06 2.669606e+06 1.957201e+06 3.000472e+06 2.083496e+06 2.987444e+06 2.127713e+06 C6 H11 N O3_7.888 8.690512e+04 2.539578e+05 1.811637e+05 2.402567e+05 8.578194e+04 1.931248e+05 2.622155e+05 2.318811e+05 98405.28 1.899542e+05 2.544043e+05 2.606739e+05 92410.51 1.767800e+05 2.267544e+05 2.233107e+05 1.326551e+05 2.201866e+05 2.112668e+05 2.112805e+05 5.376008e+04 2.240123e+05 2.562751e+05 2.505044e+05 9969.698 2.142576e+05 2.105358e+05 1.972221e+05 1.575983e+04 2.394104e+05 2.236564e+05 2.455467e+05 85547.95 1.682016e+05 2.292019e+05 2.673921e+05 6.369282e+04 2.484863e+05 2.056251e+05 2.296819e+05 1.030760e+05 1.869433e+05 2.361044e+05 2.408420e+05 8.844132e+04 1.858843e+05 2.410484e+05 2.274494e+05 1.866248e+05 5.117986e+04 3.644656e+04 6.452618e+05 6.812710e+04 8.752645e+05 5.443908e+04 5.545358e+05 1.741951e+06 1.576357e+06 1.090771e+06 7.930832e+05 2.679078e+05 5.563257e+04 2.393825e+05 1.620208e+05 3.533847e+05 1.357539e+05 1.647981e+05 5.378724e+05 6.993967e+05 4.327298e+05 1.120732e+05 4.291118e+04 3.229856e+05 3.659863e+04 6.242835e+05 4.469764e+05 7.222526e+04 2.159149e+05 1.082604e+05 4.480466e+04 9.481357e+04 1.913687e+05 4.121199e+04 1.695877e+05 9.761790e+04 4.436186e+04 3.748947e+04 7.052164e+04 5.848445e+04 4.401631e+04 1.814246e+05 4.586009e+04 8.911295e+05 4.924744e+04 4.733437e+05 1.515534e+05 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2.197826e+05 5.206871e+04 1.574230e+05 2.053306e+05 5.327143e+04 3.829354e+05 4.131211e+04 6.536160e+04 3.833273e+04 5.158102e+04 3.269408e+04 4.247804e+04 3.442088e+04 9.010974e+04 4.351016e+04 5.727601e+04 5.908646e+04 1.361924e+05 4.155816e+05 8.450249e+04 7.006299e+04 4.303030e+04 1.661441e+05 5.085988e+04 2.480910e+05 7.441773e+05 5.753093e+05 9.045625e+04 6.025375e+05 5.735717e+04 1.445504e+05 4.612336e+04 3.807870e+04 4.788545e+04 5.301413e+05 6.402603e+04 4.797527e+04 2.353903e+05 6.393608e+05 2.326103e+05 4.034612e+04 4.311939e+04 2.282215e+05 6.806691e+04 4.182733e+04 8.610493e+04 4.080272e+04 3.450157e+04 1.593839e+05 4.430102e+04 3.205373e+04 9.423911e+04 7.512852e+04 5.108406e+04 4.489395e+05 4.593685e+04 1.875449e+05 4.188950e+04 3.186510e+05 5.629049e+05 1.147170e+05 6.406483e+04 3.843654e+04 1.383274e+06 3.780394e+04 3.098931e+05 4.366261e+05 4.923968e+04 4.623253e+04 3.114909e+04 8.358983e+04 5.640108e+04 1.661622e+05 5.219025e+04 1.176548e+05 3.295343e+05 4.676947e+04 5.188873e+05 1.857161e+05 4.005499e+05 1.293371e+06 9.786565e+04 4.993689e+04 4.491398e+04 6.902975e+04 6.610525e+04 1.017440e+05 1.566881e+05 2.193762e+05 C4 H11 Cl N8 O3 P2_7.891 2.464241e+06 1.296701e+06 8.420017e+05 1.402815e+06 8.945354e+04 8.763792e+05 1.459786e+06 1.205434e+06 100171.42 1.062465e+06 1.082935e+06 1.323349e+06 93627.39 1.091154e+06 1.145034e+06 1.145183e+06 1.361221e+05 1.198810e+06 1.111355e+06 1.074056e+06 5.686947e+04 1.125893e+06 1.271868e+06 1.274244e+06 10147.042 1.067844e+06 1.227044e+06 1.090553e+06 1.515316e+04 1.115408e+06 1.182268e+06 1.223104e+06 83929.00 1.152236e+06 1.120802e+06 1.083035e+06 6.390376e+04 1.205276e+06 1.225056e+06 1.127406e+06 9.691598e+04 1.125217e+06 1.290074e+06 1.240070e+06 8.516215e+04 1.009993e+06 1.025898e+06 1.282091e+06 1.350409e+06 1.365205e+06 9.955166e+05 1.287530e+06 1.113403e+06 9.239446e+05 1.861630e+06 9.718167e+05 9.263631e+05 8.754621e+05 1.674899e+06 1.339359e+06 2.031333e+06 2.029733e+06 1.931495e+06 1.196308e+06 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1.012915e+06 1.281906e+06 3.865095e+05 6.793190e+05 1.042014e+06 5.195406e+05 1.462725e+06 9.188143e+05 1.126436e+06 1.136421e+06 1.136844e+06 1.713436e+06 1.648055e+06 1.215790e+06 9.429940e+05 9.751820e+05 7.310564e+05 1.569675e+06 1.052096e+06 1.119779e+06 8.334976e+05 1.041239e+06 1.998646e+06 1.574305e+06 8.833245e+05 1.530324e+06 1.341357e+06 8.597587e+05 1.449394e+06 1.105972e+06 1.813977e+06 1.160864e+06 1.156541e+06 1.509297e+06 1.062858e+06 8.203230e+05 1.633894e+06 5.344610e+05 1.457715e+06 9.637842e+05 2.060930e+06 9.056291e+05 1.548226e+06 1.136913e+06 C6 H5 Cl N2 O3 S_7.904 5.286551e+06 5.435078e+06 3.829798e+06 4.875734e+06 7.879346e+04 3.338995e+06 4.491669e+06 4.695230e+06 87976.35 4.553029e+06 4.688264e+06 4.840458e+06 95960.93 3.836020e+06 4.653757e+06 4.279819e+06 1.466611e+05 4.594217e+06 4.314614e+06 4.536525e+06 6.362897e+04 4.178905e+06 4.429426e+06 4.699232e+06 10074.924 4.333427e+06 4.780026e+06 4.149658e+06 2.745302e+04 4.670276e+06 4.465311e+06 4.404819e+06 90114.91 4.111871e+06 4.918894e+06 4.475489e+06 6.960281e+04 4.159671e+06 4.834394e+06 4.487321e+06 1.075499e+05 4.010249e+06 4.672946e+06 4.635875e+06 9.020916e+04 3.997295e+06 4.783251e+06 4.378788e+06 3.520977e+06 3.278374e+06 3.855775e+06 3.657673e+06 6.075286e+06 6.483027e+06 4.102063e+06 4.362213e+06 4.289561e+06 5.745051e+06 4.804606e+06 4.200213e+06 3.822045e+06 4.409725e+06 4.489872e+06 4.603369e+06 3.601039e+06 3.198226e+06 4.900573e+06 5.021354e+06 5.987641e+06 5.236643e+06 3.145167e+06 4.902337e+06 3.927793e+06 3.143422e+06 5.294987e+06 3.548583e+06 4.222148e+06 6.002799e+06 6.517904e+06 4.833900e+06 3.961744e+06 3.455584e+06 4.458100e+06 3.226477e+06 4.458661e+06 5.890240e+06 4.348680e+06 5.572943e+06 6.031207e+06 5.345681e+06 3.728822e+06 2.403357e+06 4.150099e+06 6.540360e+06 3.110654e+06 3.172391e+06 4.573298e+06 4.823876e+06 2.503139e+06 4.787062e+06 3.950223e+06 2.834754e+06 5.077222e+06 4.222496e+06 6.010212e+06 5.149254e+06 4.564071e+06 5.173312e+06 4.177495e+06 4.227228e+06 4.084674e+06 4.474162e+06 4.201646e+06 4.381636e+06 3.667438e+06 5.251239e+06 3.956866e+06 2.248920e+06 6.246471e+06 5.282489e+06 4.714314e+06 3.451391e+06 4.553255e+06 5.963657e+06 5.698490e+06 5.732522e+06 4.748740e+06 3.253412e+06 5.199957e+06 2.948875e+06 4.081713e+06 7.775098e+06 4.890934e+06 4.251567e+06 4.291214e+06 3.133949e+06 4.986840e+06 3.402082e+06 5.291488e+06 4.803894e+06 3.399374e+06 4.037914e+06 3.869229e+06 4.810690e+06 3.507134e+06 3.722172e+06 3.402398e+06 4.151632e+06 5.326532e+06 4.389477e+06 4.626359e+06 3.866590e+06 5.507396e+06 3.935794e+06 5.118768e+06 5.103076e+06 5.754501e+06 7.751923e+06 3.493394e+06 3.038432e+06 6.908837e+06 3.601136e+06 5.222606e+06 6.826745e+06 3.587490e+06 3.592717e+06 4.172025e+06 4.348430e+06 4.416607e+06 7.448814e+06 7.002234e+06 5.661011e+06 8.027510e+06 4.421330e+06 4.156409e+06 2.487580e+06 5.279227e+06 4.725603e+06 4.999248e+06 1.885987e+06 6.695759e+04 4.084614e+06 4.446557e+06 2.651548e+06 2.657275e+06 3.763926e+06 5.373004e+06 5.962756e+06 5.145084e+06 4.227986e+06 4.808701e+06 2.705885e+06 9.320408e+04 5.171779e+06 2.191930e+06 4.779864e+06 5.480783e+06 2.180400e+06 5.273249e+06 4.118265e+06 5.338701e+06 3.780425e+06 6.816486e+06 5.620294e+06 3.549263e+06 4.108669e+06 3.356907e+06 4.687407e+06 2.685539e+06 4.546979e+06 4.243638e+06 5.335169e+06 5.096650e+06 5.546455e+06 3.335778e+06 5.114686e+06 4.081450e+06 3.893359e+06 3.251656e+06 3.811479e+06 3.189375e+06 6.229693e+06 4.443580e+06 3.370069e+06 3.086577e+06 2.750817e+06 6.270864e+06 5.371388e+06 4.663526e+06 7.279190e+06 4.714697e+06 5.046762e+06 6.844831e+06 3.959266e+06 4.974711e+06 2.847350e+06 6.698946e+06 5.924659e+06 5.090678e+06 5.945339e+06 4.161361e+06 3.358259e+06 2.814899e+06 5.496242e+06 5.212186e+06 3.565426e+06 6.191281e+06 4.145559e+06 4.902747e+06 5.086104e+06 5.214488e+06 6.129528e+06 4.285760e+06 5.183576e+06 5.213307e+06 3.014486e+06 4.626790e+06 7.108342e+06 6.108323e+06 4.117642e+06 5.527907e+06 6.069735e+06 CHOLINE 5.888530e+08 4.628543e+08 2.834277e+08 4.587262e+08 4.272414e+05 3.101048e+08 4.560608e+08 4.209475e+08 84352.62 3.784320e+08 3.971390e+08 4.188295e+08 210873.73 3.759021e+08 3.843425e+08 3.967957e+08 2.542172e+05 3.763744e+08 3.925799e+08 3.988346e+08 1.188874e+06 3.639448e+08 4.217528e+08 4.479142e+08 859713.667 3.645572e+08 3.881460e+08 3.842918e+08 2.017496e+06 3.867523e+08 3.954104e+08 4.121528e+08 1169748.61 3.922183e+08 3.876016e+08 3.891570e+08 1.142849e+06 3.869466e+08 4.003020e+08 4.084711e+08 8.337485e+05 3.830167e+08 4.069161e+08 4.043522e+08 1.077015e+06 3.831890e+08 3.694540e+08 4.128261e+08 3.516983e+08 4.095057e+08 3.332780e+08 4.145377e+08 4.670677e+08 4.808862e+08 4.784233e+08 5.154314e+08 4.271218e+08 5.102309e+08 5.142462e+08 4.958647e+08 4.434872e+08 4.429903e+08 4.457575e+08 4.484895e+08 3.641518e+08 3.552369e+08 4.217660e+08 4.032604e+08 4.302745e+08 4.539451e+08 4.679596e+08 4.705356e+08 4.238055e+08 3.172117e+08 4.697418e+08 3.835855e+08 4.023103e+08 4.402537e+08 6.355494e+08 4.684845e+08 4.239101e+08 4.128621e+08 4.319767e+08 3.927545e+08 3.945166e+08 4.458600e+08 3.394816e+08 4.228029e+08 4.401929e+08 3.841503e+08 4.183413e+08 3.074852e+08 3.757604e+08 3.628327e+08 3.586663e+08 3.823391e+08 3.932689e+08 3.791733e+08 3.348041e+08 3.541930e+08 2.443032e+08 3.744978e+08 3.590339e+08 3.445085e+08 3.975109e+08 3.821068e+08 4.001546e+08 3.855139e+08 3.637000e+08 4.303800e+08 3.232206e+08 4.082685e+08 4.077619e+08 4.190181e+08 4.172376e+08 4.590528e+08 4.257401e+08 3.184714e+08 5.058536e+08 4.188775e+08 3.377742e+08 3.166996e+08 2.737936e+08 3.317650e+08 3.620591e+08 3.653626e+08 3.858674e+08 2.758816e+08 4.111805e+08 4.167739e+08 4.173181e+08 5.852236e+08 3.715313e+08 4.666978e+08 3.537142e+08 3.291928e+08 4.046824e+08 3.704263e+08 4.240442e+08 4.062194e+08 3.649810e+08 3.980323e+08 3.538470e+08 4.096046e+08 4.397318e+08 3.925012e+08 3.056276e+08 4.247165e+08 4.116562e+08 3.478912e+08 4.267823e+08 4.024737e+08 4.035240e+08 3.721531e+08 4.030663e+08 3.882527e+08 4.758080e+08 4.594722e+08 3.636651e+08 2.834777e+08 4.386909e+08 4.489926e+08 3.848858e+08 3.878245e+08 3.694128e+08 3.078223e+08 4.113959e+08 4.341901e+08 3.699222e+08 4.321101e+08 4.769551e+08 4.325348e+08 4.440951e+08 3.829053e+08 3.640112e+08 2.452876e+08 4.692259e+08 3.921979e+08 4.685053e+08 3.534278e+08 1.979314e+05 2.627462e+08 3.965487e+08 2.434373e+08 2.984583e+08 3.342470e+08 5.134725e+08 3.857132e+08 3.851660e+08 4.055945e+08 3.912742e+08 3.215069e+08 9.630199e+04 3.634955e+08 2.535968e+08 4.229809e+08 4.325057e+08 3.466728e+08 4.104641e+08 4.552654e+08 5.308373e+08 4.027592e+08 4.778751e+08 5.058287e+08 3.057967e+08 3.868113e+08 3.710029e+08 4.353608e+08 3.306840e+08 4.185419e+08 4.082809e+08 4.256866e+08 4.281575e+08 4.095766e+08 3.353470e+08 4.586599e+08 3.562095e+08 3.745823e+08 5.681130e+08 4.100626e+08 2.357336e+07 4.426701e+08 4.379264e+08 2.992717e+08 4.039740e+08 3.580905e+08 4.897272e+08 3.391820e+08 4.431797e+08 5.334193e+08 4.297691e+08 3.995270e+08 4.307970e+08 3.919759e+08 3.964973e+08 3.481032e+08 5.083027e+08 3.893283e+08 3.437208e+08 5.251962e+08 4.476060e+08 3.591876e+08 3.015647e+08 4.983741e+08 3.659811e+08 3.653414e+08 4.852065e+08 4.196599e+08 4.662346e+08 4.164747e+08 3.894358e+08 4.882224e+08 3.962116e+08 4.704711e+08 4.450158e+08 3.205293e+08 3.758580e+08 3.881227e+08 4.021318e+08 2.675637e+08 4.655154e+08 5.130008e+08 beta-Alanine_7.906 1.104747e+08 8.232236e+07 6.273732e+07 8.131887e+07 7.490252e+04 6.291607e+07 8.385319e+07 8.263734e+07 80199.17 7.139481e+07 7.501801e+07 7.945506e+07 119525.98 6.895886e+07 7.444989e+07 7.814932e+07 1.228035e+05 7.022286e+07 7.368676e+07 7.589458e+07 5.160764e+04 6.860227e+07 7.838304e+07 8.980988e+07 50642.839 6.712858e+07 7.359452e+07 7.242858e+07 6.436046e+04 7.180676e+07 7.794378e+07 7.872021e+07 82010.43 7.148687e+07 7.501579e+07 7.409939e+07 6.982311e+04 7.308827e+07 7.621552e+07 7.877257e+07 9.516018e+04 7.112850e+07 7.754114e+07 7.860036e+07 1.022804e+05 7.085457e+07 7.031363e+07 7.842147e+07 6.033820e+07 5.987344e+07 6.048790e+07 5.495974e+07 1.043946e+08 1.333915e+08 8.495071e+07 7.946423e+07 7.802061e+07 1.166955e+08 9.503431e+07 7.354574e+07 8.259625e+07 8.464096e+07 9.245645e+07 8.014009e+07 4.854281e+07 4.364779e+07 8.066479e+07 9.684909e+07 1.060385e+08 8.539672e+07 5.337139e+07 9.389040e+07 6.772154e+07 4.353475e+07 9.780368e+07 5.748623e+07 7.023895e+07 1.136681e+08 1.515896e+08 7.968553e+07 6.668300e+07 5.610817e+07 7.057379e+07 5.188515e+07 7.966799e+07 1.039302e+08 7.063870e+07 1.003976e+08 1.077134e+08 1.099363e+08 6.046995e+07 3.831892e+07 7.190647e+07 1.177397e+08 5.252209e+07 5.220098e+07 6.881228e+07 8.153615e+07 3.000037e+07 9.765146e+07 7.192432e+07 4.538335e+07 8.905657e+07 6.395874e+07 1.067664e+08 8.342108e+07 7.025735e+07 9.606539e+07 6.974275e+07 7.239176e+07 5.734886e+07 6.760783e+07 7.323981e+07 6.764884e+07 4.815778e+07 9.346893e+07 6.257529e+07 3.640405e+07 1.200655e+08 9.880565e+07 6.990076e+07 5.421177e+07 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1.041130e+06 4.771662e+05 8.411781e+05 5.609882e+05 5.256731e+05 7.738694e+05 9.787708e+05 6.814266e+05 2.427473e+05 4.843252e+05 5.052025e+05 5.148490e+05 6.550551e+05 4.104061e+05 9.871119e+05 8.135674e+05 7.603631e+05 8.089550e+05 5.790097e+05 9.874025e+05 4.661864e+05 8.624936e+05 1.090303e+06 1.091785e+06 9.468885e+05 9.643372e+05 1.037489e+06 2.586195e+05 1.987783e+06 9.339295e+05 5.544791e+05 4.261841e+05 5.560834e+05 4.355993e+05 6.974625e+05 6.163300e+05 7.216737e+05 1.797351e+05 8.616358e+05 7.594220e+05 6.129003e+05 3.695070e+06 8.566375e+05 1.368513e+06 6.265426e+05 4.528841e+05 1.130126e+06 5.856238e+05 1.242006e+06 9.684418e+05 5.230776e+05 9.958558e+05 6.642212e+05 1.008950e+06 1.005036e+06 6.563581e+05 2.597288e+05 1.101293e+06 9.659625e+05 5.863669e+05 1.154867e+06 8.691803e+05 8.730208e+05 5.631883e+05 9.436563e+05 7.236984e+05 1.260189e+06 1.093526e+06 8.535403e+05 7.432735e+05 1.145738e+06 2.652375e+05 7.676915e+05 7.382541e+05 5.946338e+05 8.757652e+05 7.086360e+05 7.668467e+05 7.331881e+05 9.149456e+05 1.185305e+06 9.766618e+05 1.085231e+06 7.468192e+05 3.507268e+05 3.595204e+05 1.234626e+06 7.862119e+05 1.451631e+06 3.090069e+05 2.997798e+04 2.065686e+05 8.236237e+05 2.309679e+05 2.879961e+05 4.285473e+05 1.349600e+06 7.873794e+05 6.324595e+05 9.282290e+05 8.282631e+05 3.654977e+05 4.918939e+04 5.688140e+05 1.388853e+04 8.947294e+05 7.710728e+05 3.608304e+05 9.569674e+05 1.493737e+06 2.592978e+06 9.124789e+05 1.607960e+06 2.001596e+06 7.833750e+05 7.360351e+05 7.393507e+05 8.428901e+05 4.895139e+05 1.391305e+06 9.682348e+05 1.453251e+06 1.029968e+06 9.937116e+05 6.262874e+05 1.402694e+06 5.530422e+05 6.499745e+05 3.140330e+06 1.070620e+06 7.020051e+05 1.494689e+06 9.257010e+05 9.202277e+05 7.869656e+05 4.995231e+05 1.535746e+06 5.033660e+05 1.222632e+06 1.421052e+06 7.708024e+05 1.043387e+06 1.176225e+06 8.484234e+05 6.857323e+05 4.817394e+05 1.504548e+06 7.995040e+05 2.296745e+05 1.879630e+06 8.651979e+05 4.295804e+05 2.151551e+05 1.410336e+06 7.411955e+05 6.747647e+05 1.279152e+06 1.042933e+06 1.133083e+06 8.400038e+05 8.452625e+05 1.506162e+06 8.465603e+05 1.103126e+06 1.041257e+06 7.784449e+05 5.345270e+05 8.429657e+05 6.203834e+05 4.926435e+04 1.414582e+06 1.969761e+06 C7 H8 N2 O_7.931 1.236976e+06 9.376444e+05 7.814375e+05 1.224642e+06 4.338640e+04 6.853858e+05 1.108173e+06 8.883270e+05 42615.04 9.537111e+05 9.167907e+05 9.725757e+05 52505.64 8.989271e+05 9.979199e+05 9.059042e+05 6.058794e+04 8.458559e+05 9.324190e+05 1.016179e+06 2.852481e+04 9.294711e+05 9.786514e+05 1.067241e+06 5732.726 7.052524e+05 9.814701e+05 9.087487e+05 8.301552e+03 8.739449e+05 1.031997e+06 9.590540e+05 43149.54 9.144064e+05 9.646272e+05 9.721941e+05 3.114164e+04 8.461194e+05 9.661490e+05 9.025343e+05 5.345207e+04 9.034817e+05 1.044025e+06 9.832111e+05 4.610140e+04 8.135053e+05 9.663528e+05 9.330386e+05 6.428442e+05 9.036354e+05 1.867037e+06 1.092339e+06 1.755535e+06 8.509357e+05 5.908580e+05 6.698060e+05 6.177377e+05 9.166810e+05 1.116035e+06 6.017099e+05 4.014782e+05 3.164870e+05 1.221334e+06 6.612211e+05 7.772596e+05 7.679330e+05 7.706207e+05 9.314616e+05 1.035521e+06 3.207706e+05 1.091725e+06 1.215538e+06 6.832842e+05 2.675062e+05 5.326019e+05 6.590129e+05 5.602421e+05 6.442438e+05 2.439494e+06 1.307450e+06 1.478416e+06 6.894812e+05 2.088745e+06 9.888564e+05 6.085727e+05 7.671856e+05 2.398651e+06 1.820338e+06 1.281185e+06 1.333776e+06 1.200802e+06 3.893640e+05 1.254333e+06 1.959938e+06 1.468351e+06 6.218354e+05 2.643191e+05 6.790794e+05 8.344222e+05 2.018793e+06 1.062125e+06 2.995565e+05 3.062791e+05 4.360385e+05 1.413872e+06 6.784967e+05 6.664080e+05 6.356594e+05 6.271353e+05 7.071664e+05 4.002806e+05 2.224093e+06 1.454935e+06 5.506572e+05 8.410327e+05 1.469680e+06 1.744296e+06 6.145875e+05 8.959220e+05 5.424728e+05 2.385483e+06 6.346023e+05 7.813651e+05 2.235502e+06 1.203350e+06 3.762060e+05 4.719791e+05 5.951879e+05 4.982270e+05 1.103509e+06 1.229666e+06 9.017425e+05 5.693989e+05 7.320155e+05 6.071993e+05 1.276374e+06 3.349900e+05 6.143819e+05 6.513531e+05 1.487979e+06 1.053034e+06 1.107885e+06 9.508373e+05 8.077472e+05 8.389421e+05 2.293402e+06 4.959808e+05 9.907331e+05 2.372463e+06 8.572321e+05 1.616843e+06 1.197336e+06 4.811931e+05 4.737496e+05 6.888389e+05 1.783668e+06 7.205158e+05 2.274275e+06 1.046979e+06 8.030093e+05 1.152752e+06 1.235878e+06 6.393557e+05 2.112829e+06 1.592079e+06 5.089175e+05 3.512807e+05 1.394412e+06 1.160164e+06 5.944923e+05 6.850651e+05 2.289851e+06 1.086636e+06 6.356875e+05 5.781651e+05 6.115117e+05 1.655732e+06 2.381071e+05 8.159551e+05 3.936399e+05 3.727758e+04 7.612450e+05 5.228436e+05 1.649440e+05 2.434570e+05 7.610774e+05 1.435949e+06 8.535482e+05 1.751443e+06 6.161339e+05 1.138893e+06 1.355529e+06 4.736545e+04 1.967892e+06 1.549193e+04 1.437011e+06 1.654946e+06 2.045329e+05 4.814839e+05 1.355300e+06 6.351871e+05 7.896153e+05 1.409020e+06 1.407935e+06 3.391623e+05 5.767349e+05 6.314965e+05 9.675114e+05 8.180891e+05 2.454089e+06 1.106076e+06 5.884237e+05 1.076204e+06 8.367793e+05 6.928347e+05 2.245633e+06 2.948617e+05 7.767215e+05 2.293966e+05 4.611813e+05 6.887396e+05 8.286774e+05 1.681225e+06 7.796903e+05 3.232996e+05 4.143612e+05 8.234920e+04 1.314929e+06 7.601392e+05 1.225714e+06 2.913830e+05 1.380104e+06 1.190846e+06 7.043433e+05 4.843235e+05 1.017701e+06 1.039316e+06 1.212292e+06 3.081488e+06 8.467878e+05 1.562056e+06 6.887975e+05 4.974879e+05 8.194262e+05 7.614758e+05 1.103281e+06 5.666336e+05 1.336463e+06 3.307680e+05 1.076466e+06 1.916532e+06 9.429584e+05 1.197143e+06 5.054863e+05 9.349130e+05 4.701122e+05 5.041806e+05 5.090508e+05 6.643029e+05 4.238041e+04 3.113918e+05 3.401427e+06 C10 H16 N6 O9_7.932 2.164697e+04 9.126242e+04 8.547283e+04 1.484107e+05 4.819948e+04 6.553946e+04 1.144916e+05 1.219957e+05 38825.17 1.225164e+05 1.462005e+05 1.163338e+05 56157.24 5.703350e+04 9.243607e+04 8.792857e+04 7.228660e+04 8.363893e+04 1.474160e+05 1.334983e+05 2.975189e+04 8.367746e+04 9.848416e+04 1.243002e+05 4806.224 7.659301e+04 1.244574e+05 1.134237e+05 5.631860e+03 8.906123e+04 1.042717e+05 1.053681e+05 26044.30 1.179105e+05 1.202054e+05 1.019412e+05 1.863987e+04 1.022598e+05 1.095854e+05 1.099510e+05 3.420334e+04 8.356660e+04 1.273931e+05 1.156884e+05 3.067642e+04 8.879885e+04 1.101729e+05 1.072085e+05 4.136402e+04 7.960948e+04 4.843069e+04 9.616892e+03 1.436202e+05 1.210251e+05 4.180484e+04 3.009753e+04 3.198531e+05 2.024697e+05 2.628641e+04 1.341116e+05 3.276192e+04 1.457876e+04 2.486631e+04 1.427709e+04 2.542720e+04 1.589133e+05 7.089139e+04 5.813666e+04 1.779499e+05 1.599977e+05 7.503217e+04 5.934826e+04 3.793561e+04 1.855472e+04 5.530926e+04 2.313505e+05 5.816801e+04 4.768866e+05 5.857736e+04 2.093317e+04 2.113639e+04 1.674100e+04 8.275603e+04 1.608203e+04 1.091410e+05 1.252161e+05 5.430762e+04 5.678597e+04 5.587306e+04 2.096905e+04 1.569986e+04 1.426033e+04 9.048422e+04 2.154052e+05 3.623644e+04 2.490990e+04 7.692587e+04 3.613777e+04 2.899828e+04 5.077831e+04 1.778174e+04 3.924517e+04 6.759199e+04 2.058252e+05 1.290123e+05 1.766917e+04 2.669857e+04 5.402174e+04 7.513730e+04 1.054862e+05 2.167667e+04 1.116329e+05 3.830158e+04 7.987892e+04 4.233907e+04 4.895540e+04 2.907994e+04 1.619208e+04 8.249496e+04 2.309928e+05 7.899616e+04 3.187413e+04 6.529897e+05 1.464654e+06 1.286104e+06 6.679467e+04 6.880828e+04 3.046229e+04 4.374585e+04 6.217834e+05 6.858182e+04 3.255166e+05 4.205512e+05 4.470575e+04 5.355327e+04 2.250548e+04 2.097187e+05 7.046815e+04 1.641935e+05 5.438513e+04 2.932277e+04 1.014160e+05 9.009110e+04 1.853052e+05 3.525868e+04 1.602423e+05 7.567883e+04 5.247531e+04 2.076179e+04 5.688430e+04 2.801754e+05 1.331068e+05 5.460915e+04 5.253304e+04 2.371150e+05 9.879339e+04 6.780659e+04 3.878863e+05 1.869528e+04 8.495903e+04 4.515572e+05 1.197597e+04 3.039699e+04 1.604309e+05 1.998270e+05 1.850417e+04 2.853036e+04 1.679949e+05 7.286642e+04 4.297668e+04 4.609477e+05 4.233780e+05 2.369664e+05 6.161736e+04 5.789790e+04 1.071075e+04 1.604600e+04 1.405516e+04 4.144563e+04 7.571874e+04 2.341736e+04 2.296516e+05 8.793190e+04 1.288008e+04 1.980749e+04 1.663296e+04 1.169120e+05 2.738601e+04 4.437837e+04 5.328968e+04 7.239223e+04 5.124708e+04 8.762303e+04 2.383327e+05 1.324687e+04 2.918860e+04 2.000079e+04 9.528079e+03 5.372736e+04 1.346674e+04 1.411315e+05 4.958454e+04 7.788177e+04 4.992004e+04 6.763887e+04 6.346848e+04 2.574552e+04 5.147740e+05 1.199034e+04 1.846915e+05 3.197325e+04 3.027544e+04 2.658615e+05 2.606269e+04 1.645842e+04 1.456494e+05 2.600612e+05 4.825736e+04 7.203921e+04 1.064701e+04 5.774641e+04 3.103173e+04 5.043970e+04 1.587820e+04 1.060670e+04 3.212194e+04 4.113720e+05 1.401513e+05 8.403776e+05 2.173993e+05 2.945803e+04 2.895724e+04 1.101750e+05 1.921970e+04 1.154119e+04 1.154005e+04 1.228108e+05 2.486479e+05 1.185579e+04 1.064150e+05 3.387639e+04 6.345555e+04 2.109926e+04 4.773446e+04 5.167713e+04 6.029079e+04 1.139412e+05 1.922874e+04 7.367433e+04 6.233611e+04 1.665518e+05 1.613855e+04 4.777951e+04 6.317726e+04 1.999104e+04 1.644523e+04 1.023334e+04 3.025251e+05 3.899499e+05 1.251807e+04 2.489170e+04 1.226915e+05 C5 H9 N O3_7.945 1.749604e+07 6.839459e+06 4.752507e+06 8.245447e+06 1.895697e+05 5.828684e+06 9.535755e+06 1.349813e+07 106680.48 4.141997e+06 8.703092e+06 1.134651e+07 124967.00 5.484343e+06 3.187280e+06 1.020933e+07 1.768596e+05 5.062764e+06 4.809856e+06 1.026236e+07 7.049288e+04 5.795360e+06 9.853085e+06 1.293186e+07 71156.919 3.506310e+06 9.139146e+06 5.824371e+06 8.309630e+04 6.557334e+06 5.328577e+06 1.397457e+07 172399.05 4.939612e+06 6.296740e+06 7.753201e+06 1.190629e+05 5.923349e+06 8.378661e+06 1.182992e+07 1.484352e+05 4.200343e+06 1.036195e+07 1.018837e+07 1.201434e+05 4.006061e+06 3.342343e+06 1.110521e+07 5.002177e+06 1.014936e+07 9.954035e+06 1.461874e+07 7.020914e+06 2.099167e+07 2.713455e+07 8.744266e+06 1.157361e+07 1.210836e+07 2.394876e+07 8.561323e+06 1.515664e+07 1.164208e+07 1.086855e+07 1.486272e+07 5.134503e+06 4.632045e+06 2.404464e+07 1.034556e+07 1.606341e+07 1.870747e+07 5.578060e+06 9.692593e+06 8.242614e+06 5.602037e+06 1.465103e+07 3.203067e+06 1.195513e+07 2.208743e+07 1.500868e+07 9.595677e+06 2.192571e+06 6.951656e+06 4.949133e+06 1.082222e+07 2.015618e+07 1.907412e+07 4.250446e+06 3.202467e+06 1.272058e+07 6.228954e+06 1.558109e+07 1.849988e+06 7.272165e+06 1.161238e+07 1.477199e+07 3.908393e+07 8.513169e+06 3.218826e+07 1.261845e+06 5.967610e+06 1.408528e+07 3.328646e+06 4.940470e+06 4.270247e+06 1.821856e+07 1.835898e+07 8.058154e+06 2.928996e+07 5.940977e+06 1.183592e+07 4.689193e+06 1.350791e+07 2.842398e+07 2.164916e+06 1.927490e+06 2.229470e+06 1.228441e+07 1.756199e+06 2.411065e+07 1.912273e+07 1.251081e+06 8.677177e+06 8.692123e+06 1.024879e+07 6.598471e+06 6.101246e+06 1.404604e+07 3.820346e+06 4.665009e+06 2.035912e+06 5.696875e+06 6.073431e+06 3.570268e+06 1.002654e+07 3.383297e+06 3.943990e+06 7.804087e+06 5.590679e+06 9.315037e+06 1.629671e+07 8.636835e+06 1.433880e+07 9.392347e+06 1.028617e+07 5.175128e+06 5.981534e+06 7.761835e+05 7.603541e+06 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1.622148e+07 9.556230e+06 3.946499e+06 1.599285e+07 1.448451e+07 3.427159e+06 6.769030e+06 1.163934e+07 5.205175e+06 1.250248e+07 9.522891e+06 1.611358e+07 8.394988e+06 7.675539e+06 1.142595e+07 9.042998e+06 2.420350e+06 3.599499e+06 1.639654e+07 4.171230e+06 3.800263e+06 1.842258e+07 1.218299e+07 9.358849e+06 1.525454e+07 7.876484e+06 1.507010e+07 7.698982e+06 4.036384e+06 1.343594e+07 2.777291e+06 3.605329e+06 3.822267e+06 2.090586e+07 1.241248e+07 1.683066e+07 1.847583e+07 C8 H14 N6 O2_7.951 6.676807e+07 2.966352e+07 1.934775e+07 3.259990e+07 1.485746e+05 2.016098e+07 3.367512e+07 2.744381e+07 135011.44 2.468679e+07 2.596583e+07 2.857217e+07 161039.69 2.468281e+07 2.793711e+07 2.621746e+07 1.860636e+05 2.571857e+07 2.729438e+07 2.568933e+07 8.300602e+04 2.446181e+07 2.920690e+07 3.039337e+07 15910.920 2.491561e+07 2.656018e+07 2.482349e+07 6.830256e+04 2.539729e+07 2.550758e+07 2.976095e+07 132278.63 2.986604e+07 2.482411e+07 2.469689e+07 9.848241e+04 2.644541e+07 2.584796e+07 2.746171e+07 1.707265e+05 2.760933e+07 2.644185e+07 2.795520e+07 1.488497e+05 2.717436e+07 2.434484e+07 2.758568e+07 3.216508e+07 2.865991e+07 2.437506e+07 2.305917e+07 2.856870e+07 2.791823e+07 6.030087e+07 1.416304e+07 2.558253e+07 2.611804e+07 3.622570e+07 2.197101e+07 5.641233e+07 6.567152e+07 6.483569e+07 2.819747e+07 1.293250e+07 1.545542e+07 2.359835e+07 4.631209e+07 2.555454e+07 1.604247e+07 1.929105e+07 1.570492e+07 2.451786e+07 3.160823e+07 3.028746e+07 2.449661e+07 2.993272e+07 6.004492e+07 7.695781e+07 3.120030e+07 2.662199e+07 1.857465e+07 3.658946e+07 1.752020e+07 3.629498e+07 3.030714e+07 3.975382e+07 2.649840e+07 3.518544e+07 4.895984e+07 1.906105e+07 1.042504e+07 1.302533e+07 5.956611e+07 2.637201e+07 2.123448e+07 1.090421e+07 4.634289e+07 5.926657e+06 7.114106e+07 1.571605e+07 2.939489e+07 4.446195e+07 3.849991e+07 2.883283e+07 3.856263e+07 1.974245e+07 4.159958e+07 3.329736e+07 1.831192e+07 1.589954e+07 9.708655e+06 2.591168e+07 1.490248e+07 6.493978e+06 4.555557e+07 9.839444e+06 5.663129e+07 2.062775e+07 4.159218e+07 1.447887e+07 3.242409e+07 1.269038e+07 4.267911e+07 2.311969e+07 3.282100e+07 2.866542e+07 3.735729e+07 4.830295e+07 4.277105e+07 8.239596e+07 2.132327e+07 1.718091e+07 1.099910e+07 5.827914e+07 8.502336e+06 1.939836e+07 4.025332e+07 2.665158e+07 4.021446e+07 3.908573e+07 1.578471e+07 1.715375e+07 2.229058e+07 1.407220e+07 1.042752e+07 1.657357e+07 1.449667e+07 1.234583e+07 1.796832e+07 1.115965e+07 1.068664e+07 1.162210e+07 5.348390e+07 2.002017e+07 3.133030e+07 1.557491e+07 2.005594e+07 1.460038e+07 1.500197e+07 3.557955e+07 3.292965e+07 4.197659e+07 4.386539e+07 2.551454e+07 2.982268e+07 5.532530e+07 2.689341e+07 3.061289e+07 2.499028e+07 7.031494e+07 2.243349e+07 3.254242e+07 4.003864e+07 4.090875e+07 8.148797e+06 1.630262e+07 4.479114e+07 3.396716e+07 8.744728e+06 2.194957e+07 5.227739e+07 5.012807e+07 1.563048e+07 2.398343e+07 3.081985e+07 2.825160e+07 1.981511e+07 3.621225e+07 2.572856e+07 2.471295e+07 3.331730e+07 1.479262e+05 5.732091e+07 1.101942e+07 2.341425e+07 5.305850e+07 1.949195e+07 4.040300e+07 2.348504e+07 1.405853e+07 2.611558e+07 3.135113e+07 2.295960e+07 1.471834e+07 2.268157e+07 9.234603e+06 3.108513e+07 3.414913e+07 8.881627e+06 2.187661e+07 1.376500e+07 3.798785e+07 2.351064e+07 1.897303e+07 2.049971e+07 4.301706e+07 1.593930e+07 1.007870e+07 2.517923e+07 7.239474e+06 1.712107e+07 1.883644e+07 8.910081e+06 2.819626e+07 1.503043e+07 2.649171e+07 3.767698e+07 2.764603e+07 4.956742e+07 3.665253e+07 2.665095e+07 2.946681e+07 1.816093e+07 1.484128e+07 4.580152e+07 3.503664e+07 3.512187e+07 1.798961e+07 2.066317e+07 5.200439e+07 3.136423e+07 1.420413e+07 4.443295e+07 3.192867e+07 1.755546e+07 4.152161e+07 1.958882e+07 4.549925e+07 2.823584e+07 2.841991e+07 3.422131e+07 2.148906e+07 1.764250e+07 4.917667e+07 9.146606e+06 2.710783e+07 3.342246e+07 8.207218e+07 1.752873e+07 4.782545e+07 2.758831e+07 C2 H6 Cl N O3 P2_8.005 1.477522e+06 3.052695e+05 5.557197e+05 1.972277e+05 8.626691e+04 2.457902e+05 2.924707e+05 4.684204e+05 72378.84 1.703517e+05 8.751395e+05 2.806793e+05 105227.93 3.426673e+05 3.561924e+05 4.120914e+05 1.347048e+05 3.606799e+05 4.495028e+05 5.709775e+05 5.885966e+04 3.983720e+05 5.209025e+05 6.794884e+05 12636.815 4.661184e+05 3.190432e+05 5.846353e+05 2.295592e+04 6.023292e+05 3.150749e+05 5.308639e+05 209353.20 4.876424e+05 3.274106e+05 4.686758e+05 1.335764e+05 5.681010e+05 4.756252e+05 4.408786e+05 1.738593e+05 6.025338e+05 4.605877e+05 6.096832e+05 1.388857e+05 5.472417e+05 2.142614e+05 6.135404e+05 3.249358e+05 3.674640e+05 8.089881e+05 1.938126e+06 3.727585e+05 4.379181e+05 9.584570e+05 1.021041e+06 2.114667e+06 2.424626e+06 1.957256e+06 1.381193e+06 8.680100e+05 1.609702e+06 1.452895e+06 1.341204e+06 2.977201e+05 3.835009e+05 9.102292e+05 6.090316e+05 4.979491e+05 2.962753e+05 9.750870e+05 1.308837e+06 1.319976e+06 1.846350e+05 8.923410e+05 3.359646e+05 4.699711e+05 9.656950e+05 1.004542e+06 6.781409e+05 4.622971e+04 3.440947e+05 3.914473e+05 2.646624e+05 5.801583e+05 4.112899e+05 2.146877e+05 8.052221e+04 5.034001e+05 3.728539e+05 3.512786e+05 3.182546e+05 9.090765e+05 5.078184e+05 2.811574e+05 6.622028e+05 6.739304e+05 1.856454e+05 2.063406e+05 3.014434e+05 3.874508e+05 4.918361e+05 5.565154e+05 4.518013e+05 8.760084e+05 3.605497e+05 6.483521e+05 6.098285e+05 1.137128e+06 4.711547e+05 3.349096e+05 5.380084e+05 6.178065e+05 3.217015e+05 9.900439e+04 6.875977e+04 7.395433e+05 2.089784e+05 8.561362e+05 3.234494e+05 2.767518e+05 4.803816e+05 7.682103e+05 5.206692e+05 3.141638e+05 6.818104e+05 6.090341e+05 3.337269e+05 3.583008e+05 1.990365e+05 8.134837e+05 5.204236e+05 2.813582e+05 4.045116e+05 2.671928e+05 3.503299e+05 5.121633e+05 3.579622e+05 3.408671e+05 3.914287e+05 5.381192e+05 5.960219e+05 2.644757e+05 3.674944e+05 4.453184e+05 4.381506e+05 2.987782e+05 2.965490e+05 4.029104e+05 5.575951e+05 4.633218e+05 8.453098e+05 7.700966e+05 7.684757e+04 6.245086e+05 4.689496e+05 4.659202e+05 7.634604e+05 9.069119e+05 3.183221e+05 1.355520e+06 6.032813e+05 8.690225e+05 5.724894e+05 3.833951e+05 5.895799e+05 5.857832e+05 4.088844e+05 4.174175e+05 7.884194e+05 3.539356e+05 1.434751e+06 5.539254e+05 3.651707e+05 5.211500e+05 3.309681e+05 9.710589e+05 4.645732e+05 5.599669e+05 2.105852e+05 2.518251e+05 3.241312e+05 3.805788e+05 2.172607e+05 3.074195e+05 5.221818e+05 3.896966e+05 1.268325e+06 1.158099e+05 2.546497e+05 6.569198e+05 5.054278e+04 2.152747e+05 5.883467e+05 1.038180e+05 2.516725e+05 2.679075e+05 2.879939e+05 5.914952e+05 1.387225e+06 9.342805e+05 1.962178e+05 4.304985e+05 1.017720e+06 6.029784e+05 6.389963e+04 2.977164e+05 4.862857e+05 9.514230e+05 1.991482e+05 4.450493e+05 5.190001e+05 4.753888e+05 4.611919e+05 1.694350e+05 5.616583e+05 2.409749e+05 4.420555e+05 3.665897e+05 7.418671e+05 5.718774e+05 2.912576e+05 4.361158e+05 1.451116e+06 1.147624e+06 5.604790e+05 2.947359e+05 4.118009e+05 2.218844e+05 2.328243e+05 2.180710e+05 2.759339e+05 8.412656e+05 3.578802e+05 4.961726e+05 6.314701e+05 5.692696e+05 3.303980e+05 7.660881e+04 4.574029e+04 5.944803e+05 1.077005e+05 4.238861e+05 3.286509e+05 1.025913e+05 2.114217e+05 7.140841e+05 3.533227e+05 6.851371e+05 3.527370e+05 2.314619e+05 3.331601e+05 2.672956e+05 4.396598e+05 4.311892e+05 6.553867e+05 4.929952e+04 2.647377e+05 1.202804e+06 1.727130e+05 2.963221e+05 7.166377e+05 C5 H Cl N2 O S_8.025 6.504929e+07 2.569741e+08 7.649832e+07 8.167618e+07 5.600385e+06 1.291621e+07 9.039290e+07 1.031128e+08 2681575.45 1.143104e+08 1.477105e+08 9.437428e+07 440443.71 1.020878e+08 9.068229e+07 1.329707e+08 1.631071e+06 1.060232e+08 7.692564e+07 2.275910e+08 5.016002e+06 4.949740e+07 8.899544e+07 1.228826e+08 1810793.934 9.244823e+07 1.001888e+08 1.213588e+08 3.171548e+06 1.033308e+08 1.046537e+08 1.458422e+08 1875260.85 6.978692e+07 1.101615e+08 1.019412e+08 3.155930e+05 8.604628e+07 2.065921e+08 6.569623e+07 1.025763e+07 9.337196e+07 1.069432e+08 9.808708e+07 1.023927e+07 1.137169e+08 8.843503e+07 1.327263e+08 1.966437e+08 6.646906e+07 7.418185e+07 1.789722e+08 1.204791e+08 7.327932e+07 7.520518e+07 1.680375e+08 1.925158e+08 1.181458e+08 1.693506e+08 1.659418e+08 7.830314e+07 2.436383e+08 1.681760e+08 9.165767e+07 6.647436e+07 1.117268e+08 5.590816e+07 8.358241e+07 6.291444e+07 7.983231e+07 1.013932e+08 5.860021e+07 6.132609e+07 4.339467e+07 1.069417e+08 9.130468e+07 6.095836e+07 6.593888e+07 9.077883e+07 8.728366e+07 9.366390e+07 6.561831e+07 5.156645e+07 7.117254e+07 7.030225e+07 9.202425e+07 1.252659e+08 1.118309e+08 7.026658e+07 1.113613e+08 7.098338e+07 3.214937e+07 8.726633e+07 2.663487e+08 9.550983e+07 5.979975e+07 1.371764e+08 7.311932e+07 8.990184e+07 9.167276e+07 5.918742e+07 8.032657e+07 8.223151e+07 1.046921e+08 5.710097e+07 7.268235e+07 1.284891e+08 4.504055e+07 6.230090e+07 9.321692e+07 9.788268e+07 5.499770e+07 9.204395e+07 7.305098e+07 1.186188e+08 9.637950e+07 5.061326e+07 8.601378e+07 5.252529e+07 1.126424e+08 3.635982e+08 1.448657e+08 6.314105e+07 8.135771e+07 7.762822e+07 1.146389e+08 1.078747e+08 1.024102e+08 1.184813e+08 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1.392040e+08 6.539984e+07 9.728237e+07 2.886972e+07 9.085138e+07 9.600945e+07 1.289716e+08 8.164486e+07 5.214730e+07 8.264580e+07 9.932965e+07 1.232958e+08 6.339134e+07 8.107802e+07 1.039492e+08 1.417838e+08 8.115866e+07 5.961522e+07 6.480613e+07 1.464206e+08 9.300599e+07 3.656118e+07 5.765993e+07 6.249215e+07 2.731052e+07 1.025440e+08 1.436073e+08 7.407792e+07 8.681444e+07 9.185307e+07 8.216493e+07 1.177584e+08 3.033875e+08 6.775774e+07 1.252739e+08 9.421080e+07 1.040891e+08 8.554437e+07 1.003726e+08 7.580524e+07 2.231033e+08 1.083987e+08 1.050497e+08 5.973522e+07 1.098652e+08 1.169783e+08 7.159187e+07 9.037650e+07 1.499131e+07 4.639376e+07 9.638322e+07 6.666939e+07 1.744627e+08 5.728620e+07 6.630392e+07 5.293576e+07 C8 H6 Cl O3 P_8.026 1.926455e+06 1.408552e+06 1.729322e+06 1.948587e+06 2.306249e+05 7.418340e+05 1.963013e+06 1.592650e+06 209865.89 1.480220e+06 1.467239e+06 2.708435e+06 104204.89 1.184308e+06 1.544578e+06 1.664645e+06 1.271788e+05 1.068216e+06 1.567902e+06 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1.528661e+05 2.118834e+05 2.120833e+05 9.394893e+04 7.859795e+04 2.358047e+05 C14 H16 N O8 P_8.397 1.594248e+05 3.544632e+05 2.151666e+05 2.894262e+05 1.066785e+05 1.440829e+05 3.140248e+05 3.088910e+05 96078.39 2.943341e+05 1.671825e+05 2.965531e+05 101305.82 2.942061e+05 3.012554e+05 3.349795e+05 1.521647e+05 1.545603e+05 1.421201e+05 3.300386e+05 5.668287e+04 2.773931e+05 3.229054e+05 3.228065e+05 12645.391 1.398348e+05 2.740158e+05 2.711165e+05 1.201499e+04 3.254590e+05 2.330406e+05 3.148790e+05 106496.24 2.374594e+05 2.594815e+05 1.743862e+05 7.063712e+04 2.971963e+05 2.941719e+05 2.942492e+05 1.221660e+05 2.220301e+05 3.245072e+05 2.484294e+05 1.293926e+05 2.516965e+05 2.741925e+05 2.567287e+05 1.779135e+05 1.435953e+05 1.270530e+05 1.525076e+05 1.174297e+05 4.329592e+05 9.731173e+04 1.482413e+05 2.242077e+05 1.822913e+05 1.737628e+05 1.089907e+05 1.018248e+05 1.269480e+05 1.358296e+05 2.350963e+05 1.135165e+05 1.293506e+05 1.526516e+05 2.705834e+05 1.016183e+05 1.036129e+05 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7.400790e+05 1.170709e+06 1.314267e+06 126873.14 1.097744e+06 1.304932e+06 1.067632e+06 127958.94 1.098521e+06 1.056707e+06 1.148734e+06 1.748799e+05 1.168426e+06 1.132487e+06 1.077277e+06 6.549226e+04 1.321893e+06 1.053621e+06 1.247555e+06 16201.249 9.048992e+05 1.257334e+06 1.418517e+06 1.633669e+04 1.172843e+06 9.883856e+05 1.135113e+06 128811.85 1.021031e+06 1.102854e+06 1.132085e+06 6.821681e+04 1.044219e+06 1.423398e+06 1.161918e+06 1.174760e+05 9.937916e+05 1.283498e+06 1.327123e+06 1.193965e+05 9.204283e+05 1.009971e+06 1.254597e+06 9.396847e+05 6.705523e+05 1.060689e+06 3.125998e+06 1.387679e+06 1.766816e+06 1.371612e+06 1.622593e+06 1.115441e+06 1.329177e+06 1.003233e+06 3.107280e+06 1.397397e+06 1.109833e+06 1.186597e+06 9.949384e+05 1.309564e+06 1.398590e+06 1.185185e+06 9.831860e+05 1.079257e+06 1.273389e+06 2.548268e+06 1.082091e+06 1.098916e+06 1.836657e+06 9.424750e+05 1.267173e+06 1.018525e+06 1.606711e+06 2.780324e+06 1.635109e+06 8.357685e+05 1.381761e+06 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1.247932e+06 9.678800e+05 1.273867e+06 9.256556e+05 8.816877e+05 1.013299e+06 1.105648e+06 1.415379e+06 6.893456e+05 1.125956e+06 1.091407e+06 1.031459e+06 1.271683e+06 1.067423e+06 1.056302e+06 9.229883e+05 1.274462e+06 1.483940e+06 1.447196e+06 1.381753e+06 1.603427e+06 1.882967e+06 8.702955e+05 7.922307e+05 9.744733e+05 1.860606e+06 1.200346e+06 8.305906e+05 8.023217e+05 6.253238e+05 7.950419e+05 7.248451e+05 1.700996e+06 1.482938e+05 1.139625e+06 7.471164e+05 1.115505e+06 1.013467e+06 9.339175e+05 1.003732e+06 1.208748e+06 1.011943e+06 8.370973e+05 9.457981e+05 1.146927e+06 4.952979e+05 2.354954e+06 7.915099e+05 9.313677e+05 6.914373e+05 1.099656e+06 9.370102e+05 6.643927e+05 6.459021e+05 8.638516e+05 1.171588e+06 1.122299e+06 5.147560e+05 6.194743e+05 3.777626e+06 8.908775e+05 8.539228e+05 1.218599e+06 8.474850e+05 6.627139e+05 1.145738e+06 1.003788e+06 9.560589e+05 1.121875e+06 1.237141e+06 9.363931e+05 1.417448e+06 9.141677e+05 1.322524e+06 1.023231e+06 1.008941e+06 8.044427e+05 1.000134e+06 6.563200e+05 8.627164e+05 9.264024e+05 1.328389e+06 1.013023e+06 1.301780e+06 1.181057e+06 1.697307e+06 2.211761e+06 1.311449e+06 1.221659e+06 1.110947e+06 1.516940e+06 9.264315e+05 1.175973e+06 1.616077e+06 1.002397e+06 2.152392e+06 2.654026e+06 9.919393e+05 1.007607e+06 1.288128e+06 1.529873e+06 1.171890e+06 1.380184e+06 C4 H12 N5 O15 P_8.433 1.762934e+05 3.417762e+05 2.285095e+05 1.237767e+05 1.128756e+05 9.047777e+04 2.509516e+05 2.222799e+05 81582.67 1.621246e+05 1.914114e+05 2.263239e+05 70751.35 7.207004e+04 1.673580e+05 1.928019e+05 9.174507e+04 2.570765e+05 1.792236e+05 2.023890e+05 3.465451e+04 1.102671e+05 2.493633e+05 2.680550e+05 8590.807 1.646161e+05 1.934297e+05 2.108061e+05 1.007218e+04 1.502766e+05 2.925471e+05 1.422276e+05 88093.67 1.394160e+05 2.166948e+05 2.427210e+05 5.663197e+04 2.164073e+05 6.250103e+05 1.318468e+05 1.161214e+05 1.538764e+05 5.770364e+05 1.811383e+05 1.013566e+05 2.003914e+05 2.122536e+05 2.072394e+05 1.260853e+05 9.799704e+04 3.018317e+05 5.524941e+06 3.286457e+05 4.219825e+05 1.376041e+05 3.196824e+05 1.454650e+05 7.419282e+04 1.143870e+05 1.809413e+06 1.020753e+05 1.358531e+05 6.755964e+04 2.587004e+05 1.274048e+06 7.846270e+05 1.361494e+05 9.611013e+04 1.044551e+05 2.188880e+05 3.936518e+06 1.003727e+05 8.893805e+04 1.723571e+06 6.691026e+04 5.710251e+05 1.369807e+05 7.006563e+05 8.644935e+06 1.150990e+06 7.669762e+04 5.317744e+05 1.085486e+05 4.547096e+05 1.303608e+05 8.840160e+05 1.136987e+05 7.420943e+05 1.878714e+05 1.688181e+05 8.292256e+04 2.977243e+06 1.929651e+05 8.400980e+04 1.260273e+05 6.096320e+05 3.059530e+06 1.400304e+05 5.612355e+06 6.674531e+04 4.887043e+04 4.057803e+05 1.233022e+05 1.415559e+05 1.052314e+05 1.064462e+05 1.548505e+05 2.030796e+05 7.980632e+04 2.809281e+05 7.750551e+04 1.368393e+05 9.149814e+04 2.326355e+06 1.118486e+07 1.448311e+05 6.296591e+05 9.348077e+05 1.485111e+05 9.385057e+04 1.853875e+05 1.116051e+05 9.754219e+04 1.509023e+05 1.172152e+05 1.181717e+05 1.569153e+05 1.391402e+05 1.221759e+05 7.188857e+04 7.007075e+04 7.876538e+06 1.093996e+05 7.636621e+04 6.320637e+04 8.590956e+04 1.229174e+05 7.404324e+04 6.127784e+04 1.278161e+05 2.051628e+05 1.762451e+05 1.165553e+05 6.553443e+04 2.119281e+05 2.256930e+05 2.082619e+05 2.175453e+05 2.171315e+05 1.772880e+05 6.903734e+04 7.564728e+04 1.203138e+05 1.411874e+05 1.839239e+05 2.515111e+05 1.611668e+05 8.553253e+04 5.767416e+04 1.570870e+05 1.287063e+05 2.516714e+05 1.331816e+05 9.116465e+04 1.747364e+05 1.040478e+05 1.504628e+05 1.577242e+05 3.139366e+05 1.791596e+05 7.958739e+04 1.294673e+05 1.509487e+05 1.681089e+05 1.212190e+05 5.372812e+05 3.278054e+05 7.531164e+05 2.281414e+05 5.452271e+05 1.080664e+07 1.129950e+05 8.435304e+04 1.099013e+05 2.420393e+06 2.557735e+05 1.003501e+05 9.575638e+04 8.361318e+04 1.205203e+05 7.617409e+04 1.344541e+06 1.926512e+05 4.692603e+05 1.804552e+05 1.850365e+05 1.226309e+05 1.736517e+05 8.882709e+04 8.186603e+04 1.365782e+05 7.144074e+04 1.677453e+05 7.750917e+04 9.452972e+04 5.918686e+06 1.383717e+05 1.085131e+05 5.400098e+04 2.211007e+05 2.236211e+05 5.538432e+04 5.556511e+04 8.871784e+04 1.498928e+06 2.472386e+05 9.730724e+04 1.136321e+05 5.140803e+07 1.205553e+05 9.816932e+04 8.208959e+04 1.876080e+05 1.663965e+05 1.406289e+05 1.044745e+05 1.247618e+05 4.349502e+05 4.426484e+05 2.799848e+05 5.848606e+05 2.631637e+05 1.403839e+05 1.324756e+05 9.517608e+04 9.996662e+04 3.944997e+05 9.946019e+04 9.815690e+04 1.287495e+05 8.323753e+04 8.317090e+04 1.712345e+05 2.296091e+05 9.739839e+05 3.251116e+06 9.961473e+04 1.100417e+05 6.541446e+04 1.638243e+05 8.336503e+04 3.003800e+05 1.210607e+06 2.015571e+05 3.368532e+05 3.206479e+06 9.060120e+04 1.208980e+05 1.985810e+05 3.579234e+06 1.909862e+05 1.326513e+05 C7 H17 N7 O5 S3_8.436 2.670906e+05 1.659407e+05 2.117019e+05 2.864185e+05 1.511895e+05 1.236030e+05 2.848963e+05 2.539218e+05 163863.44 2.330805e+05 2.686957e+05 3.222575e+05 164590.20 2.088215e+05 2.711141e+05 2.403936e+05 2.220939e+05 1.784542e+05 2.750883e+05 2.546154e+05 7.498286e+04 3.076686e+05 2.665879e+05 3.385573e+05 18815.412 2.254838e+05 1.578826e+05 2.186394e+05 2.274401e+04 1.825161e+05 2.409039e+05 2.160923e+05 176425.20 3.317095e+05 2.045292e+05 2.346113e+05 9.672032e+04 2.999010e+05 3.213091e+05 1.918157e+05 1.682281e+05 2.640231e+05 2.698807e+05 2.257482e+05 1.717489e+05 2.562389e+05 2.668257e+05 2.550796e+05 2.167302e+05 1.605830e+05 2.140450e+05 1.357621e+06 3.600053e+05 2.928775e+05 3.724596e+05 3.081318e+05 1.363096e+05 1.641299e+05 3.990819e+05 9.650705e+05 2.918120e+05 2.637465e+05 2.078811e+05 2.875435e+05 6.384156e+05 4.727251e+05 2.684775e+05 4.305432e+05 1.947353e+05 2.685815e+05 1.588580e+06 1.507089e+05 2.077333e+05 6.814740e+05 1.510943e+05 3.717736e+05 2.128787e+05 5.366327e+05 3.058652e+06 5.623851e+05 1.650857e+05 4.520505e+05 2.752317e+05 5.318527e+05 1.510340e+05 5.468021e+05 1.664812e+05 4.152429e+05 3.075329e+05 1.207037e+05 2.150266e+05 9.356737e+05 1.456123e+05 1.755215e+05 2.982439e+05 5.403981e+05 9.252653e+05 2.161105e+05 1.092357e+06 1.627955e+05 1.210200e+05 2.830003e+05 2.001311e+05 2.680942e+05 1.930167e+05 1.760555e+05 2.773932e+05 1.976734e+05 2.671673e+05 3.590527e+05 1.681202e+05 2.441679e+05 1.518997e+05 7.001777e+05 2.101159e+06 1.862118e+05 6.179133e+05 3.506036e+05 3.761705e+05 2.444440e+05 1.865214e+05 1.678795e+05 1.763606e+05 1.654549e+05 2.961753e+05 1.861324e+05 3.685228e+05 2.037904e+05 1.477351e+05 1.630749e+05 1.726773e+05 1.880780e+06 1.636198e+05 1.694783e+05 1.510078e+05 1.579208e+05 2.765382e+05 1.566751e+05 1.356765e+05 1.336671e+05 1.798282e+05 1.773181e+05 2.665044e+05 2.203337e+05 2.321552e+05 2.066521e+05 2.133343e+05 1.808128e+05 2.588445e+05 2.739603e+05 1.634937e+05 1.684185e+05 2.918353e+05 3.552803e+05 2.866081e+05 1.608111e+05 4.132321e+05 2.000195e+05 1.248202e+05 2.982220e+05 2.078776e+05 3.241569e+05 2.265058e+05 2.311941e+05 2.516535e+05 2.134939e+05 2.944451e+05 1.666490e+05 1.972529e+05 2.712467e+05 1.693397e+05 3.167779e+05 1.880704e+05 1.420787e+05 1.660867e+05 3.180944e+05 5.209926e+05 6.117604e+05 2.646339e+05 3.868101e+05 1.001592e+06 2.220560e+05 2.095470e+05 2.032307e+05 6.544817e+05 3.702802e+05 2.010694e+05 1.965457e+05 2.512466e+05 1.752182e+05 2.037497e+05 5.414934e+05 3.081188e+05 3.634063e+05 2.867512e+05 2.553465e+05 2.610304e+05 2.612953e+05 2.998716e+05 1.862297e+05 1.612951e+05 1.532916e+05 1.850061e+05 1.857968e+05 1.615785e+05 1.672462e+06 2.033928e+05 2.097565e+05 1.173929e+05 1.589007e+05 2.829093e+05 1.205848e+05 1.431945e+05 1.720687e+05 4.819995e+05 3.314782e+05 1.701908e+05 1.704125e+05 1.437743e+07 1.212438e+05 2.289736e+05 1.688092e+05 1.782698e+05 2.142610e+05 2.424394e+05 2.509617e+05 2.943598e+05 3.721033e+05 3.832748e+05 1.638021e+05 3.737769e+05 2.729057e+05 2.471273e+05 1.853752e+05 2.564350e+05 1.666396e+05 2.624288e+05 2.238916e+05 1.729503e+05 2.264909e+05 1.486458e+05 1.518823e+05 2.494405e+05 2.966226e+05 5.309334e+05 1.024730e+06 3.390852e+05 2.813628e+05 1.731951e+05 2.733241e+05 2.982286e+05 3.496102e+05 7.025693e+05 1.560331e+05 3.450926e+05 1.026241e+06 1.576316e+05 2.793729e+05 3.494376e+05 6.321943e+05 3.289916e+05 2.328540e+05 C4 H10 N2 O3 S_8.436 1.667040e+06 2.107414e+06 1.872447e+06 1.937872e+06 9.748284e+04 1.348271e+06 2.013159e+06 2.051475e+06 107278.94 1.703089e+06 1.934860e+06 2.016487e+06 102307.70 1.669832e+06 1.817892e+06 1.843635e+06 1.408587e+05 1.868162e+06 1.855500e+06 1.949735e+06 5.248296e+04 1.564323e+06 1.935839e+06 2.262165e+06 12959.168 1.787426e+06 1.733697e+06 1.804145e+06 1.454208e+04 1.930847e+06 1.717576e+06 1.995355e+06 94686.25 1.807117e+06 1.754095e+06 1.597485e+06 4.985649e+04 1.841736e+06 2.578796e+06 1.615899e+06 8.858496e+04 1.945736e+06 1.594851e+06 1.837909e+06 9.938747e+04 1.971768e+06 1.669517e+06 2.020243e+06 1.284207e+06 9.832759e+05 1.906328e+06 3.727155e+06 2.081685e+06 1.780785e+06 2.348286e+06 2.149472e+06 1.626052e+06 1.733750e+06 1.827719e+06 3.625042e+06 1.994277e+06 1.860888e+06 1.621169e+06 1.823404e+06 2.571418e+06 2.354520e+06 1.696579e+06 1.484463e+06 1.526090e+06 2.012466e+06 5.102120e+06 1.727549e+06 1.934328e+06 2.777038e+06 1.502739e+06 2.190009e+06 1.909545e+06 2.801163e+06 6.623665e+06 2.330535e+06 1.560970e+06 1.811650e+06 1.184623e+06 2.409232e+06 1.438003e+06 2.417858e+06 1.386467e+06 2.286204e+06 2.042061e+06 1.436867e+06 1.759569e+06 3.289522e+06 1.352295e+06 1.518875e+06 1.308326e+06 2.652148e+06 2.980669e+06 1.251165e+06 3.901331e+06 1.679989e+06 1.186947e+06 1.978938e+06 1.811321e+06 1.530221e+06 1.441501e+06 1.382901e+06 1.488553e+06 2.008328e+06 1.524819e+06 1.903159e+06 1.232075e+06 1.778694e+06 1.398482e+06 2.541466e+06 5.804163e+06 1.483305e+06 2.721459e+06 2.101911e+06 2.065606e+06 1.210551e+06 1.208087e+06 1.614715e+06 1.239015e+06 1.584861e+06 1.319226e+06 1.371863e+06 2.077277e+06 1.067155e+06 1.292020e+06 1.575318e+06 1.267137e+06 4.421706e+06 1.484182e+06 1.533748e+06 1.169962e+06 1.126443e+06 1.706097e+06 1.028234e+06 1.488490e+06 1.488806e+06 1.850469e+06 1.696189e+06 1.295217e+06 1.161831e+06 1.112587e+06 1.321260e+06 1.644711e+06 1.351326e+06 1.856756e+06 1.330412e+06 1.596922e+06 1.296259e+06 1.638198e+06 1.692526e+06 1.913832e+06 1.436608e+06 2.054462e+06 9.118690e+05 1.488512e+06 2.271978e+06 1.274607e+06 1.485108e+06 1.536388e+06 1.782164e+06 1.427896e+06 1.538817e+06 1.378061e+06 1.174786e+06 1.758730e+06 1.845666e+06 1.638174e+06 2.064235e+06 1.511580e+06 1.234220e+06 1.476713e+06 1.969615e+06 2.417112e+06 2.112465e+06 2.055314e+06 2.301436e+06 3.080427e+06 9.354779e+05 1.309481e+06 1.628321e+06 2.979837e+06 1.841700e+06 1.326094e+06 9.567700e+05 1.356450e+06 1.425487e+06 1.297104e+06 2.628752e+06 1.264467e+06 1.890537e+06 1.214349e+06 2.085500e+06 1.705505e+06 1.385272e+06 1.513667e+06 1.521530e+06 1.332097e+06 1.450310e+06 1.230287e+06 1.600188e+06 9.175507e+05 4.056299e+06 1.157488e+06 1.486460e+06 1.088450e+06 1.650569e+06 1.612701e+06 1.085403e+06 1.214846e+06 1.470874e+06 2.196792e+06 2.073367e+06 1.081102e+06 1.164299e+06 1.321679e+07 1.425042e+06 1.238989e+06 1.824821e+06 1.532524e+06 1.046521e+06 1.894173e+06 1.282508e+06 1.338853e+06 1.854418e+06 1.899488e+06 1.356671e+06 2.298000e+06 1.730821e+06 1.765722e+06 1.672116e+06 1.682804e+06 1.055781e+06 1.213799e+06 1.001288e+06 1.116146e+06 1.753541e+06 1.757537e+06 1.358495e+06 1.811129e+06 2.016675e+06 2.624806e+06 3.687019e+06 1.531076e+06 1.341507e+06 1.458786e+06 2.015072e+06 1.613436e+06 2.055684e+06 2.612116e+06 1.656849e+06 2.359989e+06 3.624222e+06 1.624508e+06 1.267863e+06 2.049059e+06 2.361054e+06 1.865387e+06 1.812834e+06 C12 H20 O4 P2 S3_8.438 8.312447e+05 1.082660e+06 1.070626e+06 8.538126e+05 1.354074e+05 5.140040e+05 8.297902e+05 9.929290e+05 138057.89 7.555774e+05 9.989283e+05 1.193792e+06 106489.28 7.039410e+05 8.434092e+05 9.300412e+05 1.549531e+05 7.861772e+05 8.593814e+05 8.638790e+05 3.345103e+05 8.067548e+05 9.320223e+05 1.209227e+06 70522.671 7.034930e+05 8.835613e+05 8.940340e+05 1.766515e+04 9.402585e+05 7.254514e+05 9.626780e+05 396504.30 8.993864e+05 8.590845e+05 8.268321e+05 6.831314e+04 8.938073e+05 9.922607e+05 7.417840e+05 1.118063e+05 1.006966e+06 8.415029e+05 9.070929e+05 1.101224e+05 1.017511e+06 7.225814e+05 9.551725e+05 6.022703e+05 1.212907e+05 7.493589e+05 3.668071e+06 1.231323e+06 1.341858e+06 8.264030e+05 1.284282e+06 7.938043e+05 9.638436e+05 1.017085e+06 2.804023e+06 1.246068e+06 8.101849e+05 7.515026e+05 7.713624e+05 1.584639e+06 1.385808e+06 8.286492e+05 7.417759e+05 7.432649e+05 1.025868e+06 3.541862e+06 7.169971e+05 7.276672e+05 2.142604e+06 6.770626e+05 1.367535e+06 7.683153e+05 1.386940e+06 4.204453e+06 1.466464e+06 5.862002e+05 1.395142e+06 4.956002e+05 1.400948e+06 7.031787e+05 1.267384e+06 5.699003e+05 1.116354e+06 9.202677e+05 4.151809e+05 8.783799e+05 1.797720e+06 6.963077e+05 6.265699e+05 4.886750e+05 1.361440e+06 2.258964e+06 5.076436e+05 2.728449e+06 5.759026e+05 6.733992e+05 1.109471e+06 6.273989e+05 8.722044e+05 7.736007e+05 4.426456e+05 1.008539e+06 1.069158e+06 9.039729e+05 1.195614e+06 6.075834e+05 5.142150e+05 4.655317e+05 1.947194e+06 4.077204e+06 4.848420e+05 1.688495e+06 1.148417e+06 1.273060e+06 4.792931e+05 6.365833e+05 7.402673e+05 6.109283e+05 7.240160e+05 4.758920e+05 4.707033e+05 1.512353e+06 4.304399e+05 4.628030e+05 7.730865e+05 8.436541e+05 3.143498e+06 5.780081e+05 5.077236e+05 2.854971e+05 7.661873e+05 8.884769e+05 3.358661e+05 5.515936e+05 4.898996e+05 8.372296e+05 8.596578e+05 5.262961e+05 5.284198e+05 3.752295e+05 5.103607e+05 8.977130e+05 5.906807e+05 1.048697e+06 7.485233e+05 5.737330e+05 5.363330e+05 6.025451e+05 1.687804e+06 1.272785e+06 6.741629e+05 1.154905e+06 2.295635e+05 4.545255e+05 1.020437e+06 5.261853e+05 8.732977e+05 5.853991e+05 5.821305e+05 7.777151e+05 7.317393e+05 1.017574e+06 4.833552e+05 7.240553e+05 8.890313e+05 7.468624e+05 1.179312e+06 6.828366e+05 7.324441e+05 7.127955e+05 1.051071e+06 1.351461e+06 1.393776e+06 1.083785e+06 1.227827e+06 2.398379e+06 2.902858e+05 4.140042e+05 7.550465e+05 1.862044e+06 9.563489e+05 3.930457e+05 2.799759e+05 5.857576e+05 6.624232e+05 5.784317e+05 1.447121e+06 1.608441e+05 1.170905e+06 6.550180e+05 7.900066e+05 7.669532e+05 6.067357e+05 8.379410e+05 7.133175e+05 4.523483e+05 4.738712e+05 6.177551e+05 9.778461e+05 2.585855e+05 2.551574e+06 4.902195e+05 6.517800e+05 3.783364e+05 8.750341e+05 8.876280e+05 2.403977e+05 4.974174e+05 5.608295e+05 1.279300e+06 8.264992e+05 4.814292e+05 1.629838e+05 9.102603e+06 5.832555e+05 5.083065e+05 7.594650e+05 6.180543e+05 4.068624e+05 8.585813e+05 3.951519e+05 6.304578e+05 8.875212e+05 1.220592e+06 7.158209e+05 1.395174e+06 5.839924e+05 9.630789e+05 6.421526e+05 8.007953e+05 4.703332e+05 6.397223e+05 4.053181e+05 4.296008e+05 5.652574e+05 7.658297e+05 5.498103e+05 9.967986e+05 1.120977e+06 1.424647e+06 2.694641e+06 8.281004e+05 6.656290e+05 5.647579e+05 9.550084e+05 6.875584e+05 1.121065e+06 1.411189e+06 4.933560e+05 1.546858e+06 2.828092e+06 6.694945e+05 7.600366e+05 1.058632e+06 1.786703e+06 9.012198e+05 1.095315e+06 C8 H3 N O5_8.439 7.910719e+05 1.017043e+06 1.120721e+06 7.892650e+05 9.185045e+04 4.854321e+05 8.353893e+05 9.993878e+05 191531.33 7.682317e+05 9.477642e+05 9.814085e+05 92866.10 7.859702e+05 7.927210e+05 9.309523e+05 1.317951e+05 8.190114e+05 9.453041e+05 8.143681e+05 2.906951e+05 6.847865e+05 9.397303e+05 1.193756e+06 13250.074 6.562054e+05 9.147426e+05 7.663943e+05 1.541102e+04 9.366433e+05 7.418304e+05 8.853699e+05 325054.42 9.278208e+05 9.179985e+05 8.001166e+05 5.437620e+04 8.074343e+05 9.528170e+05 7.782836e+05 9.134106e+04 9.419706e+05 8.147700e+05 8.917241e+05 2.540266e+05 1.007875e+06 6.908616e+05 9.325155e+05 5.519832e+05 1.329367e+05 6.981124e+05 2.731115e+06 1.145299e+06 1.309174e+06 8.818303e+05 1.185220e+06 7.743694e+05 8.909619e+05 9.420777e+05 2.831451e+06 1.136143e+06 7.792587e+05 7.584120e+05 7.524779e+05 1.581066e+06 1.268000e+06 8.835354e+05 6.477211e+05 7.877436e+05 1.062434e+06 2.200078e+06 7.653720e+05 6.520516e+05 1.900860e+06 6.861467e+05 1.462443e+06 7.958530e+05 1.655566e+06 4.552020e+06 1.478845e+06 5.706137e+05 1.328311e+06 5.486487e+05 1.338300e+06 6.885568e+05 1.243965e+06 5.941809e+05 1.152521e+06 9.581085e+05 5.490156e+05 7.957480e+05 1.752852e+06 6.720611e+05 6.975838e+05 4.689968e+05 1.356261e+06 2.165624e+06 4.255632e+05 2.492060e+06 5.703069e+05 5.996391e+05 1.051861e+06 7.963474e+05 8.359763e+05 7.258583e+05 4.363766e+05 9.834337e+05 9.119839e+05 9.540169e+05 1.181321e+06 6.402164e+05 5.992544e+05 5.112906e+05 1.940382e+06 3.644850e+06 4.616561e+05 1.621715e+06 1.158253e+06 1.210781e+06 4.746416e+05 7.171197e+05 7.197791e+05 5.868269e+05 7.476825e+05 4.571006e+05 4.520924e+05 9.762037e+05 4.155870e+05 5.300219e+05 7.590255e+05 8.743709e+05 3.039480e+06 5.930574e+05 5.181296e+05 2.604731e+05 7.292431e+05 8.573949e+05 4.175591e+05 5.880499e+05 5.609766e+05 7.761003e+05 8.855580e+05 5.289650e+05 5.222083e+05 3.302216e+05 4.420643e+05 8.623247e+05 5.343232e+05 1.014952e+06 7.004231e+05 5.996628e+05 5.807015e+05 6.442362e+05 1.723196e+06 1.268941e+06 6.610134e+05 1.336786e+06 2.369389e+05 4.714688e+05 9.643491e+05 5.237179e+05 8.917702e+05 5.730619e+05 5.655439e+05 7.374267e+05 7.300578e+05 1.005929e+06 4.205436e+05 7.357035e+05 8.088963e+05 7.775057e+05 1.108415e+06 6.560783e+05 7.453520e+05 5.136636e+05 1.007903e+06 1.226969e+06 1.405646e+06 1.090620e+06 1.131812e+06 2.237176e+06 2.734680e+05 3.830924e+05 7.535488e+05 1.879860e+06 8.643277e+05 3.734804e+05 2.706705e+05 4.687300e+05 6.089994e+05 5.801937e+05 1.447152e+06 1.392267e+05 1.098796e+06 5.328605e+05 7.940591e+05 7.380702e+05 6.146025e+05 8.420152e+05 7.375387e+05 5.142636e+05 4.877689e+05 5.524677e+05 7.924853e+05 2.733882e+05 2.482603e+06 4.834820e+05 6.100753e+05 3.818271e+05 7.883050e+05 8.523923e+05 3.042884e+05 5.169013e+05 5.587467e+05 1.167433e+06 9.559694e+05 4.243640e+05 1.634941e+05 1.099604e+07 6.116599e+05 5.032613e+05 7.943080e+05 5.978648e+05 3.381820e+05 8.893762e+05 4.217029e+05 5.791920e+05 8.288515e+05 1.249331e+06 6.786251e+05 1.407851e+06 5.610357e+05 8.771408e+05 6.490896e+05 8.028697e+05 4.635260e+05 5.993790e+05 3.414991e+05 4.225107e+05 6.362832e+05 8.701117e+05 4.502290e+05 9.787569e+05 1.038480e+06 1.397967e+06 2.179800e+06 8.425449e+05 6.632967e+05 5.588984e+05 8.913700e+05 7.048755e+05 1.103261e+06 1.609696e+06 4.512471e+05 1.440069e+06 2.883200e+06 5.634662e+05 5.991274e+05 1.116782e+06 1.724484e+06 8.885961e+05 1.107311e+06 C4 H4 N2 O12 S_8.44 6.705564e+06 6.961945e+06 7.691388e+06 7.363119e+06 8.319844e+05 5.023133e+06 7.370832e+06 7.377704e+06 334063.21 7.074971e+06 7.281683e+06 7.367349e+06 668183.23 6.258512e+06 6.559617e+06 7.232927e+06 5.372458e+05 6.955382e+06 7.129157e+06 6.850912e+06 1.581361e+05 5.755828e+06 7.707726e+06 8.447610e+06 55426.223 5.975488e+06 7.129431e+06 6.976658e+06 4.719503e+04 6.324039e+06 7.080968e+06 8.148186e+06 860898.93 6.060720e+06 6.391417e+06 7.009524e+06 5.526985e+05 7.170102e+06 7.159655e+06 7.837722e+06 3.066922e+05 5.759772e+06 7.413302e+06 7.737818e+06 3.034071e+05 6.052070e+06 5.879467e+06 7.921069e+06 4.350901e+06 2.606797e+06 6.307277e+06 2.439079e+07 8.748326e+06 9.486641e+06 7.759354e+06 9.769986e+06 6.343840e+06 5.999863e+06 8.430543e+06 1.898788e+07 7.927133e+06 6.122242e+06 5.472032e+06 7.697775e+06 1.270393e+07 1.034386e+07 6.281070e+06 5.492966e+06 5.408457e+06 6.863707e+06 2.453380e+07 6.002530e+06 7.222377e+06 1.608165e+07 4.603370e+06 9.402252e+06 6.437780e+06 1.037580e+07 3.255048e+07 9.896069e+06 5.914083e+06 8.509642e+06 4.975519e+06 1.088698e+07 6.107717e+06 1.113851e+07 4.225644e+06 8.880149e+06 7.754205e+06 5.705512e+06 6.858866e+06 1.476174e+07 4.703521e+06 6.063400e+06 4.707254e+06 1.087826e+07 1.603359e+07 4.379728e+06 1.988043e+07 5.948558e+06 3.205263e+06 8.042830e+06 6.400813e+06 6.736352e+06 5.576253e+06 5.165954e+06 5.872280e+06 8.267646e+06 5.732570e+06 7.553842e+06 3.674590e+06 6.604938e+06 4.404511e+06 1.416426e+07 2.905218e+07 5.552301e+06 1.188326e+07 9.180900e+06 8.472025e+06 4.706210e+06 4.059259e+06 6.621668e+06 5.229099e+06 5.435660e+06 5.430729e+06 5.639880e+06 8.182522e+06 3.847664e+06 4.369590e+06 4.608074e+06 5.237804e+06 2.383180e+07 5.257234e+06 5.545391e+06 3.237012e+06 3.887463e+06 6.444229e+06 2.962822e+06 4.695039e+06 4.658881e+06 7.341307e+06 5.561658e+06 4.850353e+06 4.001426e+06 4.043370e+06 4.523284e+06 6.950740e+06 4.533707e+06 7.190834e+06 5.165248e+06 5.442917e+06 4.144610e+06 5.496201e+06 9.695279e+06 7.235885e+06 5.386185e+06 8.372458e+06 3.071084e+06 4.443946e+06 6.798515e+06 4.778711e+06 6.671027e+06 5.182350e+06 5.581768e+06 5.608920e+06 5.622491e+06 8.018256e+06 4.171417e+06 7.470294e+06 7.961553e+06 6.259288e+06 7.383679e+06 5.705464e+06 4.731737e+06 4.895745e+06 7.968360e+06 9.883817e+06 9.355632e+06 8.488734e+06 8.800124e+06 1.770943e+07 2.852392e+06 4.039941e+06 5.954498e+06 1.456465e+07 7.331332e+06 3.336281e+06 2.876600e+06 4.389378e+06 4.848207e+06 3.655926e+06 1.115203e+07 6.332024e+05 8.814806e+06 5.325819e+06 6.143894e+06 6.299561e+06 4.384289e+06 5.800056e+06 5.923716e+06 5.016643e+06 4.156596e+06 4.990200e+06 6.056327e+06 3.275314e+06 1.879074e+07 3.826328e+06 5.544148e+06 3.105868e+06 7.121664e+06 6.349933e+06 3.896236e+06 3.369518e+06 4.647445e+06 8.715633e+06 7.810941e+06 3.137349e+06 3.346585e+06 6.802267e+07 3.850472e+06 3.893252e+06 6.140482e+06 5.431876e+06 3.528948e+06 6.591326e+06 4.183048e+06 5.117735e+06 8.048815e+06 8.881599e+06 4.936350e+06 1.049839e+07 6.995179e+06 6.942918e+06 6.726356e+06 6.265053e+06 4.201017e+06 4.997895e+06 3.274862e+06 3.378348e+06 6.862939e+06 6.523365e+06 4.827077e+06 7.498730e+06 7.815796e+06 1.119651e+07 1.735410e+07 5.394739e+06 5.363347e+06 5.393405e+06 6.657231e+06 5.636622e+06 9.715235e+06 1.204026e+07 5.163648e+06 1.137830e+07 1.974176e+07 6.044443e+06 4.942605e+06 8.033694e+06 1.327159e+07 7.058596e+06 7.125374e+06 N-ALPHA-ACETYLLYSINE 1.583624e+06 2.060901e+06 1.484262e+06 1.352560e+06 1.407636e+05 8.224244e+05 1.617465e+06 1.559720e+06 137046.06 1.422229e+06 1.561455e+06 1.589075e+06 119389.27 1.244789e+06 1.627576e+06 1.485811e+06 1.656631e+05 1.441368e+06 1.385076e+06 1.603650e+06 6.509566e+04 1.219568e+06 1.632566e+06 1.709105e+06 16649.908 1.385701e+06 1.366989e+06 1.397011e+06 2.072103e+04 1.439729e+06 1.383775e+06 1.921466e+06 117463.87 1.412811e+06 1.363227e+06 1.333643e+06 6.938939e+04 1.460884e+06 1.465905e+06 1.716966e+06 1.248597e+05 1.452691e+06 1.468339e+06 1.419249e+06 1.333492e+05 1.420814e+06 1.297731e+06 1.668975e+06 1.810943e+06 1.044876e+06 1.189591e+06 2.629492e+06 1.363798e+06 1.900414e+06 1.750970e+06 2.577804e+06 1.879416e+06 2.080717e+06 2.789906e+06 2.393973e+06 2.144351e+06 2.641980e+06 1.708226e+06 1.718081e+06 1.796892e+06 1.120894e+06 1.585943e+06 1.278288e+06 1.500567e+06 1.256231e+06 2.471813e+06 1.613015e+06 1.683785e+06 1.315705e+06 1.599330e+06 2.429336e+06 1.219212e+06 1.558880e+06 4.328658e+06 1.927676e+06 3.142298e+06 1.484752e+06 9.158538e+05 1.116547e+06 9.753868e+05 1.217164e+06 1.125966e+06 1.551177e+06 1.272973e+06 9.158105e+05 2.669779e+06 1.877849e+06 1.665041e+06 1.447023e+06 1.587331e+06 2.148397e+06 2.086345e+06 1.721359e+06 2.622269e+06 9.362396e+05 1.052845e+06 2.157486e+06 1.100901e+06 2.067115e+06 9.706796e+05 1.256272e+06 1.053172e+06 1.547952e+06 2.848563e+06 1.360776e+06 8.745200e+05 8.819303e+05 1.572847e+06 2.004310e+06 2.388466e+06 1.031020e+06 1.525226e+06 2.288809e+06 1.434011e+06 2.068351e+06 9.831407e+05 8.650931e+05 5.312348e+05 1.002834e+06 8.687221e+05 9.609213e+05 7.229266e+05 8.134725e+05 1.726268e+06 1.559058e+06 1.471511e+06 1.752788e+06 1.057068e+06 2.269967e+06 1.456214e+06 1.059083e+06 1.843523e+06 1.511267e+06 1.095236e+06 1.510378e+06 1.605295e+06 1.641780e+06 1.517183e+06 1.598012e+06 1.826613e+06 1.447511e+06 1.483918e+06 1.440440e+06 1.512682e+06 7.042743e+05 7.668410e+05 1.077778e+06 2.326260e+06 1.703376e+06 1.224437e+06 1.373011e+06 1.747008e+06 9.737610e+05 1.067554e+06 1.259996e+06 1.109024e+06 2.599404e+06 1.205460e+06 1.096996e+06 1.053160e+06 1.202108e+06 1.064889e+06 1.370010e+06 1.010673e+06 1.182796e+06 1.209327e+06 1.165255e+06 1.355328e+06 1.303043e+06 1.036416e+06 1.822790e+06 1.260968e+06 8.951846e+05 3.197998e+06 2.099343e+06 1.361613e+06 8.772269e+05 8.910246e+05 1.831818e+06 1.636195e+06 1.089173e+06 1.036010e+06 1.622354e+06 1.420604e+06 9.932149e+05 1.209396e+06 1.725449e+06 3.907034e+06 1.512240e+06 1.141488e+06 1.369090e+06 1.679786e+06 1.753588e+06 1.160291e+06 1.444766e+06 1.376229e+06 1.448148e+06 8.947934e+05 1.517142e+06 1.050281e+06 2.229265e+06 1.446936e+06 1.038074e+06 8.770271e+05 1.073882e+06 1.566110e+06 1.436881e+06 1.141295e+06 8.227668e+05 8.999253e+05 1.823449e+06 8.139372e+05 1.055169e+06 3.338751e+06 1.282045e+06 1.197055e+06 1.401307e+06 1.734475e+06 6.034581e+05 1.589579e+06 1.053305e+06 1.209225e+06 1.918174e+06 1.317378e+06 1.440149e+06 2.443506e+06 9.524262e+05 1.199422e+06 1.322206e+06 1.638538e+06 1.059710e+06 1.345644e+06 1.366900e+06 1.005891e+06 1.698662e+06 2.100521e+06 1.261074e+06 1.836543e+06 1.508192e+06 1.737051e+06 1.838166e+06 1.318418e+06 7.921266e+05 2.237283e+06 1.632863e+06 2.042292e+06 1.246123e+06 1.882973e+06 1.908542e+06 1.654100e+06 1.590981e+06 8.436363e+05 3.122164e+06 1.488077e+06 2.061932e+06 1.120639e+06 1.894227e+06 C3 H7 O7 P S_8.441 1.638734e+06 1.369846e+06 1.373718e+06 1.390919e+06 1.650050e+05 6.421379e+05 1.248264e+06 1.479151e+06 145939.80 1.153507e+06 1.333324e+06 1.361149e+06 127016.77 1.108493e+06 1.094314e+06 1.185125e+06 1.744959e+05 1.266550e+06 1.212879e+06 1.074540e+06 6.460447e+04 1.426513e+06 1.263876e+06 1.474240e+06 16728.038 1.058981e+06 1.188132e+06 1.291667e+06 2.213694e+04 1.248704e+06 1.107209e+06 1.429053e+06 132411.00 1.096422e+06 1.138299e+06 1.195499e+06 7.146380e+04 1.207974e+06 1.445141e+06 1.357049e+06 1.166736e+05 1.100836e+06 1.278825e+06 1.288981e+06 1.227215e+05 1.082610e+06 1.089815e+06 1.390310e+06 8.458754e+05 6.797255e+05 1.171649e+06 2.870161e+06 1.660041e+06 1.602734e+06 1.311948e+06 1.627383e+06 1.184355e+06 1.566832e+06 1.420647e+06 2.475790e+06 1.507804e+06 1.432830e+06 1.146882e+06 1.132611e+06 1.771923e+06 1.633714e+06 1.142955e+06 1.063010e+06 1.239152e+06 1.416091e+06 3.091740e+06 1.288948e+06 1.305339e+06 2.017416e+06 1.112610e+06 1.381965e+06 1.780709e+06 1.489337e+06 2.776404e+06 1.715791e+06 1.023034e+06 1.398208e+06 8.519397e+05 1.580568e+06 9.454193e+05 1.477318e+06 9.451825e+05 1.316919e+06 1.149980e+06 9.713749e+05 1.206116e+06 1.944770e+06 9.381849e+05 1.130594e+06 1.042216e+06 1.613392e+06 2.203064e+06 9.046939e+05 2.062158e+06 1.045279e+06 7.703697e+05 1.354360e+06 1.116462e+06 1.204943e+06 1.072449e+06 1.099409e+06 1.206163e+06 1.433285e+06 1.484110e+06 1.369287e+06 8.662841e+05 1.205034e+06 1.038958e+06 1.978848e+06 2.947166e+06 1.029389e+06 1.663040e+06 1.443754e+06 1.600864e+06 8.684774e+05 7.537876e+05 1.088679e+06 9.395122e+05 1.290675e+06 1.047447e+06 9.711186e+05 1.413746e+06 8.417964e+05 1.015721e+06 9.844337e+05 9.557285e+05 2.276785e+06 9.174914e+05 1.061766e+06 6.956798e+05 7.599994e+05 1.140930e+06 5.657545e+05 1.012833e+06 9.846625e+05 1.186480e+06 1.237568e+06 9.059916e+05 8.550431e+05 8.990979e+05 1.077302e+06 1.247000e+06 1.107136e+06 1.571945e+06 1.028402e+06 1.142028e+06 9.885577e+05 1.080495e+06 1.843034e+06 1.238754e+06 9.609101e+05 1.504373e+06 9.473840e+05 9.306379e+05 1.290767e+06 1.168393e+06 1.356601e+06 8.873575e+05 1.109277e+06 1.048288e+06 1.046745e+06 1.665318e+06 8.291371e+05 1.483597e+06 1.249475e+06 1.253331e+06 1.199173e+06 1.198314e+06 1.145661e+06 9.022435e+05 1.205655e+06 1.779219e+06 1.782597e+06 1.439661e+06 1.262970e+06 1.821293e+06 8.951738e+05 9.081271e+05 1.064594e+06 1.860362e+06 1.218667e+06 7.987778e+05 7.585276e+05 1.006048e+06 1.008948e+06 7.610424e+05 1.624318e+06 1.437645e+05 1.214636e+06 9.250796e+05 1.177069e+06 1.555005e+06 9.603884e+05 1.256450e+06 1.196929e+06 9.081503e+05 1.120176e+06 8.923661e+05 1.156185e+06 7.701031e+05 2.263163e+06 7.391377e+05 1.072200e+06 6.344863e+05 1.304787e+06 1.202052e+06 7.559105e+05 6.808913e+05 9.256635e+05 1.674854e+06 1.160896e+06 7.706102e+05 6.551962e+05 4.639116e+06 6.959209e+05 9.211468e+05 1.208869e+06 1.184552e+06 5.996673e+05 1.200280e+06 8.375820e+05 9.474857e+05 1.295555e+06 1.420675e+06 1.048091e+06 1.364747e+06 1.079400e+06 1.382023e+06 1.100716e+06 1.149350e+06 7.246764e+05 1.013591e+06 7.088705e+05 7.090644e+05 1.220655e+06 1.245760e+06 9.060648e+05 1.382329e+06 1.671023e+06 1.526562e+06 2.384992e+06 1.196247e+06 1.355377e+06 1.000250e+06 1.189667e+06 1.124208e+06 1.824671e+06 1.604424e+06 1.021155e+06 2.580504e+06 2.370244e+06 9.703933e+05 8.859005e+05 1.435100e+06 1.807408e+06 1.342843e+06 1.388704e+06 C4 H8 N10 O P2 S_8.443 2.245376e+06 2.162506e+06 2.708966e+06 2.648548e+06 1.163280e+05 1.625951e+06 2.264381e+06 2.358780e+06 113869.88 2.181138e+06 3.480371e+06 2.257256e+06 100517.53 1.832869e+06 2.024885e+06 2.500429e+06 1.372123e+05 2.190255e+06 2.111387e+06 2.632136e+06 5.497722e+04 2.636658e+06 2.086710e+06 2.526697e+06 14469.918 2.077955e+06 2.272563e+06 2.482821e+06 1.792591e+04 2.459391e+06 2.397125e+06 2.497265e+06 106947.38 2.076706e+06 2.135621e+06 2.187049e+06 5.615835e+04 2.178977e+06 2.749657e+06 2.478898e+06 9.419809e+04 2.245679e+06 2.443587e+06 2.578631e+06 1.026917e+05 2.030206e+06 2.060988e+06 2.536693e+06 2.059231e+06 1.349425e+06 2.152908e+06 5.250996e+06 2.680878e+06 2.762384e+06 2.323500e+06 3.179207e+06 2.393316e+06 3.123402e+06 2.607674e+06 7.025210e+06 2.886815e+06 2.385093e+06 2.082769e+06 1.970656e+06 3.103731e+06 3.239976e+06 2.847833e+06 2.018451e+06 1.888701e+06 2.523779e+06 5.093408e+06 2.257240e+06 2.758543e+06 4.243201e+06 1.991112e+06 2.969211e+06 2.105017e+06 2.711682e+06 5.140187e+06 2.948299e+06 2.011513e+06 2.532334e+06 1.693556e+06 2.775484e+06 1.880911e+06 2.859073e+06 1.622079e+06 2.563826e+06 2.367123e+06 1.635021e+06 2.547374e+06 3.065971e+06 1.984674e+06 1.987769e+06 1.676640e+06 3.009627e+06 2.724993e+06 1.653109e+06 4.183583e+06 1.754360e+06 1.124444e+06 2.256316e+06 1.875166e+06 2.059552e+06 2.207228e+06 2.026790e+06 2.354882e+06 3.822559e+06 2.461702e+06 2.679713e+06 1.517002e+06 1.992382e+06 2.214128e+06 2.301907e+06 4.212706e+06 2.293065e+06 2.819733e+06 2.428678e+06 3.222162e+06 1.531463e+06 1.499257e+06 2.003484e+06 1.786129e+06 1.733725e+06 1.836125e+06 1.901320e+06 2.977842e+06 1.694269e+06 1.312072e+06 1.865841e+06 1.975213e+06 4.874752e+06 1.832837e+06 1.973342e+06 1.358739e+06 1.436686e+06 2.211887e+06 1.259262e+06 1.643082e+06 2.152499e+06 2.152725e+06 1.942660e+06 1.945431e+06 1.527028e+06 1.693293e+06 1.742541e+06 2.195807e+06 1.913474e+06 2.880871e+06 1.940185e+06 2.325708e+06 1.748905e+06 1.975136e+06 4.231869e+06 2.279895e+06 1.939690e+06 3.005542e+06 1.586370e+06 1.548220e+06 2.110768e+06 2.064768e+06 2.732512e+06 1.924387e+06 1.956021e+06 2.694574e+06 1.924855e+06 2.678590e+06 2.057309e+06 2.631929e+06 2.178767e+06 2.067408e+06 2.242929e+06 1.826264e+06 1.886148e+06 1.960166e+06 2.440690e+06 3.197087e+06 2.678937e+06 2.606329e+06 2.541105e+06 3.819934e+06 2.422430e+06 1.554024e+06 1.971350e+06 3.429917e+06 2.394143e+06 1.928701e+06 1.583799e+06 1.702240e+06 2.915092e+06 1.644243e+06 2.514912e+06 3.428520e+05 2.296487e+06 1.690138e+06 1.985077e+06 2.052870e+06 1.700957e+06 2.404877e+06 2.065222e+06 1.919652e+06 1.873493e+06 1.956161e+06 1.891112e+06 1.365094e+06 3.115348e+06 1.650189e+06 1.847778e+06 1.105950e+06 2.567697e+06 2.406327e+06 1.393545e+06 1.354243e+06 1.796043e+06 3.159623e+06 1.994466e+06 1.871766e+06 1.119368e+06 9.428135e+06 1.590749e+06 1.710314e+06 2.127632e+06 2.172261e+06 1.242404e+06 2.059270e+06 1.600747e+06 2.037842e+06 2.152319e+06 2.311536e+06 2.029935e+06 2.545560e+06 2.055838e+06 2.497955e+06 2.009455e+06 2.279095e+06 1.304336e+06 2.614262e+06 1.398901e+06 1.562837e+06 1.936720e+06 2.472610e+06 1.687716e+06 2.525892e+06 2.457323e+06 1.922499e+06 6.668378e+06 2.330067e+06 2.402889e+06 1.792697e+06 2.103083e+06 1.995674e+06 3.022016e+06 2.874999e+06 1.957844e+06 3.815441e+06 4.640910e+06 1.880753e+06 1.486482e+06 2.343792e+06 3.340178e+06 2.395726e+06 2.571162e+06 C10 H8 N9 O3 P S3_8.444 8.846877e+05 1.331115e+06 1.548334e+06 1.558083e+06 1.725819e+05 1.003903e+06 1.573439e+06 1.594361e+06 171831.69 1.343325e+06 1.429706e+06 1.587979e+06 160165.01 1.166960e+06 1.298272e+06 1.502485e+06 2.079111e+05 1.455573e+06 1.476905e+06 1.523585e+06 8.415168e+04 8.145099e+05 1.752714e+06 1.686363e+06 21246.401 1.343445e+06 1.385038e+06 1.256261e+06 2.502536e+04 1.260939e+06 1.565338e+06 1.382610e+06 165644.62 1.416090e+06 1.389206e+06 1.385973e+06 9.145653e+04 1.581709e+06 1.361302e+06 1.426600e+06 1.674041e+05 1.298307e+06 1.384281e+06 1.420919e+06 1.632091e+05 1.579252e+06 1.240858e+06 1.489037e+06 8.676219e+05 3.595438e+05 1.206535e+06 5.533663e+06 2.018441e+06 1.767892e+06 1.705660e+06 1.978326e+06 1.078108e+06 9.671068e+05 1.451008e+06 4.346035e+06 1.414564e+06 1.414378e+06 8.097113e+05 1.487126e+06 3.058012e+06 2.344414e+06 1.226850e+06 9.505374e+05 1.111564e+06 1.697867e+06 6.353606e+06 1.118859e+06 1.275449e+06 3.372605e+06 9.314151e+05 2.068858e+06 1.335232e+06 2.432338e+06 9.481571e+06 1.978552e+06 1.045522e+06 2.321559e+06 8.201541e+05 1.762414e+06 1.165136e+06 2.570882e+06 8.277889e+05 2.186590e+06 1.618061e+06 9.712165e+05 1.380677e+06 3.335968e+06 8.200418e+05 1.007436e+06 9.139342e+05 2.427366e+06 3.044094e+06 9.775951e+05 5.370477e+06 1.191314e+06 7.104573e+05 2.155976e+06 1.341687e+06 1.417049e+06 9.168904e+05 1.002735e+06 1.073886e+06 1.701923e+06 1.002794e+06 1.542218e+06 6.069275e+05 1.586529e+06 6.723651e+05 3.303258e+06 9.184414e+06 9.777120e+05 2.827212e+06 2.225526e+06 1.770484e+06 7.369661e+05 8.115273e+05 1.277280e+06 8.651531e+05 1.016747e+06 1.042887e+06 1.106293e+06 1.613125e+06 7.196825e+05 8.215298e+05 8.674450e+05 1.055393e+06 6.522809e+06 9.996846e+05 1.163842e+06 5.765075e+05 8.438914e+05 1.450311e+06 5.009318e+05 8.659342e+05 9.070670e+05 1.707926e+06 1.280766e+06 8.974397e+05 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3.933363e+06 3.789495e+06 4.532816e+06 3.508857e+06 3.387596e+06 4.161231e+06 8.579710e+06 3.823285e+06 3.791196e+06 5.245120e+06 5.892379e+06 4.468655e+06 4.328363e+06 4.300971e+06 8.368453e+06 5.433698e+06 3.852510e+06 5.574503e+06 5.574760e+06 4.746549e+06 5.206917e+06 4.554334e+06 3.130181e+06 3.652688e+06 5.162497e+06 7.334301e+06 4.832105e+06 4.825695e+06 4.224008e+06 4.156341e+06 4.409837e+06 3.558925e+06 5.210837e+06 6.550186e+06 5.264347e+06 3.671367e+06 4.998541e+06 3.862238e+06 4.413581e+06 3.928778e+06 4.112532e+06 3.236891e+06 4.541398e+06 2.920697e+06 3.794647e+06 4.668095e+06 5.026351e+06 4.090952e+06 4.805268e+06 3.151306e+06 5.128502e+06 3.836297e+06 3.229131e+06 3.399691e+06 4.148418e+06 3.531591e+06 4.445365e+06 3.615933e+06 3.805296e+06 3.721614e+06 4.010196e+06 4.076383e+06 5.174592e+06 5.874971e+06 4.738737e+06 3.378535e+06 4.313319e+06 3.348075e+06 5.136187e+06 6.111619e+06 3.776270e+06 5.716359e+06 4.667246e+06 5.314174e+06 3.746530e+06 3.088897e+06 3.680714e+06 2.567213e+06 3.841481e+06 3.680706e+06 3.758412e+06 4.448652e+06 2.626255e+06 3.650560e+06 3.738174e+06 3.023092e+06 5.690020e+06 3.494880e+06 3.724898e+06 3.248518e+06 3.141867e+06 3.660074e+06 2.977007e+06 3.037340e+06 4.098714e+06 4.068053e+06 4.065490e+06 4.229187e+06 3.538435e+06 3.580227e+06 3.869327e+06 3.691355e+06 4.184499e+06 5.087267e+06 3.878029e+06 4.734752e+06 4.278917e+06 4.768785e+06 6.275516e+06 4.816415e+06 2.892408e+06 4.865561e+06 3.079193e+06 3.687743e+06 4.712248e+06 4.540686e+06 4.410927e+06 4.158351e+06 2.626697e+06 4.244407e+06 4.083376e+06 5.217226e+06 3.180628e+06 4.504222e+06 4.431264e+06 5.371851e+06 4.819125e+06 3.786095e+06 3.646785e+06 4.029719e+06 4.401433e+06 6.120746e+06 4.169056e+06 5.113425e+06 4.222941e+06 4.261210e+06 3.137909e+06 3.455741e+06 3.642746e+06 4.702854e+06 4.167114e+06 3.125693e+06 2.829962e+06 2.583725e+06 3.218631e+06 3.507305e+06 4.783894e+06 1.475656e+05 4.411004e+06 3.134464e+06 5.124168e+06 6.152133e+06 2.957637e+06 4.856461e+06 4.021201e+06 5.779645e+06 3.045353e+06 3.874881e+06 4.146316e+06 2.843571e+06 5.574198e+06 3.389103e+06 3.222637e+06 3.073204e+06 3.853910e+06 4.191856e+06 3.183205e+06 3.074653e+06 3.067465e+06 3.922460e+06 4.660877e+06 3.116206e+06 3.120400e+06 7.651647e+06 3.355057e+06 3.315444e+06 4.301893e+06 3.844639e+06 2.688376e+06 3.037266e+06 3.160889e+06 4.139085e+06 3.878746e+06 4.861355e+06 3.836164e+06 3.740902e+06 3.956412e+06 4.356501e+06 4.106211e+06 4.355040e+06 3.178573e+06 3.838005e+06 3.253045e+06 3.228446e+06 4.395401e+06 4.590415e+06 3.503734e+06 4.581174e+06 4.940741e+06 4.241034e+06 4.189972e+06 4.913494e+06 3.806387e+06 2.669242e+06 4.029242e+06 4.128787e+06 3.857813e+06 5.271739e+06 3.700316e+06 5.918904e+06 4.845858e+06 3.822202e+06 3.289448e+06 5.161074e+06 4.293574e+06 5.063983e+06 3.572638e+06 TAURINE 1.881759e+08 2.141216e+08 2.220506e+08 2.199711e+08 1.030700e+06 1.352176e+08 2.229201e+08 2.198716e+08 586923.47 1.985616e+08 2.109399e+08 2.231047e+08 814967.30 1.847649e+08 2.007038e+08 2.055113e+08 8.302036e+05 1.949897e+08 2.063110e+08 2.115880e+08 6.723810e+05 1.733097e+08 2.209624e+08 2.449488e+08 67483.218 1.885045e+08 1.977044e+08 1.965572e+08 8.470047e+04 1.912741e+08 2.046831e+08 2.240856e+08 599201.48 2.024351e+08 2.034843e+08 1.963539e+08 6.648887e+05 2.066073e+08 1.919054e+08 2.126450e+08 4.996413e+05 2.085742e+08 2.051081e+08 2.131061e+08 8.600777e+05 2.002755e+08 1.874629e+08 2.155765e+08 1.592301e+08 1.040949e+08 1.921282e+08 4.976693e+08 2.400368e+08 2.407519e+08 2.400548e+08 2.501753e+08 1.888479e+08 1.944332e+08 2.330458e+08 3.895271e+08 2.269748e+08 2.138828e+08 1.705510e+08 2.182392e+08 3.137473e+08 2.637909e+08 1.957296e+08 1.767035e+08 1.766266e+08 2.124524e+08 5.407476e+08 1.884766e+08 2.160469e+08 3.362480e+08 1.675715e+08 2.502315e+08 1.996230e+08 3.113042e+08 6.686710e+08 2.959513e+08 1.807710e+08 2.553944e+08 1.524826e+08 2.600512e+08 1.757454e+08 2.816581e+08 1.428972e+08 2.393029e+08 2.175661e+08 1.607881e+08 1.936034e+08 3.631856e+08 1.591829e+08 1.609714e+08 1.587027e+08 2.968394e+08 3.810520e+08 1.604838e+08 4.363296e+08 1.767592e+08 1.103686e+08 2.292625e+08 1.892041e+08 1.948417e+08 1.674510e+08 1.622162e+08 1.809016e+08 2.081869e+08 1.692139e+08 2.143401e+08 1.443492e+08 1.964403e+08 1.476415e+08 3.297516e+08 5.986594e+08 1.787238e+08 3.054804e+08 2.394817e+08 2.292072e+08 1.495840e+08 1.422893e+08 1.822074e+08 1.070055e+08 1.833188e+08 1.607571e+08 1.643207e+08 2.467860e+08 1.307692e+08 1.517986e+08 1.598664e+08 1.549741e+08 5.006307e+08 1.630823e+08 1.685517e+08 1.217556e+08 1.263253e+08 1.969130e+08 1.133466e+08 1.574207e+08 1.654873e+08 2.067190e+08 1.931159e+08 1.579903e+08 1.288113e+08 1.412270e+08 1.481105e+08 2.033881e+08 1.652688e+08 1.991628e+08 1.544432e+08 1.789801e+08 1.421980e+08 1.650471e+08 2.104163e+08 2.090558e+08 1.713414e+08 2.431651e+08 1.166093e+08 1.655972e+08 2.011502e+08 1.559458e+08 2.016235e+08 1.598538e+08 1.719859e+08 1.672137e+08 1.796616e+08 1.933013e+08 1.460431e+08 2.058480e+08 2.303023e+08 1.755801e+08 2.179718e+08 1.766030e+08 1.444644e+08 1.459343e+08 2.143439e+08 2.619670e+08 2.989683e+08 2.221588e+08 2.529324e+08 3.917442e+08 1.063008e+08 1.453437e+08 1.898828e+08 3.336295e+08 2.135110e+08 1.209974e+08 1.164086e+08 1.627559e+08 1.591819e+08 1.403478e+08 2.993783e+08 1.560529e+08 2.392603e+08 1.593079e+08 2.030627e+08 1.962062e+08 1.637360e+08 1.677039e+08 1.853624e+08 1.631691e+08 1.492915e+08 1.611354e+08 1.843121e+08 1.166774e+08 4.296592e+08 1.297729e+08 1.816307e+08 1.227004e+08 2.015683e+08 2.001289e+08 1.266601e+08 1.277963e+08 1.521073e+08 2.590475e+08 2.195166e+08 1.193420e+08 1.240114e+08 1.382722e+09 1.501333e+08 1.422899e+08 1.834056e+08 1.768927e+08 1.185540e+08 1.892431e+08 1.348378e+08 1.641247e+08 2.180814e+08 2.391313e+08 1.627046e+08 2.855906e+08 1.953132e+08 2.000399e+08 1.927886e+08 1.910294e+08 1.383894e+08 1.600877e+08 1.186099e+08 1.214703e+08 2.134395e+08 1.859878e+08 1.582058e+08 2.000776e+08 2.302102e+08 2.726586e+08 3.881217e+08 1.842096e+08 1.592896e+08 1.658870e+08 2.013879e+08 1.796926e+08 2.387039e+08 3.063246e+08 1.719412e+08 2.697041e+08 4.021819e+08 1.847293e+08 1.536915e+08 2.317398e+08 3.021881e+08 2.076695e+08 2.081752e+08 139.49873_8.447 3.573446e+07 3.500305e+07 3.468819e+07 3.245693e+07 1.130839e+05 1.737222e+07 3.531188e+07 3.652440e+07 123525.66 2.892871e+07 3.374062e+07 3.100453e+07 112913.86 2.902980e+07 2.968782e+07 3.094054e+07 1.499400e+05 3.055393e+07 3.063468e+07 3.032129e+07 5.892087e+04 3.248041e+07 3.509350e+07 3.505231e+07 15355.466 2.543175e+07 3.235905e+07 3.046216e+07 1.987654e+04 3.126272e+07 2.959180e+07 3.815070e+07 116750.97 2.689578e+07 3.106868e+07 2.970969e+07 6.745870e+04 2.729224e+07 3.729733e+07 3.539875e+07 1.122139e+05 2.683825e+07 3.250507e+07 3.264260e+07 1.167877e+05 2.795610e+07 2.784476e+07 3.487629e+07 2.362228e+07 1.825913e+07 3.195921e+07 6.804709e+07 4.029391e+07 3.808343e+07 3.279669e+07 4.328943e+07 2.974682e+07 3.424694e+07 3.470663e+07 5.951322e+07 3.452182e+07 3.339399e+07 2.963802e+07 2.892152e+07 4.139005e+07 4.143537e+07 3.124398e+07 2.526710e+07 2.673031e+07 3.466666e+07 6.627966e+07 2.754377e+07 3.500135e+07 5.297805e+07 2.396769e+07 3.631669e+07 2.831102e+07 3.885161e+07 7.191102e+07 4.027475e+07 2.539022e+07 3.553911e+07 2.236807e+07 3.719198e+07 2.946001e+07 4.209724e+07 2.112130e+07 3.408762e+07 3.233095e+07 2.355651e+07 2.984253e+07 5.194509e+07 2.495738e+07 3.118175e+07 2.361092e+07 4.144255e+07 5.482568e+07 2.376139e+07 5.453172e+07 2.629095e+07 1.674734e+07 3.333033e+07 2.750184e+07 3.011281e+07 2.678203e+07 2.423886e+07 3.032035e+07 3.788825e+07 3.324353e+07 3.401782e+07 2.118840e+07 2.739233e+07 2.586901e+07 4.903164e+07 7.412523e+07 2.809573e+07 4.078601e+07 3.285334e+07 3.980204e+07 2.209029e+07 2.095864e+07 2.914432e+07 1.997445e+07 2.732100e+07 2.744302e+07 2.552425e+07 3.401555e+07 2.213320e+07 2.197091e+07 2.481885e+07 2.805137e+07 6.221900e+07 2.509370e+07 2.523012e+07 1.886700e+07 1.766146e+07 2.912233e+07 1.758828e+07 2.323207e+07 3.040111e+07 3.038486e+07 2.705015e+07 2.504839e+07 2.184552e+07 2.380978e+07 2.428914e+07 3.046654e+07 2.432765e+07 3.512648e+07 2.512474e+07 2.759506e+07 2.358536e+07 2.769196e+07 4.867425e+07 3.064068e+07 2.554832e+07 3.579338e+07 1.865499e+07 2.828400e+07 2.868739e+07 2.665371e+07 3.526465e+07 2.478767e+07 2.772427e+07 1.916311e+07 2.727979e+07 3.760030e+07 2.158911e+07 3.205117e+07 2.941991e+07 2.998886e+07 2.919997e+07 2.528229e+07 2.484971e+07 2.516644e+07 3.241870e+07 4.109074e+07 4.115846e+07 3.551326e+07 3.437631e+07 5.126225e+07 2.458827e+07 2.278537e+07 2.799047e+07 5.093900e+07 3.143841e+07 2.033465e+07 2.054590e+07 2.230682e+07 2.325060e+07 2.018708e+07 4.247211e+07 5.936596e+06 3.544979e+07 2.302972e+07 2.925503e+07 3.035492e+07 2.404010e+07 3.069563e+07 3.199569e+07 2.613815e+07 2.140868e+07 2.375663e+07 2.820271e+07 1.799154e+07 6.075417e+07 2.136862e+07 2.677221e+07 1.686263e+07 2.911612e+07 2.876916e+07 1.950899e+07 1.985577e+07 2.353082e+07 3.270458e+07 3.127408e+07 1.970512e+07 1.896584e+07 1.197499e+08 2.031907e+07 2.503759e+07 2.818220e+07 2.650022e+07 1.691501e+07 2.903591e+07 2.282514e+07 2.398231e+07 3.063698e+07 3.368345e+07 2.906485e+07 3.700875e+07 2.890655e+07 3.022716e+07 2.937559e+07 2.787805e+07 2.118030e+07 2.841149e+07 1.918678e+07 2.239209e+07 2.916997e+07 3.396313e+07 2.226606e+07 3.300813e+07 3.626511e+07 3.985022e+07 5.909523e+07 3.269804e+07 3.147400e+07 2.574683e+07 3.023998e+07 2.578671e+07 3.892497e+07 4.153477e+07 2.521268e+07 5.183151e+07 6.536555e+07 2.690207e+07 2.493614e+07 3.497182e+07 4.854773e+07 3.122831e+07 3.365081e+07 130.49346_8.447 3.907639e+07 3.373291e+07 3.352030e+07 3.260782e+07 2.560592e+05 2.237257e+07 3.124710e+07 3.503044e+07 268675.29 2.811709e+07 3.685097e+07 3.084405e+07 231513.53 2.961226e+07 2.878892e+07 3.042611e+07 2.996697e+05 3.184650e+07 2.958304e+07 3.109836e+07 1.166842e+05 3.290343e+07 3.198408e+07 3.549910e+07 29435.660 2.572525e+07 3.353204e+07 2.997728e+07 3.667094e+04 3.054837e+07 3.237837e+07 3.490426e+07 213356.26 2.700570e+07 3.046837e+07 2.983665e+07 1.213663e+05 2.877543e+07 3.601435e+07 3.640752e+07 2.034831e+05 2.853368e+07 3.111763e+07 3.139719e+07 2.179064e+05 2.613107e+07 2.788208e+07 3.609721e+07 2.376901e+07 1.827495e+07 3.046430e+07 7.193868e+07 3.550952e+07 3.996355e+07 3.237255e+07 4.159134e+07 3.093583e+07 3.551653e+07 3.367818e+07 6.958941e+07 3.466047e+07 3.377312e+07 2.997434e+07 2.862588e+07 4.352633e+07 3.930396e+07 3.102103e+07 2.669719e+07 2.825095e+07 3.407644e+07 7.097331e+07 2.826814e+07 3.209760e+07 5.386492e+07 2.729577e+07 3.602638e+07 2.846084e+07 4.009140e+07 7.507111e+07 3.956784e+07 2.673169e+07 3.723000e+07 2.449822e+07 3.766744e+07 2.565859e+07 3.988245e+07 2.339622e+07 3.524967e+07 3.298691e+07 2.442290e+07 2.973822e+07 4.928244e+07 2.396483e+07 3.227186e+07 2.520465e+07 4.097642e+07 4.954900e+07 2.456939e+07 5.693525e+07 2.845722e+07 2.010595e+07 3.572389e+07 2.818493e+07 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4.910416e+07 2.247176e+07 2.247924e+07 2.673231e+07 4.730388e+07 3.266780e+07 2.359170e+07 1.893903e+07 2.442973e+07 2.346748e+07 2.177300e+07 4.705728e+07 5.118276e+06 3.449138e+07 2.429495e+07 3.486353e+07 2.938788e+07 2.321335e+07 3.220040e+07 3.199679e+07 2.640271e+07 2.294374e+07 1.808984e+07 3.014422e+07 1.596680e+07 5.937652e+07 2.096660e+07 2.817390e+07 1.774455e+07 2.949057e+07 3.044519e+07 2.041074e+07 1.811870e+07 2.281659e+07 3.348766e+07 3.247791e+07 1.887332e+07 1.858993e+07 1.226082e+08 2.006324e+07 2.445866e+07 2.989619e+07 2.600936e+07 1.938577e+07 3.164947e+07 2.060462e+07 2.468197e+07 3.226287e+07 3.685873e+07 2.663033e+07 3.883954e+07 2.708529e+07 3.050140e+07 2.968910e+07 2.818411e+07 1.968974e+07 2.917689e+07 1.740547e+07 2.334405e+07 3.139161e+07 3.302064e+07 2.381099e+07 3.528839e+07 3.893281e+07 4.247387e+07 5.890830e+07 2.980415e+07 3.291188e+07 2.548420e+07 3.214582e+07 2.760600e+07 3.865983e+07 4.349899e+07 2.649268e+07 5.142262e+07 7.073769e+07 2.803563e+07 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2.619032e+06 2.434775e+06 4.970647e+06 4.884829e+06 3.797465e+06 5.720061e+06 5.768940e+06 8.750138e+06 1.449433e+07 4.108045e+06 3.802930e+06 4.279424e+06 5.251507e+06 4.305584e+06 7.470214e+06 9.506711e+06 3.937566e+06 8.606628e+06 1.564971e+07 4.622693e+06 3.873774e+06 5.969230e+06 1.030670e+07 5.346660e+06 5.508534e+06 C8 H12 N O4 P3_8.449 3.658299e+07 3.547252e+07 3.009923e+07 3.242358e+07 1.280190e+05 1.885446e+07 3.205046e+07 3.193153e+07 144726.20 3.151382e+07 3.389563e+07 2.981078e+07 117737.97 2.780514e+07 2.841260e+07 3.101621e+07 1.542661e+05 2.960461e+07 2.864793e+07 3.002612e+07 6.103525e+04 3.170579e+07 3.146698e+07 3.513695e+07 15996.199 2.693854e+07 2.940855e+07 2.945174e+07 2.106025e+04 2.958514e+07 2.964598e+07 3.643929e+07 124147.02 2.634504e+07 2.983665e+07 2.904971e+07 7.184866e+04 2.628964e+07 3.551688e+07 3.475005e+07 1.192962e+05 2.652346e+07 3.194205e+07 3.270963e+07 1.237978e+05 2.353579e+07 2.761801e+07 3.430340e+07 2.304093e+07 1.831528e+07 3.129541e+07 6.426149e+07 3.552017e+07 3.783561e+07 3.124149e+07 4.101033e+07 2.835445e+07 3.246424e+07 3.483288e+07 5.702771e+07 3.529160e+07 3.180917e+07 2.893602e+07 2.943667e+07 4.023816e+07 4.074641e+07 2.955090e+07 2.476105e+07 2.495400e+07 3.376005e+07 6.177902e+07 2.628752e+07 3.234843e+07 4.871595e+07 2.134285e+07 3.499989e+07 2.740421e+07 3.636229e+07 6.762274e+07 3.860937e+07 2.527878e+07 3.338229e+07 2.311202e+07 3.610560e+07 2.823226e+07 4.131920e+07 2.132593e+07 3.293120e+07 3.100194e+07 2.192331e+07 2.899449e+07 4.898530e+07 2.170822e+07 2.855242e+07 2.355121e+07 3.982101e+07 5.261461e+07 2.038966e+07 5.108043e+07 2.488245e+07 1.544934e+07 3.327749e+07 2.489699e+07 3.073271e+07 2.570222e+07 2.315233e+07 2.943314e+07 3.764208e+07 3.261923e+07 3.415898e+07 2.061740e+07 2.705079e+07 2.584723e+07 4.771139e+07 6.420550e+07 2.784015e+07 3.895355e+07 3.296302e+07 4.094330e+07 2.196893e+07 2.048837e+07 2.862843e+07 1.508892e+07 2.709040e+07 2.694697e+07 2.365599e+07 3.482450e+07 1.967247e+07 2.134317e+07 2.359246e+07 2.740950e+07 6.113408e+07 2.472380e+07 2.464694e+07 1.952603e+07 1.198769e+07 2.804855e+07 1.653211e+07 2.224188e+07 2.596381e+07 2.809593e+07 2.096678e+07 2.366736e+07 2.059284e+07 2.462594e+07 2.569763e+07 3.042421e+07 2.411081e+07 3.535018e+07 2.445504e+07 2.637541e+07 2.258714e+07 2.538696e+07 4.322126e+07 2.779245e+07 2.692026e+07 3.616436e+07 1.814586e+07 2.218961e+07 2.782908e+07 2.642963e+07 3.281870e+07 2.214684e+07 2.271574e+07 2.384365e+07 2.702377e+07 3.792251e+07 2.001646e+07 3.205867e+07 2.901047e+07 2.979562e+07 2.894941e+07 2.484817e+07 2.308927e+07 2.486661e+07 3.136171e+07 4.055865e+07 3.490665e+07 3.382102e+07 3.376141e+07 4.659405e+07 2.237943e+07 2.087528e+07 2.811304e+07 4.525837e+07 2.977434e+07 2.053822e+07 2.001779e+07 2.273519e+07 2.048880e+07 2.144447e+07 4.284613e+07 6.642604e+06 3.432379e+07 2.433835e+07 2.694664e+07 2.913082e+07 2.329846e+07 3.026235e+07 2.964521e+07 2.607523e+07 2.239190e+07 2.093924e+07 2.810952e+07 1.783830e+07 5.422334e+07 2.026566e+07 2.767320e+07 1.709031e+07 2.074593e+07 3.024314e+07 1.848395e+07 1.859404e+07 2.246263e+07 3.039702e+07 2.895651e+07 1.922593e+07 1.830152e+07 1.139301e+08 1.963896e+07 2.299913e+07 2.739569e+07 2.602259e+07 1.714209e+07 2.684560e+07 2.189649e+07 2.327514e+07 3.067283e+07 3.081460e+07 2.991763e+07 3.577727e+07 2.842379e+07 2.803109e+07 2.863016e+07 2.657109e+07 1.976551e+07 2.993110e+07 1.812788e+07 2.261018e+07 3.013127e+07 3.045891e+07 2.323110e+07 3.192129e+07 3.643145e+07 3.734938e+07 5.296591e+07 2.902428e+07 3.111469e+07 2.497343e+07 2.965315e+07 2.580005e+07 4.528039e+07 3.822547e+07 2.729532e+07 5.172726e+07 5.723669e+07 2.709274e+07 2.611033e+07 3.351988e+07 4.419301e+07 3.020895e+07 3.217435e+07 C8 H12 N O8 P S2_8.449 3.081603e+06 3.251084e+06 3.360689e+06 3.411032e+06 8.899796e+04 2.809689e+06 3.433189e+06 3.371974e+06 100558.56 3.224317e+06 3.430144e+06 3.460976e+06 88914.28 2.828100e+06 3.133670e+06 3.448046e+06 1.148497e+05 3.246802e+06 3.454391e+06 3.340172e+06 4.715294e+04 2.598587e+06 3.539693e+06 3.844928e+06 12082.170 2.899698e+06 3.236619e+06 3.298742e+06 1.523319e+04 2.861126e+06 3.424877e+06 3.822012e+06 87976.00 2.995324e+06 2.858666e+06 3.265643e+06 4.998460e+04 3.560059e+06 3.293004e+06 3.674144e+06 9.265193e+04 2.447567e+06 3.459649e+06 3.448025e+06 9.222977e+04 3.210459e+06 3.085714e+06 3.370757e+06 2.233537e+06 1.341186e+06 3.387903e+06 9.653213e+06 4.076890e+06 4.155526e+06 3.533482e+06 5.027003e+06 3.132414e+06 2.476986e+06 3.890592e+06 8.944760e+06 3.804402e+06 2.668036e+06 2.428175e+06 3.901753e+06 6.261809e+06 4.981130e+06 2.874313e+06 2.725655e+06 2.741230e+06 3.003879e+06 1.000593e+07 3.073516e+06 3.719688e+06 7.246659e+06 2.184069e+06 4.558786e+06 3.033707e+06 4.821001e+06 1.407432e+07 3.510920e+06 2.811393e+06 3.843538e+06 2.559696e+06 5.693873e+06 2.832217e+06 5.297817e+06 2.355146e+06 4.164684e+06 3.636936e+06 2.348872e+06 3.339765e+06 6.465593e+06 2.231372e+06 2.854678e+06 2.167357e+06 4.809942e+06 6.416844e+06 2.215337e+06 8.275061e+06 2.906955e+06 1.547746e+06 3.765995e+06 3.169945e+06 3.215380e+06 2.606579e+06 2.538122e+06 2.788708e+06 3.715126e+06 2.790482e+06 3.634672e+06 1.830391e+06 3.443069e+06 2.238776e+06 6.459753e+06 1.312370e+07 2.426087e+06 5.523923e+06 4.580168e+06 3.750359e+06 2.159623e+06 2.094537e+06 3.181857e+06 2.901294e+06 2.652494e+06 2.633083e+06 2.701506e+06 4.039982e+06 1.974465e+06 2.122366e+06 1.972818e+06 2.582333e+06 1.009928e+07 2.738419e+06 2.794130e+06 1.593378e+06 1.555937e+06 3.476803e+06 1.585304e+06 2.411325e+06 1.926501e+06 3.704469e+06 2.396686e+06 2.513206e+06 2.163641e+06 1.850037e+06 2.189831e+06 3.377613e+06 2.377172e+06 3.386354e+06 2.468608e+06 2.473330e+06 2.039108e+06 2.733356e+06 4.048574e+06 3.629755e+06 2.593619e+06 4.104469e+06 1.507328e+06 2.337387e+06 3.201132e+06 2.208148e+06 2.997880e+06 2.272783e+06 2.911053e+06 2.371273e+06 2.699271e+06 3.597155e+06 2.190996e+06 3.773918e+06 3.967863e+06 2.918588e+06 3.554836e+06 2.805672e+06 2.440191e+06 2.584753e+06 3.623523e+06 4.308465e+06 4.035010e+06 3.960317e+06 3.895065e+06 8.027606e+06 1.427111e+06 1.925209e+06 2.834781e+06 6.461347e+06 3.490784e+06 1.666504e+06 1.487067e+06 2.114642e+06 2.340681e+06 1.853039e+06 4.733245e+06 3.534098e+05 3.895900e+06 2.591830e+06 2.519496e+06 3.076742e+06 2.170668e+06 2.845454e+06 2.776197e+06 2.444494e+06 2.096142e+06 2.470405e+06 2.978868e+06 1.417948e+06 8.093301e+06 2.019540e+06 2.558578e+06 1.661995e+06 3.239650e+06 2.614486e+06 2.062910e+06 1.660864e+06 2.327788e+06 4.305971e+06 3.722401e+06 1.704382e+06 1.784973e+06 3.042869e+07 1.922873e+06 1.637773e+06 3.322657e+06 2.751309e+06 1.730054e+06 3.189734e+06 2.091008e+06 2.784871e+06 3.932787e+06 4.436733e+06 2.179804e+06 5.354932e+06 3.443770e+06 3.525193e+06 3.095498e+06 2.999798e+06 2.023422e+06 2.198278e+06 1.689487e+06 1.555563e+06 2.973514e+06 2.720917e+06 2.260576e+06 3.860858e+06 3.285096e+06 5.406475e+06 7.949487e+06 2.587904e+06 2.334407e+06 2.660597e+06 3.253696e+06 2.693159e+06 4.284400e+06 5.395908e+06 2.368556e+06 4.611585e+06 8.653198e+06 2.935371e+06 2.396899e+06 3.570148e+06 6.277796e+06 3.435263e+06 3.354345e+06 C8 H8 N O5 P S_8.449 1.167537e+08 1.021804e+08 1.041700e+08 9.966734e+07 3.666862e+05 6.294337e+07 9.877943e+07 1.050831e+08 411038.17 8.799016e+07 1.078441e+08 9.282720e+07 352872.26 8.965092e+07 8.893580e+07 9.344106e+07 4.614026e+05 9.548444e+07 9.224305e+07 9.081193e+07 1.827526e+05 1.028890e+08 9.624536e+07 1.041897e+08 46717.312 8.055687e+07 1.015078e+08 9.005389e+07 5.848615e+04 9.694570e+07 9.668594e+07 1.060987e+08 345917.01 8.264776e+07 9.073511e+07 8.857826e+07 2.155217e+05 8.622909e+07 1.142034e+08 1.058588e+08 3.258532e+05 8.754196e+07 9.661299e+07 9.783851e+07 3.472313e+05 7.574323e+07 8.918228e+07 1.062423e+08 7.198289e+07 5.640303e+07 8.923041e+07 2.011397e+08 1.143917e+08 1.222050e+08 9.698120e+07 1.271508e+08 9.544731e+07 1.113638e+08 1.049240e+08 2.008862e+08 1.081245e+08 1.033812e+08 9.162263e+07 9.104222e+07 1.263868e+08 1.248990e+08 9.597648e+07 8.196214e+07 8.401138e+07 1.023959e+08 2.046468e+08 8.472528e+07 1.028669e+08 1.623544e+08 7.715171e+07 1.160604e+08 8.635678e+07 1.165207e+08 2.276132e+08 1.256289e+08 8.285670e+07 1.122327e+08 7.142836e+07 1.124251e+08 8.215009e+07 1.177318e+08 7.332818e+07 1.079829e+08 9.948115e+07 7.531564e+07 9.320375e+07 1.423967e+08 7.545105e+07 9.270170e+07 7.655624e+07 1.244032e+08 1.431380e+08 7.160568e+07 1.803165e+08 8.514247e+07 5.649391e+07 1.049165e+08 8.804467e+07 9.340064e+07 8.312605e+07 8.319786e+07 9.605099e+07 1.183953e+08 1.015220e+08 1.085185e+08 6.382622e+07 8.895023e+07 7.984725e+07 1.449568e+08 2.244863e+08 8.488103e+07 1.208329e+08 9.989873e+07 1.281746e+08 6.536564e+07 6.751636e+07 8.988672e+07 5.543267e+07 8.043493e+07 8.231193e+07 7.673914e+07 1.042356e+08 6.809512e+07 6.318001e+07 8.122095e+07 7.883218e+07 1.915044e+08 5.840777e+07 7.836515e+07 6.163112e+07 5.179355e+07 8.941622e+07 5.293079e+07 7.605408e+07 8.251749e+07 8.707622e+07 8.315739e+07 7.852758e+07 6.605058e+07 7.072439e+07 7.552733e+07 9.330228e+07 7.516100e+07 1.199980e+08 7.787966e+07 8.464084e+07 7.153772e+07 8.495431e+07 1.554357e+08 9.310179e+07 8.027358e+07 1.064999e+08 5.935081e+07 7.358793e+07 9.715694e+07 8.619157e+07 1.106980e+08 7.569916e+07 7.738117e+07 8.135433e+07 7.866798e+07 1.216109e+08 6.245245e+07 1.010193e+08 9.412018e+07 9.806121e+07 9.464763e+07 8.222793e+07 7.728946e+07 7.483549e+07 1.019477e+08 1.207209e+08 1.197963e+08 1.077729e+08 1.124570e+08 1.496613e+08 8.467823e+07 7.108152e+07 8.933794e+07 1.406959e+08 1.016801e+08 7.056297e+07 6.154226e+07 7.224859e+07 7.079900e+07 6.585845e+07 1.313001e+08 1.833761e+07 1.075366e+08 8.063348e+07 9.448459e+07 8.950731e+07 7.266437e+07 1.005363e+08 9.484983e+07 8.261072e+07 6.934383e+07 6.444049e+07 8.977909e+07 5.435856e+07 1.729145e+08 6.786411e+07 8.439756e+07 5.460371e+07 8.454022e+07 9.588211e+07 6.065068e+07 5.921286e+07 7.643828e+07 7.782266e+07 9.576202e+07 6.219092e+07 5.859065e+07 3.334174e+08 6.905085e+07 7.552386e+07 9.555695e+07 7.931761e+07 5.692452e+07 9.256039e+07 6.995239e+07 7.637160e+07 9.751869e+07 1.062237e+08 8.213447e+07 1.148153e+08 8.727410e+07 9.649642e+07 9.021213e+07 8.630830e+07 5.925270e+07 9.118192e+07 5.813812e+07 6.948118e+07 8.927770e+07 1.015357e+08 7.344937e+07 1.056551e+08 1.116295e+08 1.226784e+08 1.756660e+08 9.667424e+07 1.000581e+08 8.059353e+07 1.028298e+08 8.368564e+07 1.149072e+08 1.291936e+08 8.054477e+07 1.567285e+08 2.182185e+08 8.464814e+07 7.214888e+07 1.073286e+08 1.303108e+08 9.680953e+07 9.799307e+07 138.50108_8.449 6.059414e+06 5.243779e+06 5.557241e+06 5.331823e+06 1.255290e+05 2.434908e+06 5.068070e+06 5.528081e+06 142695.07 4.927284e+06 5.313350e+06 4.660664e+06 118168.64 4.357841e+06 4.730782e+06 5.006092e+06 1.563965e+05 4.517849e+06 4.690185e+06 4.721805e+06 6.217411e+04 5.291185e+06 4.846461e+06 5.414710e+06 16128.116 4.062109e+06 5.218419e+06 4.812529e+06 2.095325e+04 4.974930e+06 4.593290e+06 5.303973e+06 127588.24 4.167316e+06 4.867152e+06 4.543104e+06 7.222265e+04 4.536866e+06 5.943767e+06 5.343755e+06 1.195169e+05 4.231324e+06 4.711205e+06 5.594853e+06 1.190931e+05 3.789842e+06 4.019773e+06 5.733640e+06 3.254369e+06 2.744237e+06 3.842578e+06 6.519600e+07 5.393130e+06 6.469338e+06 4.936061e+06 6.040667e+06 4.735580e+06 5.226406e+06 5.609708e+06 5.785695e+07 5.901776e+06 5.317561e+06 4.414353e+06 4.561315e+06 6.247978e+06 5.720506e+06 4.780136e+06 4.133576e+06 4.265873e+06 5.613475e+06 7.666480e+06 4.154665e+06 4.892107e+06 4.978239e+07 3.647409e+06 5.708659e+06 4.295358e+06 6.189015e+06 7.481802e+06 6.264325e+06 3.574463e+06 5.706728e+06 4.581055e+06 5.390821e+06 4.257232e+06 5.751103e+06 3.267760e+06 5.224470e+06 5.158200e+06 3.359061e+06 5.199152e+06 7.040350e+06 3.933860e+06 4.361824e+06 3.601602e+06 6.432068e+06 8.378573e+06 3.606910e+06 8.616129e+06 3.944539e+06 2.175822e+06 4.772553e+06 4.045186e+06 5.011893e+06 4.453445e+06 3.779973e+06 4.928252e+06 5.794138e+06 5.366403e+06 5.533234e+06 3.415348e+06 4.329933e+06 4.161474e+06 7.693546e+06 8.062563e+06 4.182323e+06 5.802590e+06 5.388270e+06 6.009101e+06 3.364715e+06 3.179541e+06 4.451622e+06 2.677843e+06 4.323146e+06 4.017415e+06 3.835387e+06 5.293344e+06 2.797853e+06 3.583730e+06 3.595598e+06 4.204277e+06 1.005064e+07 3.549230e+06 4.039831e+06 2.866507e+06 2.788022e+06 4.239267e+06 2.732881e+06 3.694119e+06 4.225241e+06 5.214294e+06 4.033062e+06 3.809926e+06 3.433182e+06 3.615692e+06 3.742009e+06 4.436842e+06 4.162941e+06 6.003245e+06 3.577212e+06 4.435359e+06 3.512766e+06 4.285145e+06 8.242564e+06 5.147412e+06 4.112374e+06 6.012378e+06 2.686783e+06 3.292322e+06 4.434900e+06 3.966539e+06 5.764484e+06 3.595202e+06 4.059564e+06 4.219958e+06 4.461556e+06 6.312129e+06 3.236354e+06 5.084543e+06 4.324750e+06 4.767932e+06 4.662893e+06 4.043353e+06 3.625075e+06 3.724769e+06 4.895450e+06 6.893915e+06 6.302293e+06 5.697519e+06 5.258615e+06 8.605631e+06 3.352832e+06 3.340823e+06 4.429160e+06 7.660088e+06 4.680192e+06 3.256653e+06 2.831857e+06 3.205985e+06 3.597036e+06 3.545522e+06 6.349941e+06 8.340941e+05 5.778855e+06 4.120331e+06 4.259880e+06 4.796925e+06 3.780980e+06 4.849591e+06 4.798381e+06 4.034208e+06 3.506147e+06 3.548023e+06 4.675631e+06 2.764370e+06 6.467416e+06 3.236606e+06 4.158682e+06 2.679072e+06 4.377689e+06 4.641537e+06 2.873094e+06 2.640732e+06 3.925001e+06 4.419476e+06 4.421253e+06 2.810705e+06 2.885142e+06 1.559793e+07 3.349845e+06 3.752007e+06 4.410175e+06 3.874561e+06 2.426894e+06 4.547570e+06 3.491149e+06 3.960535e+06 5.000518e+06 7.061363e+06 4.161281e+06 5.669412e+06 4.600242e+06 4.849411e+06 4.456299e+06 4.159211e+06 3.033511e+06 4.517979e+06 3.028710e+06 3.257545e+06 4.606076e+06 5.203505e+06 3.530596e+06 4.755890e+06 5.378256e+06 5.846626e+06 8.182170e+06 4.687378e+06 5.195864e+06 3.885079e+06 4.055358e+06 4.321967e+06 6.555356e+06 7.132094e+06 3.897908e+06 5.615660e+07 1.032493e+07 4.224575e+06 3.964034e+06 4.860831e+06 7.257030e+06 4.973212e+06 5.329393e+06 Bisphenol S_8.45 3.915761e+06 5.356066e+06 6.474115e+06 6.400439e+06 8.221626e+04 3.932444e+06 6.945429e+06 6.237300e+06 84125.26 5.816999e+06 5.698241e+06 6.831877e+06 74229.29 5.114698e+06 5.622265e+06 5.542439e+06 1.000869e+05 5.693936e+06 5.988095e+06 6.380813e+06 3.956886e+04 3.954773e+06 6.848287e+06 8.294213e+06 9992.195 4.602549e+06 5.431336e+06 5.699341e+06 1.366178e+04 4.704566e+06 6.055897e+06 6.516906e+06 78863.12 6.060354e+06 5.523587e+06 5.834231e+06 4.485835e+04 6.316391e+06 4.619587e+06 6.243952e+06 8.065943e+04 6.123649e+06 6.091141e+06 5.947465e+06 8.116600e+04 5.954208e+06 4.776229e+06 6.502096e+06 3.269129e+06 1.595212e+06 5.462645e+06 2.953929e+07 8.265422e+06 7.761859e+06 7.174777e+06 9.165292e+06 4.834320e+06 4.801128e+06 7.691398e+06 1.761288e+07 6.981754e+06 6.176603e+06 4.190738e+06 6.943282e+06 1.358364e+07 9.971855e+06 5.416501e+06 4.432160e+06 4.329852e+06 6.035294e+06 3.012820e+07 4.467391e+06 6.555352e+06 1.348444e+07 3.926150e+06 8.894965e+06 5.747845e+06 1.230531e+07 4.804927e+07 1.153277e+07 4.374180e+06 8.494645e+06 3.315957e+06 9.528818e+06 4.484621e+06 1.071701e+07 3.160929e+06 8.100374e+06 6.525537e+06 4.097121e+06 5.894935e+06 1.561692e+07 3.404372e+06 4.130125e+06 3.742199e+06 1.142268e+07 1.788378e+07 3.089093e+06 2.263207e+07 4.486447e+06 2.162659e+06 7.023672e+06 5.214734e+06 5.356982e+06 4.064575e+06 3.912845e+06 3.714843e+06 5.644634e+06 3.775402e+06 6.435036e+06 2.561665e+06 5.863345e+06 2.873908e+06 1.445156e+07 3.707559e+07 3.867715e+06 1.294252e+07 8.061808e+06 7.461681e+06 3.052721e+06 2.855104e+06 4.653904e+06 3.466549e+06 5.131215e+06 3.828918e+06 3.857588e+06 6.959843e+06 2.915583e+06 3.327694e+06 3.579437e+06 3.528350e+06 2.978551e+07 4.119803e+06 4.177947e+06 2.141331e+06 2.539333e+06 5.534434e+06 1.942527e+06 3.713863e+06 4.435313e+06 6.449016e+06 5.515225e+06 3.687767e+06 2.430283e+06 2.411969e+06 3.145426e+06 5.966105e+06 3.361052e+06 5.031883e+06 3.443025e+06 3.796731e+06 2.928944e+06 3.674284e+06 5.353042e+06 6.070464e+06 3.646285e+06 7.569696e+06 1.925171e+06 3.526231e+06 5.886285e+06 3.408862e+06 4.917627e+06 3.684533e+06 4.453965e+06 3.596972e+06 4.258175e+06 4.601860e+06 2.809028e+06 5.697269e+06 7.123798e+06 3.946607e+06 6.802061e+06 4.293322e+06 3.129217e+06 3.773385e+06 6.592230e+06 8.742864e+06 1.179412e+07 6.191324e+06 7.650916e+06 2.119566e+07 1.602527e+06 2.848997e+06 4.898755e+06 1.430966e+07 6.291261e+06 1.967326e+06 1.755306e+06 3.632239e+06 3.623203e+06 2.827867e+06 1.144147e+07 2.451013e+06 8.126214e+06 3.688202e+06 5.375141e+06 5.249458e+06 4.085213e+06 3.773649e+06 4.768868e+06 3.587510e+06 3.323208e+06 3.640321e+06 4.239794e+06 1.913351e+06 1.949425e+07 2.786174e+06 4.153863e+06 2.172137e+06 5.036522e+06 5.543065e+06 2.571368e+06 2.467698e+06 3.474755e+06 1.060620e+07 6.789557e+06 2.221281e+06 2.335894e+06 1.564757e+08 3.029278e+06 2.865105e+06 4.921758e+06 4.218957e+06 2.721580e+06 3.707275e+06 2.493188e+06 4.074707e+06 7.079888e+06 8.219421e+06 3.339806e+06 9.569312e+06 5.749397e+06 5.037837e+06 5.604796e+06 5.565767e+06 2.692781e+06 3.017708e+06 2.019446e+06 1.922554e+06 5.223176e+06 4.846753e+06 3.168791e+06 5.504583e+06 6.514072e+06 9.601910e+06 2.172025e+07 4.763838e+06 2.909190e+06 3.582312e+06 5.910614e+06 3.851236e+06 8.049174e+06 1.178210e+07 3.760534e+06 8.470430e+06 1.873148e+07 4.654049e+06 3.452106e+06 7.166103e+06 1.285123e+07 6.233474e+06 6.075824e+06 METHIONINE SULFONE 2.591173e+06 2.026464e+06 2.129731e+06 2.109353e+06 1.419939e+05 1.246883e+06 2.014049e+06 1.956008e+06 196141.44 1.879707e+06 1.997360e+06 1.931885e+06 138943.94 1.872778e+06 1.906255e+06 1.978063e+06 1.802457e+05 1.845754e+06 1.978212e+06 1.703143e+06 7.316110e+04 1.832213e+06 2.130661e+06 2.101608e+06 18438.159 1.798863e+06 1.857423e+06 1.737236e+06 2.405682e+04 2.089943e+06 1.867593e+06 1.914987e+06 133521.89 2.060856e+06 1.827650e+06 1.745413e+06 7.865807e+04 1.910589e+06 2.082440e+06 1.889415e+06 1.317849e+05 1.980604e+06 1.767345e+06 1.972018e+06 1.303850e+05 1.985577e+06 1.761014e+06 2.006973e+06 1.952443e+06 1.602811e+06 1.175429e+06 1.082010e+06 2.932358e+06 3.201882e+06 3.529113e+06 1.382041e+06 1.920185e+06 2.317213e+06 1.961811e+06 2.760341e+06 3.048000e+06 2.896389e+06 3.865311e+06 1.921122e+06 2.089712e+06 8.411927e+05 3.201581e+06 2.371597e+06 1.196708e+06 1.548741e+06 2.710156e+06 1.569072e+06 2.097897e+06 1.102076e+06 2.755924e+06 2.929983e+06 2.211191e+06 2.775567e+06 3.699402e+06 1.202336e+06 2.192969e+06 2.306000e+06 1.243854e+06 1.516810e+06 3.146110e+06 2.837680e+06 8.541554e+05 2.117805e+06 2.718080e+06 1.661362e+06 1.372727e+06 1.421161e+06 1.078403e+06 2.629224e+06 1.196211e+06 2.076908e+06 2.092639e+06 1.998041e+06 1.021338e+06 2.058752e+06 5.412230e+05 1.752409e+06 2.323733e+06 5.070547e+06 1.188336e+06 1.453144e+06 1.329991e+06 1.392455e+06 6.569741e+06 2.623182e+06 6.466060e+05 1.748993e+06 1.536197e+06 2.617263e+06 2.069652e+06 2.771579e+06 2.301110e+06 2.924665e+06 1.287073e+06 3.800583e+06 1.348053e+06 2.556688e+06 9.895665e+05 1.213141e+06 1.049109e+06 1.312221e+06 1.874694e+06 1.959279e+06 3.328586e+06 1.701879e+06 3.913622e+06 1.673811e+06 1.622268e+06 1.738305e+06 2.484062e+06 1.241606e+06 2.964921e+06 2.440669e+06 1.810296e+06 1.560135e+06 3.237551e+06 3.456705e+06 1.582912e+06 1.683854e+06 5.163089e+06 1.939464e+06 2.119302e+06 1.697053e+06 2.893793e+06 9.371706e+05 1.038620e+06 1.620510e+06 2.633663e+06 1.692358e+06 2.971603e+06 2.806021e+06 2.240917e+06 1.576001e+06 9.898660e+05 1.662499e+06 1.190916e+06 1.063266e+06 1.305143e+06 2.138685e+06 2.037468e+06 3.685318e+06 2.289742e+06 2.736419e+06 1.841947e+06 1.639802e+06 3.531014e+06 1.168795e+06 2.486617e+06 1.671278e+06 2.044999e+06 1.318204e+06 2.035985e+06 1.472739e+06 2.560569e+06 1.930874e+06 1.536245e+06 2.126964e+06 1.905147e+06 2.378237e+06 1.125881e+06 3.169411e+06 1.301645e+06 2.027504e+06 1.915618e+06 1.946055e+06 1.700929e+06 2.370810e+06 4.582216e+06 2.557024e+06 9.803281e+05 2.490520e+06 2.407483e+06 1.544547e+06 2.574483e+06 2.027355e+06 8.690244e+05 1.708179e+06 2.757028e+06 1.946657e+06 1.915697e+06 1.062534e+06 3.576360e+06 1.744998e+06 2.525581e+06 1.268537e+06 3.665761e+06 1.912328e+06 2.779725e+06 1.540853e+06 1.506350e+06 2.986254e+06 1.235715e+06 1.226061e+06 1.438516e+06 1.977745e+06 7.218012e+05 2.425788e+06 1.768717e+06 1.566749e+06 1.682040e+06 2.640559e+06 1.617695e+06 1.433978e+06 1.808644e+06 2.206257e+06 1.953281e+06 6.509875e+05 1.819728e+06 1.395869e+06 9.643532e+05 1.169522e+06 2.597912e+06 2.887209e+06 2.235571e+06 1.480143e+06 2.747979e+06 1.673298e+06 2.171444e+06 2.319551e+06 2.201738e+06 1.205286e+06 1.226341e+06 1.059110e+06 3.307509e+06 9.266488e+05 4.620765e+06 4.131226e+06 2.763528e+06 2.136486e+06 2.899417e+06 2.808152e+06 1.502790e+06 1.252072e+06 1.470621e+06 2.414578e+06 2.519442e+06 1.954008e+06 C5 H3 N4 P_8.46 5.184113e+06 4.796061e+06 4.776049e+06 4.306948e+06 1.352467e+05 2.836940e+06 4.353548e+06 4.469952e+06 184383.41 3.907462e+06 4.758456e+06 4.691998e+06 131637.21 3.990169e+06 4.019433e+06 3.727209e+06 1.766293e+05 4.546649e+06 4.200915e+06 4.422878e+06 7.204798e+04 4.263916e+06 4.177119e+06 4.752407e+06 18507.061 3.693802e+06 4.307491e+06 4.599838e+06 3.457981e+04 4.092275e+06 4.120661e+06 5.137626e+06 135938.40 3.436668e+06 4.288408e+06 4.194273e+06 7.944177e+04 3.777456e+06 4.954703e+06 4.625917e+06 1.289442e+05 3.358031e+06 3.992976e+06 6.208025e+06 1.223788e+05 3.080767e+06 3.662799e+06 4.605467e+06 2.841610e+06 2.489746e+06 3.583332e+06 9.875827e+06 4.770090e+06 5.069457e+06 4.389924e+06 6.004647e+06 4.387731e+06 4.797926e+06 4.951426e+06 7.975540e+06 4.698272e+06 3.403957e+06 3.997898e+06 4.084358e+06 6.259859e+06 4.847498e+06 4.163253e+06 3.229221e+06 3.734991e+06 4.482830e+06 9.037350e+06 3.752496e+06 4.145759e+06 7.347325e+06 3.260417e+06 4.777061e+06 3.942823e+06 5.594346e+06 1.000909e+07 5.706034e+06 3.629634e+06 4.776324e+06 3.240010e+06 4.950799e+06 3.609799e+06 4.787927e+06 2.703759e+06 4.795431e+06 4.457149e+06 3.632098e+06 4.288572e+06 6.361071e+06 3.451481e+06 3.903046e+06 3.037669e+06 5.669594e+06 7.366310e+06 3.245458e+06 7.020881e+06 3.600698e+06 2.368471e+06 4.788691e+06 3.861386e+06 3.933265e+06 3.324595e+06 3.197613e+06 3.935274e+06 5.108707e+06 4.171611e+06 4.507154e+06 2.910331e+06 4.320828e+06 3.375588e+06 5.982445e+06 1.050491e+07 3.558006e+06 5.253198e+06 4.363483e+06 5.165924e+06 2.877798e+06 2.736086e+06 3.496540e+06 2.923838e+06 3.808055e+06 3.319429e+06 3.261080e+06 4.993923e+06 3.283746e+06 2.813303e+06 3.336345e+06 3.713973e+06 8.326012e+06 2.880644e+06 3.452279e+06 2.887139e+06 3.075864e+06 3.377583e+06 2.253351e+06 3.446359e+06 3.904567e+06 3.755687e+06 3.389652e+06 3.271021e+06 3.443291e+06 3.172882e+06 3.380885e+06 3.708534e+06 3.284991e+06 5.130332e+06 3.522419e+06 3.814688e+06 3.577284e+06 3.993131e+06 7.276876e+06 3.923973e+06 3.771307e+06 4.846575e+06 2.583555e+06 3.136033e+06 4.152464e+06 3.511818e+06 5.061360e+06 3.159528e+06 3.594104e+06 3.447876e+06 3.992739e+06 5.878689e+06 2.615211e+06 4.254176e+06 4.370526e+06 4.076939e+06 4.301602e+06 3.966066e+06 3.579995e+06 2.978624e+06 5.400134e+06 5.008722e+06 5.632241e+06 4.810162e+06 4.950541e+06 6.987050e+06 2.986753e+06 3.020134e+06 3.724998e+06 7.596252e+06 4.175558e+06 3.056354e+06 2.435594e+06 3.257405e+06 2.890378e+06 2.908098e+06 5.571439e+06 8.961914e+05 4.962141e+06 3.399822e+06 4.530578e+06 3.467718e+06 3.123642e+06 4.292066e+06 4.009583e+06 3.574499e+06 3.146455e+06 3.135814e+06 3.871868e+06 2.515446e+06 7.643895e+06 2.807505e+06 3.499686e+06 2.674521e+06 4.550373e+06 3.903472e+06 4.469793e+06 2.537248e+06 3.387263e+06 4.384864e+06 4.375759e+06 2.292114e+06 2.442986e+06 1.594657e+07 2.818846e+06 3.496563e+06 4.059202e+06 3.230860e+06 2.407610e+06 4.122234e+06 3.078088e+06 3.150040e+06 4.153974e+06 4.757415e+06 3.685149e+06 5.099085e+06 3.959443e+06 4.133019e+06 4.351512e+06 3.644655e+06 2.477516e+06 3.779258e+06 2.579449e+06 3.152744e+06 4.014858e+06 5.150002e+06 3.295564e+06 4.491960e+06 5.186801e+06 5.561639e+06 1.240025e+07 4.055134e+06 6.096462e+06 3.743181e+06 4.078253e+06 3.722768e+06 5.558327e+06 5.731277e+06 3.711243e+06 7.150329e+06 9.202900e+06 3.571041e+06 3.456564e+06 4.596062e+06 5.588707e+06 4.002566e+06 4.214576e+06 AMINOADIPATE 5.411456e+06 4.459470e+06 4.806879e+06 5.162862e+06 1.325193e+05 2.770122e+06 3.897985e+06 4.761115e+06 131830.38 4.274202e+06 4.660567e+06 4.257683e+06 110667.11 4.096934e+06 4.402162e+06 4.223170e+06 1.607505e+05 4.541327e+06 4.508920e+06 3.712354e+06 5.855066e+04 4.199866e+06 4.532853e+06 4.981153e+06 21485.505 4.150130e+06 4.093354e+06 4.186224e+06 2.083984e+04 4.077472e+06 4.450554e+06 4.612884e+06 110526.57 4.463141e+06 4.402511e+06 3.869216e+06 6.718078e+04 4.260093e+06 4.113755e+06 4.710087e+06 1.135970e+05 4.562082e+06 4.065853e+06 4.523771e+06 1.151276e+05 4.186544e+06 3.936608e+06 4.636498e+06 3.532053e+06 1.939417e+06 3.220069e+06 1.025644e+07 6.612892e+06 6.444442e+06 8.878781e+06 1.189465e+07 2.281374e+06 2.988419e+06 5.625522e+06 2.952919e+06 7.218529e+06 1.284686e+07 5.515703e+06 4.219128e+06 3.799968e+06 4.226931e+06 3.450988e+06 1.690984e+06 4.911397e+06 2.381312e+06 2.540211e+06 5.950155e+06 2.574008e+06 2.043190e+06 4.432235e+06 6.140122e+06 4.343972e+06 2.762707e+06 1.262135e+07 3.912731e+06 4.052242e+06 7.929605e+06 2.012842e+06 5.161517e+06 2.232702e+06 3.689288e+06 3.669110e+06 5.464269e+06 2.435590e+06 9.902371e+05 5.207045e+06 1.327006e+07 2.292066e+06 6.198115e+06 3.659243e+06 7.852156e+06 1.036136e+07 4.879046e+06 3.412886e+06 3.726588e+06 4.707611e+06 8.293880e+06 5.024838e+06 4.135621e+06 3.556926e+06 4.794691e+06 3.508809e+06 6.280157e+06 2.747675e+06 4.725217e+06 2.086153e+06 2.097828e+06 1.057152e+07 3.974971e+06 3.977861e+06 4.657781e+06 4.608133e+06 8.486263e+06 4.244033e+06 3.209066e+06 3.902175e+06 4.659805e+06 1.047928e+06 2.337037e+06 2.327995e+06 1.516715e+06 3.494256e+06 3.397533e+06 3.728151e+06 1.184716e+07 4.943044e+06 3.971515e+06 1.913116e+06 4.522329e+06 3.711855e+06 3.130483e+06 2.820283e+06 3.681928e+06 3.124019e+06 6.036085e+06 5.726473e+06 3.546623e+06 1.179630e+07 6.495305e+06 4.761053e+06 3.719269e+06 5.588302e+06 5.959533e+06 5.565302e+06 2.682083e+06 2.298505e+06 2.200396e+06 9.815029e+06 3.793809e+06 4.425210e+06 2.814340e+06 4.059777e+06 3.494616e+06 2.561198e+06 3.091528e+06 2.503411e+06 4.874491e+06 2.378443e+06 4.240903e+06 2.863884e+06 2.558220e+06 2.818309e+06 6.437904e+06 1.947657e+06 3.940684e+06 3.756750e+06 2.638645e+06 4.706544e+06 2.510674e+06 3.383284e+06 3.670110e+06 4.572892e+06 4.983734e+06 4.374894e+06 7.538369e+06 1.917438e+06 2.719651e+06 2.252100e+06 4.901243e+06 7.874604e+06 2.517833e+06 3.330163e+06 5.306752e+06 5.861489e+06 4.865938e+06 2.715265e+06 6.923103e+06 7.422481e+06 3.543618e+06 3.215088e+06 6.671453e+06 1.231631e+07 5.757885e+06 3.395698e+06 7.208328e+06 5.657868e+06 5.829537e+06 3.228881e+06 6.640855e+06 3.356430e+06 3.158328e+06 4.179983e+06 2.458490e+06 3.827505e+06 2.698727e+06 4.711218e+06 2.801391e+06 3.585602e+06 2.813962e+06 5.597906e+06 6.098738e+06 3.760038e+06 2.005327e+06 6.998331e+06 3.497735e+06 3.814783e+06 4.370974e+06 5.076259e+06 2.190909e+06 5.108693e+06 1.871578e+06 3.803580e+06 3.337964e+06 2.255771e+06 5.199680e+06 1.339928e+07 2.392172e+06 5.195119e+06 5.178480e+06 1.636934e+07 3.856211e+06 6.995856e+06 4.693683e+06 2.537339e+06 4.316088e+06 1.149315e+07 4.635716e+06 2.871005e+06 5.534403e+06 6.182052e+06 3.243786e+06 5.164324e+06 2.764197e+06 8.034837e+06 4.851176e+06 3.557736e+06 1.230592e+07 5.394182e+06 6.108635e+06 3.872354e+06 2.399017e+06 4.700147e+06 3.697631e+06 4.581473e+06 3.576959e+06 4.621338e+06 5.264723e+06 C6 H15 N O3_8.602 4.935068e+05 6.192412e+06 5.357862e+06 5.127987e+06 4.049025e+05 2.701885e+06 7.457870e+06 4.733621e+05 665258.11 5.320911e+06 9.282517e+05 6.105083e+05 487609.57 6.302732e+06 6.273281e+06 5.968163e+06 7.712081e+05 4.715399e+06 5.667915e+06 3.800380e+06 2.852957e+05 6.863694e+06 8.942424e+05 4.775931e+05 81247.653 6.601044e+06 5.605297e+06 6.427873e+06 7.432617e+04 4.785628e+06 5.573009e+06 1.219684e+06 417673.15 6.282897e+06 5.652623e+06 6.103701e+06 2.404038e+05 5.832209e+06 4.612601e+06 2.305665e+06 4.483575e+05 6.798091e+06 7.106657e+05 2.127639e+06 5.054088e+05 8.688840e+06 8.422616e+06 1.032658e+06 1.847869e+07 2.707858e+06 5.569525e+05 6.189956e+05 2.285056e+06 1.571321e+06 5.910625e+05 8.893091e+05 5.971507e+05 6.228676e+05 4.509198e+05 5.776059e+05 4.866708e+05 5.667250e+05 5.388431e+05 4.409257e+05 8.847501e+05 2.581071e+06 5.898712e+05 4.168069e+05 8.351785e+05 4.894952e+05 4.793738e+05 5.246239e+05 7.282377e+05 1.093440e+06 4.547611e+05 3.268148e+06 4.765761e+05 5.307669e+05 6.220234e+06 2.597086e+06 5.120966e+06 1.292300e+06 2.870248e+06 4.699993e+05 2.742204e+06 5.140367e+05 7.070430e+06 2.832796e+06 5.744974e+05 8.261565e+05 6.387368e+05 3.081066e+06 4.763379e+05 5.060835e+06 5.283571e+05 5.240461e+05 1.637436e+06 3.378596e+07 3.525597e+06 5.322490e+06 2.872744e+06 2.131593e+06 3.545860e+06 4.057586e+06 2.298172e+06 1.303098e+06 1.650783e+06 1.837591e+06 8.647774e+05 1.404269e+06 8.757522e+05 4.860762e+05 6.179869e+05 5.890432e+06 3.077142e+06 1.530556e+06 5.212811e+05 4.099833e+06 5.694018e+05 7.449727e+05 2.064345e+07 3.292930e+06 1.992526e+06 5.345690e+06 4.222876e+06 8.654236e+06 4.839555e+05 3.988763e+06 1.917511e+06 5.176682e+06 4.939214e+05 5.257655e+07 2.314342e+06 3.408474e+06 3.987962e+06 1.346409e+06 2.360615e+06 2.600950e+06 2.950973e+06 8.743067e+05 2.163872e+07 3.376194e+07 4.287408e+06 6.598260e+06 7.876132e+06 1.069134e+06 9.988591e+06 1.120518e+06 6.528841e+05 3.705532e+06 1.049946e+07 4.722612e+05 6.244712e+05 1.923238e+06 5.105946e+05 1.178775e+06 1.158314e+06 4.593180e+05 5.093241e+05 8.720745e+06 1.564299e+06 6.326377e+05 5.065511e+05 1.539049e+07 4.341290e+05 4.792452e+05 2.361329e+06 5.739312e+05 8.461284e+06 7.726668e+05 5.321267e+05 5.225375e+05 4.702179e+05 1.135939e+06 3.358117e+06 4.032514e+06 5.065805e+05 4.809916e+05 5.194888e+05 2.368110e+06 3.704557e+06 8.763449e+05 4.762036e+05 2.954742e+06 3.300267e+06 2.792044e+06 2.557464e+06 5.667095e+06 4.190865e+05 4.263517e+07 2.652026e+06 1.118073e+08 4.612324e+05 8.771395e+05 1.186626e+07 4.466806e+06 6.723915e+05 1.388696e+06 7.519192e+05 5.351111e+05 5.251043e+05 1.508360e+07 6.428279e+05 7.263430e+05 1.410247e+06 1.317568e+08 2.337758e+06 2.752692e+06 4.795566e+05 1.241874e+06 4.270625e+06 5.079640e+05 4.477328e+05 2.572269e+06 7.099233e+06 5.108571e+05 2.587381e+07 7.534121e+05 1.236157e+06 4.774960e+05 9.556120e+05 5.829537e+05 1.350501e+06 3.462961e+06 5.437339e+05 5.406346e+05 5.163325e+05 7.301001e+06 4.886609e+05 2.525707e+06 7.223183e+05 1.693003e+06 2.795536e+06 1.125980e+07 5.087697e+05 1.202609e+07 6.064422e+06 1.772808e+06 2.884134e+06 4.678988e+06 5.907723e+05 3.576628e+06 4.925539e+05 5.333908e+05 2.978000e+06 1.294620e+06 4.591746e+05 5.488406e+05 5.171229e+05 4.483921e+05 1.088999e+07 6.395722e+05 8.945848e+05 4.370297e+05 5.312665e+05 7.175430e+05 4.062626e+06 3.495232e+06 4.931221e+05 9.529321e+06 4.408310e+05 5.311418e+05 C6 H11 N O3_8.622 2.882360e+05 1.359263e+06 1.306692e+06 1.192282e+06 1.255138e+05 7.828484e+05 1.117437e+06 1.157075e+06 109328.58 1.058523e+06 1.071888e+06 1.703355e+06 90973.39 1.252637e+06 1.010150e+06 1.048909e+06 1.388955e+05 1.043392e+06 1.054090e+06 1.136098e+06 6.693153e+04 1.125296e+06 1.388723e+06 1.251862e+06 14479.487 1.050415e+06 1.295337e+06 1.112893e+06 1.590608e+04 1.077700e+06 1.090257e+06 1.318845e+06 110797.13 1.145831e+06 1.118892e+06 1.120221e+06 6.329335e+04 1.170987e+06 1.242468e+06 1.136824e+06 1.066948e+05 1.275945e+06 1.146671e+06 1.096225e+06 1.056151e+05 1.106926e+06 1.035660e+06 1.333745e+06 1.251066e+06 2.765508e+05 9.863899e+04 7.048376e+06 1.185503e+05 5.253621e+06 1.250017e+05 4.093386e+06 1.423337e+07 1.624448e+07 7.812394e+06 6.869619e+06 1.969850e+05 1.728961e+05 1.195095e+06 9.274792e+05 4.382608e+06 6.131908e+05 1.226730e+06 3.309985e+06 5.033011e+06 2.406478e+06 1.142053e+05 1.283949e+05 2.088481e+06 1.090235e+05 3.103624e+06 4.567338e+06 3.697924e+05 1.217750e+06 9.010689e+04 1.718479e+05 1.350828e+05 9.124223e+05 3.458522e+05 1.013498e+06 1.168724e+05 1.119109e+05 1.091188e+05 1.106602e+05 4.256779e+05 1.028507e+05 1.205055e+06 1.816679e+05 2.716489e+06 1.070602e+05 2.048984e+06 8.866798e+05 1.623895e+06 3.754268e+05 1.521249e+05 8.671231e+04 1.021199e+06 2.566880e+05 5.787451e+05 2.064565e+06 7.725697e+05 1.638967e+05 1.245218e+05 8.002218e+05 7.551012e+05 1.420793e+05 7.232778e+05 6.297917e+06 4.485441e+06 5.656329e+05 1.085254e+06 1.574962e+05 9.261800e+04 1.654201e+06 2.330380e+05 6.913061e+05 1.081892e+05 1.104510e+05 1.627675e+06 1.124418e+05 7.518944e+05 1.213479e+05 1.185021e+05 3.395196e+05 1.440499e+05 1.191722e+06 1.355164e+06 2.010642e+06 1.524629e+06 3.423217e+05 1.550270e+05 8.562287e+05 2.706569e+06 5.957975e+05 1.014367e+05 5.932527e+05 1.144505e+05 8.631068e+06 3.557355e+05 3.375470e+06 3.988616e+05 1.234290e+05 3.669317e+06 2.127992e+06 3.099322e+06 3.478442e+06 5.957407e+05 1.717137e+06 2.340671e+06 1.852142e+05 8.752444e+05 6.610671e+05 2.744995e+06 6.641954e+05 7.036723e+05 5.639157e+05 1.326961e+05 1.422556e+05 3.120474e+06 9.993775e+04 1.241668e+05 6.360388e+05 1.603466e+05 2.363557e+05 1.212496e+05 3.115672e+06 1.485223e+05 5.651111e+06 3.843551e+06 1.270735e+06 1.332777e+05 1.961014e+06 1.281031e+06 1.181966e+05 1.094100e+06 1.685727e+05 1.057397e+06 3.246754e+05 9.996414e+04 1.032048e+05 1.071156e+05 1.196692e+05 2.502501e+05 1.069519e+05 1.569616e+05 1.540929e+05 4.661204e+05 5.661669e+06 3.704678e+05 1.155374e+05 3.737777e+05 2.155239e+05 1.095892e+05 1.650645e+06 4.062485e+06 3.168156e+06 2.595855e+05 5.230954e+06 1.469336e+05 9.834659e+04 1.150902e+05 9.165444e+04 1.033243e+05 1.967923e+06 9.268161e+04 1.223748e+05 1.547577e+06 2.883929e+06 8.278479e+05 2.673293e+05 9.593228e+04 1.160863e+06 1.353038e+05 1.182883e+05 1.071314e+05 9.384158e+04 1.752050e+05 3.483656e+05 1.096176e+05 9.834794e+04 2.772848e+05 1.339208e+05 1.408248e+05 3.062582e+06 3.348629e+05 1.032877e+06 1.190552e+05 1.662245e+06 3.072734e+06 8.794959e+05 1.105333e+05 1.403295e+05 7.219546e+06 1.127453e+05 1.131397e+06 1.120930e+06 1.150887e+05 1.071036e+05 2.073542e+05 2.250211e+05 9.093132e+04 1.106280e+05 2.411854e+05 6.651678e+05 1.953262e+06 9.048108e+04 2.285104e+06 4.716519e+05 8.605299e+05 7.351164e+06 5.274520e+05 2.355675e+05 3.110784e+05 1.278571e+05 1.379107e+05 1.073921e+06 1.055632e+06 7.190909e+05 C4 H7 N O_8.653 4.448461e+06 5.768980e+06 7.343638e+06 6.332434e+06 1.733159e+05 2.102343e+06 7.552271e+06 7.332078e+06 180410.83 1.620293e+06 6.258557e+06 7.246440e+06 126902.28 5.663985e+06 4.881139e+06 5.416458e+06 1.864281e+05 5.383775e+06 5.664940e+06 6.347365e+06 6.202856e+04 4.826950e+06 6.201840e+06 6.350674e+06 16344.967 5.008355e+06 5.296236e+06 5.126593e+06 1.804834e+05 5.953512e+06 5.478574e+06 6.840292e+06 112479.30 4.985926e+06 5.750786e+06 5.620228e+06 6.485702e+04 4.905929e+06 5.778764e+06 6.378688e+06 1.071603e+05 5.497370e+06 4.677094e+06 6.820023e+06 1.104168e+05 5.416799e+06 4.895923e+06 6.029360e+06 5.346354e+06 4.371383e+06 4.233864e+06 1.353288e+07 3.916415e+06 8.960149e+06 1.126650e+07 8.594546e+06 7.287318e+06 1.218144e+07 9.675989e+06 5.334964e+06 5.920734e+06 8.020558e+06 5.254062e+06 5.878269e+06 5.707806e+06 5.144460e+06 1.082202e+07 3.131417e+06 8.301561e+06 6.869863e+06 8.254174e+06 5.613477e+06 5.391272e+06 8.179248e+06 7.100475e+06 5.652650e+06 5.215627e+06 1.036005e+07 4.805233e+06 8.225790e+06 6.453695e+06 4.570867e+06 1.937120e+06 5.657951e+06 1.185875e+07 1.320212e+07 4.751125e+06 7.793967e+06 5.388670e+06 2.190909e+06 6.239563e+06 1.033944e+07 2.913511e+06 6.753226e+06 5.924731e+06 1.892548e+07 7.720074e+06 6.372424e+06 5.840961e+06 3.264203e+06 1.189817e+07 1.327643e+07 7.515293e+06 8.454580e+06 7.683816e+06 5.056244e+06 3.606728e+06 1.129025e+07 4.710554e+06 6.274699e+06 3.097744e+06 4.861061e+06 1.466163e+07 6.521410e+06 6.434094e+06 1.045201e+07 5.087755e+06 9.729210e+06 4.734192e+06 7.996630e+06 4.853254e+06 4.895125e+06 6.373961e+06 3.823112e+06 3.656106e+06 5.973187e+06 8.112929e+06 5.794643e+06 3.741438e+06 2.124308e+06 3.560875e+06 8.112100e+06 3.981662e+06 9.313097e+06 7.866325e+06 4.567572e+06 4.852441e+06 9.323278e+06 7.035465e+06 1.234992e+07 8.106579e+06 9.616366e+06 7.871583e+06 6.232130e+06 1.375321e+07 4.729321e+06 4.473522e+06 5.073610e+06 5.209912e+06 4.924982e+06 3.805905e+06 3.142225e+06 3.603027e+06 5.521221e+06 6.834112e+06 5.155112e+06 4.003124e+06 4.696460e+06 3.055978e+06 4.279538e+06 5.030627e+06 4.667230e+06 7.314185e+06 4.245086e+06 5.834766e+06 1.102522e+07 4.058108e+06 5.111794e+06 6.215430e+06 3.066943e+06 1.095911e+07 5.421065e+06 5.058197e+06 3.200551e+06 4.856895e+06 5.719931e+06 7.354425e+06 1.114672e+07 5.765738e+06 5.069041e+06 4.050495e+06 1.653802e+06 6.697171e+06 3.988767e+06 6.532703e+06 4.420254e+06 5.274337e+06 5.290096e+06 6.149347e+06 1.132232e+07 4.852035e+06 1.276630e+07 1.962530e+07 4.267490e+06 3.416721e+06 8.121240e+06 5.301215e+06 3.037326e+06 1.969011e+06 9.120305e+06 5.286834e+06 1.215663e+07 4.656124e+06 8.917315e+06 5.271062e+06 3.490515e+06 5.390806e+06 5.461509e+06 4.576923e+06 5.127605e+06 8.308391e+06 4.362721e+06 2.143021e+06 8.367225e+06 5.119627e+06 8.596345e+06 7.388402e+06 4.481207e+06 6.370434e+06 5.581222e+06 3.534517e+06 5.454712e+06 7.604180e+06 2.566893e+06 3.978375e+06 4.731858e+06 3.632091e+06 4.443931e+06 7.542163e+06 8.602142e+06 2.918608e+06 4.344356e+06 5.696682e+06 4.600489e+06 4.055297e+06 5.506726e+06 8.218698e+06 4.809185e+06 4.622023e+06 8.611354e+06 6.843743e+06 1.214197e+07 4.488572e+06 7.659417e+06 3.593790e+06 6.072196e+06 6.883619e+06 4.085756e+06 3.591417e+06 6.912077e+06 8.255963e+06 5.170962e+06 8.733495e+06 8.906384e+06 7.117832e+06 6.124163e+06 2.135596e+06 5.608332e+06 7.014418e+06 4.597409e+06 6.347556e+06 8.310583e+06 TRANS-4-HYDROXY-L-PROLINE 1.381594e+08 2.034258e+08 2.053889e+08 1.965789e+08 1.438347e+05 9.471439e+07 2.060492e+08 2.147786e+08 153973.47 1.773651e+08 1.863180e+08 1.810691e+08 121704.75 1.837865e+08 1.798288e+08 1.944584e+08 1.929740e+05 1.673442e+08 1.788121e+08 1.856062e+08 6.613220e+04 1.720289e+08 1.893103e+08 2.337702e+08 17085.201 1.561414e+08 1.860567e+08 1.786877e+08 1.747613e+04 1.691666e+08 1.868444e+08 2.098956e+08 124388.17 1.715281e+08 1.740629e+08 1.958250e+08 7.148913e+04 1.713993e+08 1.816208e+08 1.976310e+08 1.188262e+05 1.757455e+08 1.908142e+08 1.948414e+08 1.244666e+05 1.701303e+08 1.773965e+08 1.906394e+08 1.956419e+08 1.226691e+08 1.532313e+08 3.759748e+08 1.233905e+08 2.852995e+08 3.354785e+08 2.761715e+08 2.245905e+08 2.170805e+08 3.067399e+08 1.574347e+08 2.688674e+08 2.401029e+08 1.813399e+08 1.758596e+08 2.059256e+08 1.620687e+08 3.631836e+08 1.109181e+08 2.365948e+08 2.088971e+08 2.136325e+08 1.879441e+08 1.878804e+08 2.136161e+08 2.356684e+08 1.830262e+08 1.793560e+08 4.047630e+08 1.697317e+08 2.262245e+08 1.943093e+08 1.328333e+08 6.895628e+07 1.649542e+08 3.754887e+08 3.878410e+08 1.505268e+08 2.172621e+08 1.918010e+08 6.437088e+07 2.410176e+08 2.357615e+08 1.053158e+08 2.079365e+08 1.845193e+08 5.469514e+08 2.081090e+08 2.045294e+08 1.653934e+08 1.062601e+08 3.150421e+08 3.874266e+08 2.103821e+08 2.949403e+08 2.434156e+08 1.951850e+08 1.229903e+08 3.598549e+08 1.480079e+08 1.668850e+08 1.137941e+08 1.446646e+08 4.096191e+08 2.116752e+08 2.052838e+08 2.944803e+08 1.640995e+08 2.726516e+08 1.361680e+08 2.403579e+08 1.550416e+08 1.621198e+08 2.257425e+08 1.263901e+08 1.378472e+08 1.940299e+08 2.093108e+08 1.917328e+08 1.002072e+08 7.498060e+07 1.110785e+08 2.166074e+08 1.528774e+08 2.809603e+08 2.503076e+08 1.553365e+08 1.595721e+08 2.405933e+08 2.116435e+08 3.131352e+08 2.405850e+08 2.722087e+08 2.511740e+08 2.197431e+08 3.270031e+08 1.961631e+08 1.282374e+08 1.681061e+08 1.383864e+08 1.684099e+08 1.399941e+08 1.055480e+08 1.303153e+08 2.018376e+08 2.080532e+08 1.658536e+08 1.600362e+08 1.219868e+08 1.151817e+08 1.467213e+08 1.414476e+08 1.695896e+08 2.217925e+08 1.392975e+08 2.176320e+08 2.926443e+08 1.411172e+08 1.599235e+08 2.141338e+08 1.173767e+08 3.044994e+08 1.736521e+08 1.836961e+08 1.096460e+08 1.669061e+08 1.591737e+08 2.554073e+08 3.195270e+08 1.795991e+08 1.431312e+08 1.339506e+08 6.611749e+07 2.193840e+08 1.068538e+08 2.308799e+08 1.563865e+08 1.583252e+08 1.769202e+08 1.463246e+08 3.175701e+08 1.559059e+08 3.147953e+08 5.238619e+08 1.439847e+08 1.074533e+08 2.151191e+08 1.922669e+08 9.918595e+07 6.273835e+07 2.650408e+08 1.678902e+08 3.563815e+08 1.413538e+08 2.575580e+08 1.478260e+08 1.114859e+08 1.734492e+08 1.337558e+08 1.759191e+08 1.002542e+08 2.549647e+08 1.470999e+08 7.384324e+07 2.761634e+08 3.563076e+07 2.592938e+08 2.478835e+08 1.107889e+08 1.949510e+08 1.728514e+08 1.039343e+08 1.499464e+08 2.355062e+08 1.038255e+08 1.271557e+08 1.386948e+08 1.232948e+08 1.660314e+08 2.442763e+08 2.327468e+08 1.459085e+07 1.535291e+08 1.677708e+08 1.502918e+08 1.370698e+08 1.814233e+08 2.133854e+08 1.583403e+08 1.310895e+08 2.168551e+08 2.130850e+08 2.768561e+08 1.488735e+08 2.259483e+08 1.101093e+08 1.946832e+08 1.856143e+08 1.366071e+08 1.327028e+08 2.109077e+08 2.298495e+08 1.941295e+08 2.131351e+08 2.573516e+08 1.913339e+08 1.957584e+08 6.480780e+07 1.936269e+08 2.313985e+08 1.653419e+08 2.225494e+08 2.113622e+08 C8 H11 N O3 S_8.659 3.918809e+05 7.329488e+06 7.924631e+06 7.674875e+06 2.607853e+05 3.107199e+06 7.865809e+06 7.719925e+06 263131.17 7.114195e+06 6.540168e+06 7.716530e+06 206563.54 5.577649e+06 7.421843e+06 7.319195e+06 3.202308e+05 6.239124e+06 7.039472e+06 6.656685e+06 1.062893e+05 5.794279e+06 7.236695e+06 8.786932e+06 60075.092 6.007118e+06 6.749630e+06 6.853693e+06 4.904949e+04 6.635379e+06 6.601765e+06 7.315815e+06 206801.18 7.144043e+06 7.083371e+06 5.711010e+06 1.247436e+05 7.093325e+06 6.531590e+06 8.332219e+06 2.101097e+05 7.351632e+06 5.841136e+06 6.777990e+06 2.264539e+05 6.474322e+06 6.557702e+06 7.561264e+06 2.270714e+05 2.265865e+05 2.175051e+05 2.845255e+05 2.147169e+05 3.790355e+05 2.685087e+05 2.322073e+05 2.209031e+05 2.339395e+05 3.632751e+05 2.606693e+05 2.292492e+05 2.391594e+05 2.365170e+05 2.366440e+05 2.541786e+05 2.425655e+05 2.295580e+05 2.159472e+05 2.071135e+05 2.203224e+05 2.345573e+05 2.127733e+05 2.508366e+05 2.144196e+05 1.990009e+05 2.270155e+05 1.940420e+05 2.053437e+05 2.203670e+05 3.010979e+05 4.019533e+05 1.997522e+05 3.956842e+05 2.577322e+05 2.286702e+05 2.473698e+05 2.442576e+05 2.902826e+05 2.003911e+05 1.726606e+05 2.398414e+05 2.267250e+05 2.262692e+05 2.358531e+05 2.595462e+05 2.309384e+05 2.844806e+05 2.542621e+05 2.333145e+05 1.939765e+05 2.351436e+05 2.317576e+05 1.979831e+05 2.414564e+05 2.383871e+05 2.274802e+05 2.444248e+05 2.406109e+05 2.421748e+05 2.235701e+05 2.146807e+05 1.860638e+05 2.910902e+05 2.420506e+05 2.174984e+05 2.891944e+05 1.833725e+05 2.539841e+05 6.220254e+05 2.192999e+05 2.302699e+05 2.353135e+05 1.970994e+05 2.130621e+05 2.418495e+05 2.383126e+05 2.545745e+05 2.679918e+05 6.966441e+05 2.217727e+05 2.277441e+05 2.375018e+05 2.199509e+05 2.327862e+05 2.053832e+05 2.730887e+05 2.154605e+05 2.025285e+05 1.919320e+05 1.935080e+05 2.377412e+05 1.958641e+05 2.244916e+05 2.750111e+05 2.580740e+05 2.292105e+05 2.879466e+05 2.195176e+05 2.361757e+05 2.599997e+05 2.252709e+05 2.143599e+05 2.026124e+05 3.515198e+05 1.950049e+05 2.640920e+05 2.643735e+05 2.080064e+05 1.875562e+05 2.569731e+05 2.401541e+05 2.770338e+05 2.040614e+05 2.209540e+05 2.429348e+05 2.168840e+05 3.208496e+05 2.445857e+05 2.300034e+05 2.258347e+05 2.281033e+05 2.032711e+05 2.420611e+05 2.104599e+05 3.537312e+05 2.223744e+05 2.496604e+05 2.519579e+05 2.073781e+05 2.422526e+05 8.222611e+07 7.038330e+06 2.258020e+07 1.838597e+07 2.554482e+07 2.815134e+07 2.936292e+07 2.262390e+07 4.743617e+07 3.042831e+07 5.185882e+07 2.838455e+07 9.808451e+07 1.271060e+07 4.393981e+07 2.781074e+07 4.553453e+07 3.398761e+07 3.861945e+07 2.199713e+07 6.169493e+07 4.802961e+07 3.023838e+05 2.068520e+07 2.713464e+07 7.952611e+06 2.824232e+07 3.404191e+07 3.153292e+07 2.591537e+07 2.903004e+07 2.710432e+07 3.797394e+07 2.621597e+07 2.304169e+07 2.760849e+07 2.254969e+07 3.096433e+07 1.600697e+07 2.878361e+07 3.168359e+07 2.907154e+07 2.412659e+07 2.136563e+07 2.772256e+07 2.312409e+07 3.459760e+07 4.689628e+07 2.342763e+07 3.460958e+07 2.544194e+07 3.691573e+07 2.506521e+07 2.527960e+07 2.387000e+07 3.214474e+07 2.799458e+07 2.576280e+07 2.706539e+07 5.802209e+05 2.393995e+05 2.357072e+05 2.199667e+05 3.605865e+05 2.123557e+05 2.550106e+05 2.244653e+05 2.752073e+05 3.876751e+05 1.987989e+05 2.284291e+05 2.370012e+05 2.194761e+05 6.819020e+05 2.860506e+05 2.540568e+05 2.141332e+05 2.573614e+05 2.231981e+05 2.869226e+05 2.083105e+05 2.322953e+05 C6 H18 N3 O5 P3 S_8.661 1.959854e+05 3.363581e+06 3.481435e+06 3.693809e+06 1.317987e+05 2.349862e+06 3.406625e+06 3.533624e+06 137234.44 3.199130e+06 3.227356e+06 3.743632e+06 104190.37 3.233304e+06 3.105087e+06 3.229539e+06 1.583973e+05 3.071904e+06 3.226770e+06 3.166181e+06 5.110712e+04 3.591134e+06 3.380026e+06 4.050278e+06 14491.198 2.594130e+06 3.391289e+06 3.338134e+06 1.528847e+04 2.879916e+06 3.207460e+06 3.714692e+06 104547.23 3.220432e+06 3.213168e+06 3.404111e+06 5.657594e+04 2.559362e+06 4.204182e+06 3.561672e+06 9.091175e+04 2.546424e+06 3.983590e+06 3.523346e+06 9.813513e+04 2.343031e+06 2.967664e+06 3.792882e+06 9.941392e+04 1.139189e+05 9.531161e+04 1.235250e+05 1.073564e+05 1.659086e+05 1.336098e+05 1.022983e+05 1.076506e+05 1.367454e+05 1.159857e+05 1.309733e+05 1.184665e+05 1.042428e+05 1.183432e+05 1.045893e+05 1.106119e+05 1.059800e+05 1.103920e+05 1.050258e+05 9.991416e+04 1.169930e+05 1.220740e+05 1.021419e+05 1.103752e+05 1.057638e+05 1.072461e+05 1.221117e+05 9.349631e+04 9.934457e+04 1.008356e+05 1.312753e+05 1.058660e+05 9.776803e+04 1.072579e+05 9.557810e+04 1.097866e+05 1.059848e+05 1.065966e+05 1.047576e+05 9.792912e+04 8.757634e+04 1.243236e+05 1.177486e+05 1.203686e+05 1.215656e+05 1.113266e+05 1.124338e+05 1.121282e+05 1.092647e+05 1.133978e+05 9.740068e+04 1.174284e+05 1.243236e+05 1.042667e+05 1.177403e+05 1.120476e+05 1.196010e+05 1.217642e+05 1.292286e+05 1.299088e+05 1.169107e+05 1.125716e+05 9.559418e+04 1.559705e+05 1.042759e+05 1.103290e+05 1.634446e+05 9.169791e+04 1.099994e+05 1.472138e+05 1.026384e+05 9.883573e+04 1.006274e+05 8.436624e+04 1.141378e+05 1.033543e+05 1.047965e+05 1.280325e+05 1.180003e+05 1.116529e+05 1.123481e+05 1.215378e+05 1.097849e+05 9.620191e+04 1.235704e+05 1.032946e+05 1.319149e+05 9.462588e+04 1.091534e+05 1.017257e+05 9.778969e+04 1.017359e+05 1.046759e+05 1.126803e+05 1.106262e+05 1.337263e+05 1.195202e+05 1.234526e+05 1.141316e+05 1.209180e+05 1.211751e+05 1.133957e+05 1.140292e+05 9.930906e+04 1.730703e+05 9.455061e+04 1.378919e+05 1.275024e+05 1.110817e+05 9.479487e+04 9.826044e+04 1.200902e+05 1.313352e+05 9.797097e+04 9.690247e+04 1.127537e+05 1.088135e+05 1.414342e+05 1.026925e+05 1.031973e+05 1.003892e+05 1.171780e+05 9.814955e+04 1.054283e+05 1.110865e+05 1.555912e+05 1.120093e+05 1.281947e+05 1.099852e+05 1.024227e+05 1.183576e+05 3.620395e+07 4.362936e+06 1.012716e+07 8.238547e+06 1.166447e+07 1.012766e+07 1.319524e+07 1.012084e+07 1.967390e+07 1.022951e+07 2.457553e+07 1.243185e+07 9.862913e+06 5.125831e+06 1.770464e+07 1.316727e+07 1.658471e+07 1.784066e+07 2.390080e+07 1.054137e+07 2.893143e+07 1.651124e+07 1.352708e+05 9.551472e+06 1.215269e+07 4.182032e+06 1.283215e+07 1.613613e+07 1.272876e+07 9.410039e+06 9.189343e+06 1.317225e+07 1.705245e+07 1.311064e+07 9.893761e+06 1.078799e+07 8.504482e+06 1.184208e+07 7.976335e+06 1.322875e+07 1.509640e+07 1.201480e+07 1.077032e+07 7.463306e+06 1.217177e+07 1.103174e+07 1.288160e+07 1.803485e+07 1.023717e+07 1.583623e+07 1.218197e+07 1.437923e+07 1.035614e+07 1.137679e+07 1.063269e+07 1.135128e+07 1.732188e+07 9.357627e+06 1.303249e+07 1.245180e+05 1.127861e+05 1.231381e+05 1.170110e+05 1.652851e+05 1.067304e+05 1.126657e+05 1.209369e+05 1.408498e+05 1.037358e+05 9.962508e+04 1.154451e+05 1.241795e+05 1.134900e+05 1.122426e+05 1.479555e+05 1.250186e+05 1.116663e+05 1.129237e+05 1.014221e+05 1.256465e+05 1.112335e+05 1.152640e+05 C13 H14 O13_8.661 1.581639e+05 1.124592e+06 1.051701e+06 1.098526e+06 1.081035e+05 7.559857e+05 1.152582e+06 8.991247e+05 122234.22 1.004976e+06 1.333136e+06 1.126623e+06 98713.78 9.015970e+05 8.347092e+05 1.084929e+06 1.493693e+05 9.252514e+05 9.772598e+05 9.661641e+05 4.571755e+04 1.361426e+06 1.010749e+06 1.106200e+06 13283.974 8.841751e+05 1.104932e+06 9.012758e+05 1.418121e+04 1.027260e+06 1.020969e+06 1.145939e+06 97702.82 1.001773e+06 1.125162e+06 9.108514e+05 5.256373e+04 8.063176e+05 1.178778e+06 1.074187e+06 7.923817e+04 1.109165e+06 1.214947e+06 1.016125e+06 8.780957e+04 7.484165e+05 9.506553e+05 1.174415e+06 9.055441e+04 1.091596e+05 8.701682e+04 1.088764e+05 9.809955e+04 1.553186e+05 1.270937e+05 9.579790e+04 9.642722e+04 1.011324e+05 1.082873e+05 1.257597e+05 1.104901e+05 9.409787e+04 1.134696e+05 9.558254e+04 9.858000e+04 9.609714e+04 9.971276e+04 9.829894e+04 9.080595e+04 1.077767e+05 1.052945e+05 9.167516e+04 1.024154e+05 9.512605e+04 9.939475e+04 1.130176e+05 8.478996e+04 8.883318e+04 9.656325e+04 1.176825e+05 9.492788e+04 9.083557e+04 9.826175e+04 9.109009e+04 9.867031e+04 9.332741e+04 9.643857e+04 1.006560e+05 8.779533e+04 7.739046e+04 1.166295e+05 1.058073e+05 1.113585e+05 1.104231e+05 9.821819e+04 1.036648e+05 9.858552e+04 9.487810e+04 1.042911e+05 9.362849e+04 1.026764e+05 1.153883e+05 9.583690e+04 1.086763e+05 1.048699e+05 1.113093e+05 1.138843e+05 1.199193e+05 1.200793e+05 1.088826e+05 1.048040e+05 8.676302e+04 1.441031e+05 9.056179e+04 1.030683e+05 1.258902e+05 8.289901e+04 9.720975e+04 1.373493e+05 9.603952e+04 8.584494e+04 8.766620e+04 7.415481e+04 1.059555e+05 9.039583e+04 9.527920e+04 1.122059e+05 1.099975e+05 1.049276e+05 1.052711e+05 1.121316e+05 1.025772e+05 8.742911e+04 1.148563e+05 9.884448e+04 1.201589e+05 8.699074e+04 9.662323e+04 9.366227e+04 8.864199e+04 8.854122e+04 9.662077e+04 1.083378e+05 1.020147e+05 1.141854e+05 1.113531e+05 1.072773e+05 1.063711e+05 1.109493e+05 1.133439e+05 1.081453e+05 1.059577e+05 8.912014e+04 1.619380e+05 8.458144e+04 1.204787e+05 1.193523e+05 9.604114e+04 8.604063e+04 9.387883e+04 1.122992e+05 1.229513e+05 8.782781e+04 8.867305e+04 1.054161e+05 1.046145e+05 1.289270e+05 9.010525e+04 8.255829e+04 9.218602e+04 1.069488e+05 8.774468e+04 9.423487e+04 1.021663e+05 1.440362e+05 1.030679e+05 1.196446e+05 9.888555e+04 9.399187e+04 1.096842e+05 1.139355e+07 1.431987e+06 3.270010e+06 2.583200e+06 3.576008e+06 4.318926e+06 5.080636e+06 3.304291e+06 6.571398e+06 3.593699e+06 7.561977e+06 3.569690e+06 3.022503e+06 1.473595e+06 4.990667e+06 3.202740e+06 4.971810e+06 4.950472e+06 8.301845e+06 3.123442e+06 1.032623e+07 6.748855e+06 1.247640e+05 2.800933e+06 2.757381e+06 1.407016e+06 4.406554e+06 4.053480e+06 4.097723e+06 4.107495e+06 3.745127e+06 3.461373e+06 3.847174e+06 4.684273e+06 3.679955e+06 2.385966e+06 2.961068e+06 3.493749e+06 2.857206e+06 4.398936e+06 5.378942e+06 3.953206e+06 2.764141e+06 2.795915e+06 2.662157e+06 4.048092e+06 2.995202e+06 5.651400e+06 2.350105e+06 4.992324e+06 3.204033e+06 4.678489e+06 3.872176e+06 2.582276e+06 3.550589e+06 2.738304e+06 5.502363e+06 3.059363e+06 4.031391e+06 1.048469e+05 1.026327e+05 1.082367e+05 1.078485e+05 1.416134e+05 1.023883e+05 1.033358e+05 1.120507e+05 1.314977e+05 9.493686e+04 9.569764e+04 1.088001e+05 1.154933e+05 1.026310e+05 9.894298e+04 1.259019e+05 1.170401e+05 9.695034e+04 1.023920e+05 9.628040e+04 1.136138e+05 1.033061e+05 1.091874e+05 168.50906_8.663 1.941828e+05 3.105703e+06 2.566249e+06 3.598375e+06 1.291844e+05 2.096197e+06 2.831091e+06 3.176883e+06 127487.15 2.510195e+06 3.358821e+06 3.052705e+06 96422.50 2.888165e+06 2.942296e+06 2.881336e+06 1.546155e+05 2.312997e+06 3.004075e+06 2.965087e+06 5.038715e+04 2.561891e+06 3.146957e+06 3.537776e+06 13413.550 2.302592e+06 3.414972e+06 2.620629e+06 1.390959e+04 2.428676e+06 2.735960e+06 3.344733e+06 96186.73 2.978460e+06 2.861461e+06 3.014101e+06 5.588475e+04 2.621364e+06 2.789841e+06 3.368392e+06 9.135677e+04 2.361941e+06 3.368792e+06 3.125489e+06 9.139821e+04 2.130842e+06 2.817278e+06 3.164527e+06 9.043254e+04 1.064946e+05 8.647618e+04 1.253368e+05 9.979845e+04 1.573328e+05 1.292809e+05 9.110676e+04 1.047635e+05 1.112951e+05 1.130863e+05 1.229216e+05 1.083119e+05 9.589418e+04 1.131187e+05 1.056974e+05 1.126827e+05 9.693173e+04 1.094186e+05 9.853495e+04 9.903427e+04 1.067987e+05 1.158623e+05 1.010612e+05 9.859632e+04 1.019209e+05 9.743835e+04 1.160355e+05 9.268340e+04 9.730583e+04 9.662263e+04 1.337952e+05 9.787204e+04 9.634009e+04 1.081416e+05 9.226132e+04 1.086955e+05 1.012893e+05 9.777338e+04 9.852194e+04 9.507855e+04 8.222371e+04 1.131721e+05 1.119723e+05 1.092588e+05 1.116014e+05 1.060414e+05 1.111207e+05 1.136022e+05 1.082563e+05 1.121578e+05 9.200004e+04 1.031414e+05 1.131991e+05 9.576636e+04 1.107456e+05 1.075273e+05 1.090836e+05 1.127464e+05 1.176455e+05 1.179457e+05 1.066920e+05 1.027001e+05 8.957776e+04 1.416515e+05 1.038356e+05 1.014716e+05 1.432529e+05 8.745648e+04 1.117606e+05 1.346832e+05 9.880469e+04 9.766572e+04 9.832218e+04 8.089490e+04 1.039408e+05 1.000653e+05 1.063261e+05 1.202687e+05 1.050167e+05 1.065472e+05 1.034367e+05 1.105874e+05 1.066968e+05 8.774554e+04 1.126137e+05 9.638273e+04 1.307241e+05 8.523505e+04 9.992483e+04 9.298754e+04 9.278714e+04 9.969625e+04 9.516974e+04 1.064350e+05 1.007537e+05 1.277408e+05 1.091131e+05 1.216613e+05 1.042378e+05 1.108443e+05 1.170177e+05 1.054367e+05 1.039022e+05 9.618384e+04 1.612313e+05 9.242254e+04 1.297905e+05 1.202448e+05 1.037448e+05 8.971633e+04 9.152109e+04 1.109973e+05 1.252745e+05 9.685761e+04 8.769947e+04 1.092320e+05 1.030160e+05 1.432337e+05 9.878943e+04 1.030087e+05 1.009594e+05 1.074524e+05 9.631701e+04 1.074427e+05 1.018567e+05 1.392591e+05 1.026914e+05 1.173706e+05 1.120709e+05 1.008019e+05 1.167584e+05 3.187048e+07 3.364692e+06 9.193943e+06 7.507972e+06 1.114060e+07 1.064100e+07 1.214556e+07 8.762561e+06 1.787071e+07 9.734852e+06 2.045334e+07 1.091912e+07 8.395098e+06 4.430785e+06 1.700296e+07 1.142370e+07 1.439110e+07 1.465657e+07 1.939818e+07 9.998511e+06 2.455457e+07 1.922521e+07 1.352826e+05 8.426558e+06 1.068607e+07 3.721867e+06 1.101243e+07 1.451137e+07 1.235186e+07 1.118975e+07 1.038379e+07 1.144536e+07 1.450671e+07 1.097778e+07 8.668772e+06 1.042632e+07 7.720463e+06 1.043912e+07 7.569987e+06 1.111253e+07 1.271950e+07 1.074704e+07 9.932997e+06 7.949426e+06 1.099283e+07 1.021535e+07 1.322813e+07 1.677540e+07 9.029255e+06 1.496303e+07 1.087005e+07 1.274215e+07 8.971889e+06 1.045437e+07 9.096537e+06 1.064873e+07 1.568919e+07 9.534165e+06 1.196081e+07 1.200027e+05 1.020916e+05 1.154437e+05 1.066846e+05 1.575466e+05 1.070094e+05 1.017199e+05 1.039856e+05 1.290667e+05 1.027218e+05 9.476265e+04 1.065441e+05 1.132092e+05 1.043762e+05 1.050264e+05 1.416414e+05 1.226875e+05 1.055387e+05 1.147511e+05 9.836406e+04 1.278398e+05 1.013253e+05 1.120398e+05 C5 H9 N3 O P2_8.664 1.335353e+05 1.362894e+06 8.384433e+05 7.944626e+05 9.358602e+04 5.957217e+05 8.965046e+05 8.409005e+05 115485.28 8.711779e+05 1.136361e+06 1.180958e+06 95586.08 7.202365e+05 7.435273e+05 8.816903e+05 1.561377e+05 8.979795e+05 8.590225e+05 8.731546e+05 5.018600e+04 1.023793e+06 9.393663e+05 1.067386e+06 13912.778 7.521423e+05 9.615942e+05 9.042570e+05 1.468245e+04 8.520393e+05 8.577107e+05 8.410263e+05 103126.13 1.043009e+06 9.656356e+05 8.558553e+05 5.694265e+04 7.687927e+05 1.103360e+06 8.516293e+05 8.897199e+04 7.597055e+05 1.240501e+06 9.357945e+05 9.125656e+04 6.622163e+05 7.784663e+05 1.059426e+06 9.184361e+04 1.071789e+05 8.799008e+04 1.177529e+05 1.062357e+05 1.652004e+05 1.310487e+05 9.407617e+04 1.050788e+05 1.108296e+05 1.164586e+05 1.241720e+05 1.163739e+05 9.659797e+04 1.149735e+05 1.053474e+05 1.104915e+05 9.805472e+04 1.090422e+05 1.042193e+05 9.885320e+04 1.117926e+05 9.731119e+04 1.006013e+05 1.013788e+05 1.028901e+05 1.026172e+05 1.220871e+05 9.245939e+04 9.721966e+04 1.157390e+05 1.315079e+05 8.999270e+04 9.676927e+04 1.080626e+05 9.359714e+04 1.082152e+05 9.945370e+04 9.870097e+04 9.967998e+04 9.550863e+04 8.418104e+04 1.227758e+05 1.034297e+05 1.149303e+05 1.052284e+05 1.043206e+05 1.113632e+05 1.109398e+05 1.051850e+05 1.123228e+05 9.320751e+04 1.047651e+05 1.198978e+05 9.983141e+04 1.169290e+05 1.120048e+05 1.167757e+05 1.203508e+05 1.244865e+05 1.239972e+05 1.144039e+05 1.100375e+05 9.217087e+04 1.488641e+05 1.009335e+05 9.905505e+04 1.137331e+05 8.891307e+04 1.092942e+05 1.447313e+05 1.026986e+05 9.489095e+04 9.565359e+04 7.928525e+04 1.102048e+05 9.762916e+04 1.054646e+05 1.050005e+05 1.082198e+05 1.046685e+05 1.012953e+05 1.160317e+05 1.101457e+05 8.894132e+04 1.200624e+05 9.679576e+04 1.305666e+05 8.716956e+04 1.043949e+05 9.724468e+04 9.466640e+04 9.693484e+04 9.991727e+04 1.079542e+05 1.056390e+05 1.044523e+05 1.170797e+05 1.182158e+05 1.119121e+05 1.060466e+05 1.112600e+05 1.053862e+05 1.106512e+05 9.677273e+04 1.713734e+05 9.244919e+04 1.125057e+05 1.267297e+05 9.237822e+04 9.169342e+04 9.170237e+04 1.186317e+05 1.310273e+05 9.641518e+04 8.939464e+04 1.130280e+05 1.045804e+05 1.424066e+05 9.666158e+04 1.001664e+05 1.011564e+05 1.020704e+05 9.613251e+04 1.054717e+05 1.062998e+05 1.430162e+05 9.858957e+04 1.261271e+05 1.103138e+05 1.013329e+05 1.171872e+05 1.012316e+07 1.089329e+06 3.140624e+06 2.108264e+06 3.167580e+06 3.476329e+06 2.087915e+06 2.760195e+06 5.866023e+06 3.441223e+06 6.446374e+06 3.324151e+06 1.219813e+05 1.279922e+06 5.195996e+06 3.272353e+06 4.475517e+06 4.845245e+06 5.515993e+06 3.570880e+06 8.269216e+06 6.401762e+06 1.363002e+05 2.702341e+06 2.830566e+06 1.108963e+06 3.602651e+06 3.756099e+06 3.570701e+06 2.684563e+06 3.410606e+06 3.321677e+06 4.615981e+06 3.503411e+06 2.620513e+06 3.352049e+06 2.362265e+06 2.710923e+06 2.290451e+06 2.806985e+06 4.093928e+06 3.415867e+06 3.083070e+06 2.160968e+06 3.440616e+06 2.640012e+06 3.573229e+06 4.660912e+06 2.841534e+06 4.065741e+06 3.711700e+06 4.337255e+06 2.963315e+06 3.115018e+06 2.901617e+06 3.515365e+06 3.341659e+06 3.124733e+06 3.243208e+06 9.428529e+04 1.047001e+05 1.014821e+05 1.117694e+05 1.300185e+05 1.079075e+05 1.038623e+05 1.094828e+05 1.386719e+05 1.027325e+05 9.630403e+04 1.049881e+05 1.209564e+05 9.764903e+04 9.293330e+04 1.147197e+05 1.178483e+05 9.010413e+04 1.135721e+05 9.962176e+04 1.262711e+05 1.076654e+05 1.133660e+05 C5 H11 N O3_8.672 2.068287e+06 1.876178e+06 1.632017e+06 1.856672e+06 2.037966e+05 8.871283e+05 1.888531e+06 2.418062e+06 204068.73 1.608521e+06 1.572816e+06 1.837103e+06 183508.73 1.475600e+06 1.655508e+06 1.430109e+06 3.546239e+05 1.743435e+06 1.761403e+06 1.463106e+06 1.505219e+05 1.450163e+06 1.551170e+06 3.144541e+06 37704.251 1.248858e+06 1.586804e+06 1.496231e+06 3.100783e+04 1.424507e+06 1.463677e+06 2.318119e+06 243386.12 1.506702e+06 1.810259e+06 1.420018e+06 2.135812e+05 1.447418e+06 1.926376e+06 1.765079e+06 2.165910e+05 1.355858e+06 2.088473e+06 2.254273e+06 2.198243e+05 1.217204e+06 1.532878e+06 1.717346e+06 2.225304e+06 7.907927e+05 9.659430e+05 3.444622e+06 3.373801e+06 2.318108e+06 3.352586e+06 4.813873e+06 3.652194e+06 6.099873e+06 5.142186e+06 3.231219e+06 2.912039e+06 3.147950e+06 2.746705e+06 4.896948e+06 3.528691e+06 1.901232e+06 2.308869e+06 7.931287e+05 1.750803e+06 1.152493e+06 3.980496e+06 2.817531e+06 3.412500e+06 9.505517e+05 1.329209e+06 3.803567e+06 1.981571e+06 1.091213e+06 6.546606e+06 2.389875e+06 1.920224e+06 1.684503e+06 7.542888e+05 2.691276e+06 1.119949e+06 2.031103e+06 1.434850e+06 1.456357e+06 1.293550e+06 1.212408e+06 1.692445e+06 2.805260e+06 2.684922e+06 1.260970e+06 1.477029e+06 2.773711e+06 1.874816e+06 1.758106e+06 3.950332e+06 1.160108e+06 1.661706e+06 3.610742e+06 9.636762e+05 3.078187e+06 1.104709e+06 1.364106e+06 1.283855e+06 1.317237e+06 1.411067e+06 1.958278e+06 1.312150e+06 8.331877e+05 2.166185e+06 3.273888e+06 3.467885e+06 1.513143e+06 2.056525e+06 3.942976e+06 1.971858e+06 2.377772e+06 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2.443424e+06 1.353113e+06 1.791698e+06 1.877504e+06 2.024156e+06 6.347284e+05 1.895169e+06 1.288254e+06 1.525942e+06 1.662896e+06 8.374773e+05 1.414795e+06 1.240185e+06 1.880043e+06 4.089261e+06 9.612246e+05 1.134770e+06 7.684500e+05 2.102962e+06 4.647932e+05 7.420671e+05 3.271846e+06 1.249665e+06 8.619252e+05 1.995763e+06 1.345041e+06 4.989556e+05 1.345136e+06 6.433962e+05 6.636185e+05 1.472465e+06 1.079593e+06 1.546224e+06 2.063817e+06 1.116880e+06 2.477278e+06 2.252921e+06 1.515175e+06 1.428621e+06 1.859548e+06 2.254638e+06 8.350277e+05 2.098655e+06 3.187353e+06 1.251304e+06 1.817089e+06 1.533617e+06 2.278892e+06 1.927603e+06 2.518696e+06 1.261020e+06 1.373490e+06 1.912726e+06 2.412536e+06 3.294243e+06 3.274884e+06 5.175160e+06 2.194191e+06 1.474632e+06 1.132259e+06 1.761031e+06 3.697035e+06 3.639379e+06 1.707211e+06 2.952518e+06 CREATINE (peak 3)_8.71 3.686580e+07 1.091044e+08 1.101938e+08 1.086703e+08 9.639257e+04 7.553921e+07 1.220406e+08 1.060895e+08 99384.98 1.053285e+08 9.605316e+07 1.140657e+08 143997.98 1.039608e+08 1.078270e+08 1.063181e+08 1.498613e+05 1.050353e+08 1.013910e+08 1.081469e+08 1.570789e+05 9.073659e+07 1.141693e+08 1.093010e+08 16268.113 9.703932e+07 1.082976e+08 1.005509e+08 1.758700e+04 1.041597e+08 1.031434e+08 1.097454e+08 130822.99 1.139106e+08 1.063652e+08 9.758934e+07 1.543719e+05 9.989018e+07 1.033427e+08 1.076376e+08 1.972624e+05 1.083730e+08 1.005152e+08 1.051076e+08 2.399834e+05 1.080336e+08 9.933033e+07 1.100749e+08 2.336391e+08 2.492986e+07 3.343052e+07 5.042784e+08 9.449342e+07 2.135450e+08 1.229854e+08 3.012158e+08 1.088698e+08 1.417726e+08 6.669615e+07 1.383114e+08 6.407162e+07 8.382649e+07 4.515635e+07 4.085533e+07 4.250485e+08 2.217054e+08 1.987634e+08 4.758976e+07 8.263869e+07 3.794225e+07 2.096070e+08 8.239287e+07 7.768126e+07 7.592597e+07 4.081966e+07 6.249655e+08 7.097270e+07 4.824335e+07 8.418886e+07 1.122923e+08 8.407328e+07 1.289293e+08 1.016749e+07 1.350368e+08 2.391857e+07 8.327072e+07 2.961336e+07 1.068425e+08 1.978430e+07 6.655761e+06 1.722995e+08 4.423573e+08 1.162213e+08 4.738160e+07 7.767846e+07 2.052298e+08 1.706114e+08 1.513380e+08 6.769349e+08 2.588924e+07 1.043487e+08 6.193054e+08 4.626682e+07 2.511400e+08 5.128431e+07 5.118293e+07 5.208436e+07 5.529372e+07 1.310725e+07 5.336317e+07 1.066629e+08 5.634955e+07 1.160354e+08 3.387972e+08 4.598056e+08 9.184569e+07 7.330682e+07 6.296821e+08 9.397099e+07 2.924186e+07 1.320623e+08 6.464288e+07 3.427363e+07 1.042421e+08 1.098370e+08 2.132047e+07 3.987346e+07 2.226257e+07 7.206351e+07 3.188098e+08 4.063755e+07 9.277673e+07 6.827345e+07 2.363909e+08 9.661707e+07 2.073630e+08 1.322093e+08 1.973501e+08 1.083601e+08 2.044341e+08 8.375013e+07 3.059227e+08 3.375353e+08 1.437105e+08 2.986391e+08 2.808787e+08 1.024740e+09 2.565450e+08 2.450271e+08 1.101977e+08 8.076141e+07 4.688658e+07 9.001223e+07 4.447360e+07 1.300649e+08 5.769504e+07 1.029326e+08 3.850150e+07 4.782463e+07 1.173686e+08 5.518598e+07 1.242306e+08 6.960921e+07 5.237017e+07 7.707591e+07 3.912933e+07 1.490232e+07 6.810881e+07 3.879766e+07 3.924067e+07 2.179075e+07 7.603126e+07 5.957876e+07 4.803594e+07 9.904868e+07 2.585112e+08 8.889826e+07 3.111776e+07 4.710212e+07 5.381655e+08 5.069221e+08 1.019544e+07 3.258365e+07 1.311735e+08 3.169539e+08 1.530948e+08 3.854788e+07 3.391296e+07 4.888729e+07 7.355443e+07 6.163276e+07 4.150606e+08 1.244710e+09 6.795575e+07 2.478618e+08 8.348165e+07 1.444855e+08 1.814758e+08 2.705949e+07 1.063121e+08 3.904711e+07 2.910524e+08 1.944890e+07 1.290743e+08 1.159847e+08 1.685229e+08 1.994196e+08 3.460760e+07 2.224179e+07 1.089068e+08 1.788854e+08 4.223240e+07 1.612403e+07 6.882458e+07 6.316646e+07 8.029435e+07 2.507592e+07 2.334338e+07 4.603151e+08 4.558645e+07 4.774783e+07 2.261960e+08 1.057151e+08 2.695724e+07 4.813640e+07 2.891855e+07 7.151084e+06 3.880242e+08 5.696510e+07 1.186529e+08 1.352348e+08 1.037792e+08 1.775826e+08 1.852209e+08 4.762035e+07 7.264198e+07 1.166340e+08 1.666896e+08 2.724029e+07 2.470491e+08 3.011894e+08 1.425444e+08 2.324314e+08 5.543794e+07 3.247893e+08 2.961946e+08 3.668111e+07 3.262520e+07 3.704295e+07 1.759591e+08 2.666014e+08 9.342799e+07 3.869817e+08 5.965997e+07 4.014842e+07 9.051635e+07 2.908288e+07 9.391291e+07 2.754857e+07 1.025142e+09 2.601723e+07 7.017256e+07 C18 H23 N8 O7 P S2_8.77 1.802122e+05 1.052303e+06 7.319617e+05 9.101329e+05 1.241611e+05 5.939328e+05 9.889150e+05 1.017357e+06 96963.67 7.800602e+05 9.399306e+05 8.211246e+05 93126.19 7.791077e+05 9.966470e+05 7.760914e+05 1.638949e+05 8.534256e+05 8.674230e+05 8.713107e+05 5.357349e+04 8.124385e+05 8.740556e+05 9.793402e+05 14951.238 8.619120e+05 8.774755e+05 8.290259e+05 1.605498e+04 7.973442e+05 9.071871e+05 1.013855e+06 110120.52 7.415336e+05 8.001064e+05 9.094019e+05 6.783869e+04 8.008731e+05 1.033012e+06 8.706911e+05 1.008006e+05 5.960197e+05 8.947220e+05 1.248760e+06 9.235397e+04 7.254391e+05 6.937014e+05 9.280047e+05 4.406585e+05 1.034980e+05 5.030234e+05 6.849884e+06 9.730404e+05 1.730044e+06 3.096127e+05 1.325277e+06 4.132057e+05 4.203956e+05 5.428029e+05 4.189408e+06 3.591901e+05 5.378318e+05 1.145355e+05 2.355032e+05 5.137246e+06 1.627140e+06 3.636609e+05 2.709244e+05 1.733285e+05 5.730843e+05 8.335937e+06 2.990219e+05 8.939095e+05 3.009674e+06 1.042516e+05 2.168203e+06 3.657066e+05 1.304207e+06 2.588422e+05 6.221086e+05 5.249983e+05 2.044050e+06 3.262826e+05 1.253491e+06 6.928280e+05 8.895409e+05 1.211597e+05 9.203474e+04 1.032442e+05 1.476007e+05 7.834368e+05 3.573033e+06 3.937993e+05 2.464582e+05 3.646624e+05 2.495371e+06 3.611454e+06 1.244226e+05 7.258577e+06 5.233112e+05 1.037878e+05 9.342978e+05 1.046219e+05 1.809120e+06 1.318177e+05 2.597489e+05 2.508997e+05 1.271359e+05 2.537441e+05 1.012945e+06 2.413446e+05 4.174360e+05 4.640173e+05 2.935370e+06 5.408039e+06 2.479455e+05 3.280019e+05 7.120609e+05 2.213903e+05 1.219869e+05 1.133131e+05 1.025346e+05 8.464554e+04 4.177268e+05 2.441393e+05 1.330811e+05 1.370199e+05 1.047440e+05 1.395769e+05 4.532215e+05 1.348244e+05 2.029265e+05 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1.336686e+06 3.367236e+05 2.300864e+05 1.271004e+05 1.163718e+05 1.924779e+06 2.813577e+06 9.934393e+04 2.439372e+05 2.258654e+07 2.029500e+05 1.069531e+05 1.522290e+05 1.103763e+05 9.833832e+04 7.370314e+05 9.154610e+04 4.495699e+05 6.156784e+05 2.521351e+06 5.150428e+05 3.866518e+06 1.364300e+06 4.591508e+05 4.917362e+05 5.958366e+05 3.429644e+05 1.640899e+05 1.223955e+05 2.375902e+05 2.438211e+05 8.766322e+05 2.590637e+05 7.494366e+05 1.631521e+05 2.391292e+06 2.699549e+06 4.048227e+05 1.765645e+05 3.734134e+05 9.448301e+05 5.956861e+05 8.721227e+05 8.694659e+05 3.716537e+05 1.946409e+06 5.753970e+06 2.930748e+05 2.274999e+05 4.721010e+05 1.704247e+06 1.208849e+05 2.708980e+05 C18 H27 Cl N7 O12 P_8.77 1.944076e+05 4.610212e+05 4.217286e+05 4.069681e+05 1.003276e+05 1.755515e+05 4.915362e+05 4.194626e+05 90642.03 2.603367e+05 4.552692e+05 4.164024e+05 88088.29 3.794197e+05 3.139964e+05 4.658701e+05 1.527883e+05 3.193086e+05 3.637303e+05 4.120156e+05 4.906147e+04 4.030179e+05 3.873676e+05 4.214032e+05 14378.987 3.271635e+05 3.991463e+05 3.541706e+05 1.489063e+04 3.493807e+05 4.746581e+05 3.907544e+05 99920.70 3.282336e+05 4.365633e+05 3.581287e+05 6.674290e+04 3.591248e+05 3.853852e+05 4.492492e+05 1.075608e+05 3.386120e+05 3.763176e+05 4.960975e+05 1.015691e+05 2.537683e+05 3.536751e+05 4.341426e+05 2.367710e+05 9.814560e+04 1.817460e+05 3.962130e+06 5.752701e+05 4.838292e+05 1.186391e+05 6.757628e+05 2.131286e+05 1.044292e+05 3.217338e+05 2.039544e+06 1.449695e+05 1.650089e+05 1.082712e+05 1.244395e+05 2.846139e+06 8.594302e+05 1.734421e+05 1.512980e+05 9.095901e+04 1.062669e+05 3.676619e+06 9.033150e+04 3.675794e+05 1.658395e+06 1.764759e+05 9.576271e+05 2.110198e+05 8.620857e+05 2.606061e+05 2.349618e+05 8.814656e+04 1.066619e+06 1.305367e+05 7.033494e+05 9.363758e+04 6.320489e+05 1.066738e+05 1.945342e+05 2.814438e+05 8.627790e+04 2.468734e+05 1.738203e+06 1.435486e+05 3.459935e+05 1.131946e+05 1.228810e+06 2.242047e+06 1.601178e+05 3.277905e+06 1.000271e+05 1.951730e+05 3.500694e+05 1.343391e+05 7.870824e+05 2.112116e+05 1.027048e+05 2.248135e+05 1.930993e+05 2.465354e+05 4.082751e+05 1.196163e+05 8.970162e+04 1.335317e+05 1.420040e+06 2.934767e+06 2.108237e+05 1.141697e+05 2.579627e+05 1.426485e+05 1.445483e+05 2.500833e+05 2.521622e+05 9.414180e+04 1.735804e+05 1.196884e+05 3.401544e+05 2.275238e+05 1.042691e+05 1.319435e+05 1.111056e+05 2.424024e+05 1.811380e+05 1.192460e+05 1.629413e+05 9.086937e+04 2.046802e+05 9.578816e+04 1.066488e+05 1.243548e+05 1.247387e+05 1.349080e+05 2.015442e+05 1.626428e+05 2.643488e+05 1.713815e+05 1.201056e+05 2.182126e+05 1.835430e+05 1.043314e+05 1.190887e+05 1.958487e+05 1.789955e+05 1.337561e+05 5.561080e+05 5.400128e+05 9.253472e+04 2.871956e+05 8.975942e+04 2.080206e+05 4.206731e+05 1.240842e+05 4.281030e+05 3.284870e+05 1.081297e+05 3.678164e+05 3.214586e+05 3.204728e+05 2.347839e+05 3.326686e+05 3.135560e+05 1.919824e+05 1.678035e+05 2.687451e+05 1.792481e+05 2.358277e+05 7.583140e+05 2.236716e+05 9.139678e+05 9.644829e+04 8.145027e+05 1.423174e+06 2.204907e+05 1.999198e+05 6.027683e+05 3.201239e+06 7.743374e+05 1.795617e+05 1.022348e+05 8.439335e+04 1.979062e+05 1.928641e+05 1.238007e+06 1.450741e+05 9.878603e+05 5.473542e+05 2.555532e+05 2.180599e+05 2.721723e+05 1.173582e+05 1.194115e+05 9.066962e+04 1.045894e+05 3.781660e+05 9.419630e+04 1.559878e+05 2.607336e+06 2.001354e+05 9.442412e+04 9.392388e+04 4.783275e+05 3.889446e+05 2.685468e+05 8.779619e+04 1.968826e+05 9.879714e+05 9.857749e+05 1.253028e+05 1.411412e+05 1.233638e+07 8.827167e+04 1.726277e+05 9.460347e+04 1.425072e+05 8.691472e+04 3.509350e+05 1.593637e+05 1.237287e+05 2.482483e+05 1.228333e+06 1.485348e+05 2.167082e+06 7.642420e+05 1.173145e+05 1.236404e+05 2.623546e+05 3.210554e+05 4.193182e+05 1.123674e+05 1.414587e+05 1.485314e+05 3.976917e+05 1.000058e+05 3.742648e+05 2.428741e+05 1.168207e+06 1.423032e+06 2.583429e+05 4.790180e+05 9.240587e+04 4.581410e+05 1.811546e+05 3.500729e+05 3.291594e+05 8.753684e+04 1.423226e+06 2.547143e+06 9.554634e+04 3.373644e+05 9.052051e+04 9.661199e+05 1.976074e+05 1.009871e+05 Dihydrothymine (3)_8.773 1.582911e+08 9.061543e+07 8.860656e+07 8.980143e+07 1.321822e+05 5.838793e+07 9.559529e+07 9.668732e+07 114461.35 8.194860e+07 7.528825e+07 9.481869e+07 106054.09 8.712247e+07 8.112852e+07 8.803699e+07 1.852065e+05 8.013383e+07 7.978416e+07 8.922165e+07 5.806145e+04 7.249532e+07 9.220833e+07 1.137576e+08 64872.044 7.050761e+07 8.223437e+07 7.951294e+07 5.375450e+04 7.986116e+07 8.438962e+07 9.974158e+07 116190.27 8.192343e+07 8.493623e+07 7.843896e+07 8.027853e+04 8.096548e+07 8.644804e+07 9.388645e+07 1.195019e+05 8.042321e+07 9.004843e+07 9.130948e+07 1.177967e+05 7.516171e+07 7.653453e+07 9.355951e+07 5.525824e+07 3.947697e+07 1.727193e+07 9.827290e+07 3.384282e+07 3.640577e+07 2.495584e+08 4.720819e+07 7.434923e+07 6.506999e+07 8.392524e+07 7.406048e+07 7.336672e+08 4.633012e+08 5.973483e+07 5.335907e+07 6.960767e+07 4.062053e+07 3.869939e+07 3.305285e+07 3.703844e+07 3.619417e+07 1.477868e+08 3.276591e+07 8.376281e+07 1.293823e+08 4.131631e+07 9.068315e+07 7.060160e+07 2.065912e+08 3.681641e+08 2.610966e+08 1.011869e+08 5.982416e+07 4.323625e+07 2.750438e+07 1.797717e+08 1.414277e+08 8.257014e+07 2.319078e+07 1.401819e+08 8.576598e+07 4.989782e+07 5.181788e+07 3.719916e+07 1.087644e+08 1.251265e+08 7.839555e+07 2.190224e+07 5.548780e+08 3.867780e+07 4.505992e+08 2.011575e+07 1.601545e+08 2.212786e+08 2.126566e+08 2.933760e+07 2.633060e+07 2.761994e+07 2.653030e+07 4.031472e+08 4.167775e+07 3.754906e+07 2.697531e+07 1.759504e+07 4.465411e+07 3.065218e+07 7.891083e+07 2.889548e+07 2.623185e+08 2.885254e+07 2.166963e+08 1.588932e+07 6.104916e+07 2.323569e+07 2.187589e+07 2.989171e+07 8.314266e+07 6.180146e+07 7.726187e+07 1.345434e+08 5.433396e+08 5.451472e+08 5.839921e+07 2.822216e+07 4.389514e+07 9.963202e+07 4.675074e+07 3.761547e+07 1.996528e+08 3.553045e+07 1.668831e+08 4.113515e+07 6.176126e+07 2.612223e+07 4.264588e+07 1.166354e+08 3.375990e+07 7.938058e+07 3.589954e+07 4.856864e+07 3.218176e+07 1.818500e+07 1.962529e+07 2.711341e+07 2.464503e+08 3.317193e+07 6.462706e+07 2.637253e+07 1.294834e+07 3.097513e+07 6.730823e+07 1.918570e+07 7.153208e+07 4.903356e+07 2.405367e+07 4.363758e+07 1.413444e+08 3.306683e+08 9.465781e+07 6.476077e+07 2.647657e+07 1.343062e+08 2.405743e+07 7.286584e+07 2.882376e+07 1.829219e+08 4.574810e+07 2.362493e+07 1.422271e+08 7.933998e+07 4.784084e+07 4.906166e+08 2.889409e+07 4.899292e+07 2.939625e+08 1.399065e+08 8.798040e+07 3.442743e+07 2.909252e+07 2.907607e+07 1.717233e+08 3.932486e+07 2.206990e+08 2.172100e+08 7.404065e+07 1.567886e+08 4.513764e+07 8.633717e+07 7.819458e+07 6.778249e+07 3.333028e+07 4.159995e+07 1.081861e+08 5.733299e+07 5.448937e+07 3.140088e+07 1.873355e+08 3.783090e+07 6.018362e+07 1.719365e+08 3.603620e+07 3.291697e+07 2.008579e+07 3.649761e+07 4.240173e+07 1.914287e+08 4.441291e+07 1.677366e+08 1.173663e+07 2.660057e+08 4.671603e+07 2.005920e+07 3.741300e+07 4.831307e+07 8.342693e+06 6.553759e+07 3.075795e+07 5.286199e+07 6.833808e+07 1.358045e+08 2.590737e+07 2.064329e+08 5.535136e+07 9.765112e+07 7.624030e+07 2.229204e+07 1.094895e+08 4.464410e+07 4.280075e+07 2.968599e+07 1.024552e+08 2.200710e+08 2.527368e+08 1.059966e+08 1.281035e+08 1.095182e+08 1.719432e+08 9.538870e+07 3.056421e+07 8.770273e+07 3.861854e+07 6.830825e+07 2.574726e+08 7.105553e+07 5.213357e+07 8.897405e+07 8.054601e+07 3.871993e+07 6.486957e+07 1.888623e+08 4.643746e+07 2.707583e+08 5.746520e+07 158.0178_8.791 2.954850e+07 1.787840e+07 1.562180e+07 1.798693e+07 1.186758e+05 8.178817e+06 1.640887e+07 1.769100e+07 103619.33 1.415868e+07 1.604759e+07 1.778027e+07 93677.92 1.518441e+07 1.276988e+07 1.529634e+07 1.670321e+05 1.508844e+07 1.531661e+07 1.534683e+07 5.031663e+04 1.561750e+07 1.599828e+07 1.892114e+07 13709.958 1.279117e+07 1.588289e+07 1.511162e+07 1.438671e+04 1.400582e+07 1.630212e+07 1.760026e+07 94027.41 1.346066e+07 1.485453e+07 1.642701e+07 5.663334e+04 1.326082e+07 1.695299e+07 1.663928e+07 8.282940e+04 1.444126e+07 1.747556e+07 1.614278e+07 8.633744e+04 1.221044e+07 1.427973e+07 1.717233e+07 1.392483e+07 1.840037e+07 1.428360e+07 1.778067e+07 1.466323e+07 3.561127e+07 2.038136e+07 2.075629e+07 2.914384e+07 2.550674e+07 3.459048e+07 2.419104e+07 1.876185e+07 1.515457e+07 1.624296e+07 1.802179e+07 1.734464e+07 1.664074e+07 1.636992e+07 1.687865e+07 1.803490e+07 1.795741e+07 2.820837e+07 1.755926e+07 2.321202e+07 1.547681e+07 1.995499e+07 2.036228e+07 1.430889e+07 1.328045e+07 3.810575e+07 3.046963e+07 2.163993e+07 1.526380e+07 1.623253e+07 2.384906e+07 1.584176e+07 2.000988e+07 1.274457e+07 1.758265e+07 1.712265e+07 9.794720e+06 1.494034e+07 1.783322e+07 2.515136e+07 1.368635e+07 1.455729e+07 1.902687e+07 2.199114e+07 1.069541e+07 1.496390e+07 1.442927e+07 1.953548e+07 1.956404e+07 1.260921e+07 1.354423e+07 1.407808e+07 1.076562e+07 1.741546e+07 2.164880e+07 2.280239e+07 1.768997e+07 1.080087e+07 1.872135e+07 2.284961e+07 1.407812e+07 1.991800e+07 1.159401e+07 2.008129e+07 1.664155e+07 3.803409e+07 1.592151e+07 1.313057e+07 1.422765e+07 5.920553e+06 1.419231e+07 1.021799e+07 1.191261e+07 1.198458e+07 1.343241e+07 2.871921e+07 1.408914e+07 1.987012e+07 2.186755e+07 1.586386e+07 1.708604e+07 1.129708e+07 1.702483e+07 2.026083e+07 1.274415e+07 1.068465e+07 2.167040e+07 9.007721e+06 1.714162e+07 1.562065e+07 2.150617e+07 1.726842e+07 2.113724e+07 1.155388e+07 1.435805e+07 1.378577e+07 1.269730e+07 1.703495e+07 1.759686e+07 1.853902e+07 2.547248e+07 2.229367e+07 1.263410e+07 2.538026e+07 1.603866e+07 1.556941e+07 2.404456e+07 1.173800e+07 2.908042e+07 1.151284e+07 1.411415e+07 2.263556e+07 1.618496e+07 1.544907e+07 1.519954e+07 1.535438e+07 1.671012e+07 1.777014e+07 2.118064e+07 1.990193e+07 1.843109e+07 1.319876e+07 1.903504e+07 1.618074e+07 1.364669e+07 2.198690e+07 1.349993e+07 1.123322e+07 1.331311e+07 9.901463e+06 1.222140e+07 9.050333e+06 1.215649e+07 1.575629e+07 1.094225e+07 1.112220e+07 1.400602e+07 1.443480e+07 1.860350e+07 1.841990e+06 9.336091e+06 6.162033e+06 1.819843e+07 2.022917e+07 1.766215e+07 2.162379e+07 2.538060e+07 1.618952e+07 1.595843e+07 1.965396e+07 1.407099e+07 1.168035e+07 1.207579e+07 1.549198e+07 2.733158e+07 9.854176e+06 1.207338e+07 1.522840e+07 1.592851e+07 1.513247e+07 1.071459e+07 5.154074e+06 1.523622e+07 9.277917e+06 1.135887e+07 3.716604e+07 1.393361e+07 1.493402e+07 3.156372e+07 2.187408e+07 5.960988e+06 1.398539e+07 1.083710e+07 1.009241e+07 1.410652e+07 1.678033e+07 1.537834e+07 1.742864e+07 1.502917e+07 2.147719e+07 1.338779e+07 1.448092e+07 1.353606e+07 1.874987e+07 1.709688e+07 1.222753e+07 2.800693e+07 1.989928e+07 1.521457e+07 1.096678e+07 2.378972e+07 1.210582e+07 1.538600e+07 1.310889e+07 1.505509e+07 2.655898e+07 2.011891e+07 1.513636e+07 2.170420e+07 1.983618e+07 2.643147e+07 1.945410e+07 1.506088e+07 1.338703e+07 1.728351e+07 1.516485e+07 1.290048e+07 1.476088e+07 2.524418e+07 C7 H16 N7 O6 P S_8.794 1.586106e+07 9.730243e+06 8.603141e+06 8.762108e+06 1.000287e+05 5.850509e+06 9.759932e+06 8.842712e+06 94391.68 7.762713e+06 9.009437e+06 9.910429e+06 85507.47 7.505584e+06 7.938094e+06 8.823392e+06 1.568357e+05 8.364025e+06 8.892427e+06 8.490108e+06 5.095929e+04 7.221130e+06 9.151218e+06 9.298697e+06 13889.332 8.038504e+06 9.394687e+06 8.116897e+06 1.424224e+04 7.842149e+06 8.452557e+06 9.441223e+06 91180.83 7.845466e+06 8.550220e+06 7.983487e+06 6.175241e+04 8.289542e+06 9.553709e+06 9.287455e+06 8.085376e+04 7.402108e+06 8.903836e+06 8.837092e+06 8.519932e+04 7.699183e+06 8.952774e+06 8.353637e+06 7.103431e+06 1.025404e+07 6.823753e+06 9.741510e+06 7.448076e+06 1.447525e+07 9.297052e+06 1.280076e+07 1.734392e+07 1.574091e+07 1.795114e+07 1.346454e+07 8.845723e+06 8.827475e+06 9.223447e+06 1.002709e+07 1.000989e+07 1.019147e+07 8.671867e+06 7.315259e+06 9.404271e+06 1.072032e+07 1.433514e+07 9.934894e+06 1.272981e+07 7.824487e+06 1.199292e+07 1.182704e+07 6.851944e+06 7.952351e+06 2.310813e+07 1.683311e+07 1.190800e+07 8.323510e+06 8.659571e+06 1.319923e+07 9.503524e+06 1.116367e+07 6.987430e+06 9.879497e+06 9.160774e+06 6.040374e+06 8.451317e+06 9.790555e+06 1.456748e+07 7.799816e+06 8.021407e+06 9.879029e+06 1.096740e+07 5.916835e+06 8.844590e+06 8.316753e+06 1.075779e+07 1.070901e+07 6.424226e+06 7.492948e+06 5.894197e+06 5.750204e+06 9.545379e+06 1.318197e+07 1.278843e+07 9.014851e+06 6.300335e+06 1.045160e+07 1.255323e+07 7.064080e+06 1.181287e+07 6.452340e+06 1.204095e+07 9.582076e+06 2.249339e+07 8.712221e+06 6.920890e+06 8.074347e+06 3.417881e+06 8.702184e+06 6.244244e+06 7.119756e+06 6.782506e+06 6.921607e+06 1.590682e+07 7.768903e+06 1.154175e+07 1.170576e+07 9.372786e+06 9.304172e+06 6.135019e+06 1.035485e+07 9.572896e+06 6.537298e+06 5.082032e+06 1.319645e+07 5.626915e+06 9.369564e+06 9.144587e+06 1.238394e+07 8.691745e+06 1.256004e+07 6.094349e+06 8.269759e+06 7.706552e+06 5.936644e+06 8.768726e+06 9.151256e+06 1.090338e+07 1.446222e+07 1.357502e+07 7.374362e+06 1.443887e+07 8.222604e+06 8.743818e+06 1.298820e+07 6.481085e+06 1.468592e+07 6.013299e+06 7.087876e+06 1.195555e+07 8.860472e+06 7.500579e+06 8.973981e+06 8.148309e+06 9.194087e+06 1.001217e+07 1.219175e+07 1.072403e+07 1.000407e+07 7.958615e+06 1.108237e+07 8.502030e+06 7.632028e+06 1.189273e+07 7.377584e+06 6.431776e+06 6.487489e+06 5.527922e+06 6.678204e+06 6.912808e+06 8.283359e+06 9.616010e+06 6.912807e+06 6.129081e+06 7.361380e+06 8.090110e+06 1.040599e+07 1.166025e+06 4.332336e+06 4.001352e+06 1.042609e+07 1.026628e+07 1.112749e+07 1.247397e+07 1.335563e+07 8.641506e+06 7.716213e+06 1.060227e+07 7.425374e+06 5.977562e+06 7.659367e+06 9.302465e+06 1.248175e+07 5.073660e+06 6.981704e+06 8.813402e+06 9.835243e+06 8.466054e+06 6.794584e+06 6.504330e+06 7.564753e+06 5.215808e+06 6.840008e+06 2.008571e+07 8.239888e+06 8.507455e+06 1.600401e+07 1.263039e+07 5.433792e+06 7.757617e+06 6.126468e+06 6.244104e+06 6.288510e+06 8.714341e+06 9.093888e+06 9.634215e+06 8.060832e+06 1.126841e+07 5.753067e+06 8.345127e+06 6.787072e+06 1.007212e+07 9.398725e+06 6.064554e+06 1.621884e+07 1.051430e+07 6.510725e+06 6.393624e+06 1.324218e+07 7.549973e+06 7.228778e+06 8.706557e+06 7.915435e+06 1.410264e+07 1.226127e+07 8.520601e+06 1.139403e+07 1.078163e+07 1.453976e+07 9.225151e+06 9.362518e+06 5.905296e+06 8.351950e+06 8.461600e+06 7.291863e+06 7.852668e+06 1.280687e+07 C7 H10 N8 O3 P2_8.798 2.600057e+07 1.726911e+07 1.723555e+07 1.704079e+07 1.099473e+05 1.169366e+07 1.739985e+07 1.818927e+07 100779.53 1.465709e+07 1.758868e+07 1.801146e+07 90762.61 1.478977e+07 1.497025e+07 1.582676e+07 1.571892e+05 1.668527e+07 1.601401e+07 1.609033e+07 5.072550e+04 1.604259e+07 1.670913e+07 1.956886e+07 13969.382 1.373746e+07 1.685937e+07 1.589028e+07 1.683310e+04 1.483599e+07 1.690588e+07 1.849847e+07 95568.98 1.388748e+07 1.610986e+07 1.943872e+07 6.089102e+04 1.476049e+07 1.436168e+07 1.794675e+07 9.427732e+04 1.459930e+07 1.802263e+07 1.839246e+07 9.421007e+04 1.317978e+07 1.469100e+07 1.798487e+07 1.581689e+07 1.793009e+07 1.514849e+07 1.743374e+07 1.598508e+07 3.528812e+07 1.994534e+07 2.142697e+07 2.911633e+07 2.602774e+07 3.538909e+07 2.395613e+07 1.818519e+07 1.608301e+07 1.633592e+07 1.813417e+07 1.913735e+07 1.758802e+07 1.670191e+07 1.690392e+07 1.684131e+07 1.779835e+07 2.402371e+07 1.778015e+07 2.294139e+07 1.630826e+07 2.084863e+07 1.948606e+07 1.428865e+07 1.395675e+07 3.649228e+07 3.381324e+07 2.343790e+07 1.521308e+07 1.778513e+07 2.303483e+07 1.672812e+07 2.198935e+07 1.440318e+07 1.712998e+07 1.799547e+07 1.112700e+07 1.552628e+07 1.809244e+07 2.375441e+07 1.417255e+07 1.470769e+07 1.940882e+07 2.301885e+07 1.286431e+07 1.499761e+07 1.636524e+07 1.829325e+07 1.908268e+07 1.219690e+07 1.168745e+07 1.444922e+07 1.098545e+07 1.708560e+07 2.089051e+07 2.268730e+07 1.724954e+07 1.136247e+07 1.915063e+07 2.259647e+07 1.577257e+07 1.991679e+07 1.181718e+07 1.947666e+07 1.859142e+07 3.649552e+07 1.738748e+07 1.344272e+07 1.644346e+07 9.457416e+06 1.585600e+07 1.430978e+07 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2.029346e+07 1.466586e+07 1.121441e+07 1.281287e+07 1.483397e+07 2.416095e+07 1.070940e+07 1.355690e+07 1.619710e+07 1.624607e+07 1.541516e+07 1.136595e+07 1.470299e+07 1.537861e+07 1.117768e+07 1.369464e+07 3.308199e+07 1.452160e+07 1.470119e+07 2.806966e+07 2.111867e+07 1.000583e+07 1.452869e+07 1.102621e+07 1.500013e+07 1.449272e+07 1.648224e+07 1.730978e+07 1.732016e+07 1.613250e+07 2.128638e+07 1.393179e+07 1.497022e+07 1.493971e+07 2.078699e+07 1.804204e+07 1.302458e+07 2.675927e+07 2.035254e+07 1.557396e+07 1.161226e+07 2.308523e+07 1.396909e+07 1.657265e+07 1.601358e+07 1.663317e+07 2.604798e+07 2.039047e+07 1.516841e+07 2.134018e+07 1.931385e+07 2.580893e+07 1.900232e+07 1.609419e+07 1.304523e+07 1.878253e+07 1.601945e+07 1.469265e+07 1.520542e+07 2.358264e+07 178.53099_8.803 1.749981e+07 9.594267e+06 9.195347e+06 9.003033e+06 8.412513e+04 6.547976e+06 1.005360e+07 1.028484e+07 78832.48 7.793641e+06 9.260016e+06 1.008637e+07 73071.05 7.766322e+06 8.455822e+06 9.009587e+06 1.292568e+05 8.744842e+06 8.988632e+06 8.416263e+06 4.060141e+04 9.028541e+06 8.860881e+06 1.036858e+07 11677.932 8.219901e+06 9.233215e+06 8.552677e+06 1.411586e+04 8.576606e+06 9.047081e+06 9.651033e+06 80439.68 8.131798e+06 8.731914e+06 8.962201e+06 4.857782e+04 8.230887e+06 1.011623e+07 9.584125e+06 7.226724e+04 7.842518e+06 1.004003e+07 9.261831e+06 7.451861e+04 6.988254e+06 8.636689e+06 9.732008e+06 7.767927e+06 9.855038e+06 7.908017e+06 9.473438e+06 8.598197e+06 2.103054e+07 1.067106e+07 1.228824e+07 1.624637e+07 1.461453e+07 1.973326e+07 1.337380e+07 9.980186e+06 9.529335e+06 9.178325e+06 1.066649e+07 1.014516e+07 9.975416e+06 9.263743e+06 9.439171e+06 9.185397e+06 1.081845e+07 1.452244e+07 1.019913e+07 1.274252e+07 8.721771e+06 1.166167e+07 1.190332e+07 8.002094e+06 7.667681e+06 2.156239e+07 1.791231e+07 1.074167e+07 8.349729e+06 1.014085e+07 1.349523e+07 9.525279e+06 1.145802e+07 7.501255e+06 9.698463e+06 9.829297e+06 6.393018e+06 8.828416e+06 9.359336e+06 1.380006e+07 7.944057e+06 8.312762e+06 9.917445e+06 1.329927e+07 6.903650e+06 8.728963e+06 8.506336e+06 1.075085e+07 1.092065e+07 6.654519e+06 7.846516e+06 7.636513e+06 5.944367e+06 1.008269e+07 1.306812e+07 1.215203e+07 9.534347e+06 5.862264e+06 1.015441e+07 1.326900e+07 8.090284e+06 1.239306e+07 6.220011e+06 1.199913e+07 9.657459e+06 2.284312e+07 9.521139e+06 7.327259e+06 8.589844e+06 5.595413e+06 8.670054e+06 7.345696e+06 7.383652e+06 6.888443e+06 7.224303e+06 1.600648e+07 8.659425e+06 1.149371e+07 1.230552e+07 9.159946e+06 9.548650e+06 6.124253e+06 1.007031e+07 1.157131e+07 7.744405e+06 6.127816e+06 1.362644e+07 5.458767e+06 9.687991e+06 9.131398e+06 1.260976e+07 9.337416e+06 1.277810e+07 6.707312e+06 8.068644e+06 6.975311e+06 7.283418e+06 8.870686e+06 9.743868e+06 1.044851e+07 1.488031e+07 1.244556e+07 7.190238e+06 1.472148e+07 8.317351e+06 9.199975e+06 1.276479e+07 6.609015e+06 1.684019e+07 5.791782e+06 7.170220e+06 1.257585e+07 8.914469e+06 8.322294e+06 8.355288e+06 9.097934e+06 9.799867e+06 9.850224e+06 1.185545e+07 1.150882e+07 1.063696e+07 7.709011e+06 1.162150e+07 8.712702e+06 7.485089e+06 1.216410e+07 7.553368e+06 6.752469e+06 6.529238e+06 5.249150e+06 6.631427e+06 6.304622e+06 8.482173e+06 9.326117e+06 6.701969e+06 5.917462e+06 7.434106e+06 8.321705e+06 1.014648e+07 1.085057e+06 5.340037e+06 4.181680e+06 9.982982e+06 9.629548e+06 1.045204e+07 1.220445e+07 1.324440e+07 8.818324e+06 9.250439e+06 1.113589e+07 7.826918e+06 5.849498e+06 7.372584e+06 9.230561e+06 1.258896e+07 5.391774e+06 7.154792e+06 9.155638e+06 9.626170e+06 8.601886e+06 6.833466e+06 6.852898e+06 7.782134e+06 5.525105e+06 6.821309e+06 1.958671e+07 8.534238e+06 8.715375e+06 1.529398e+07 1.227245e+07 5.233522e+06 7.890227e+06 6.200171e+06 6.821410e+06 7.665948e+06 8.909948e+06 9.479042e+06 9.274975e+06 8.514006e+06 1.323361e+07 6.889641e+06 8.653071e+06 7.559647e+06 1.046238e+07 1.046894e+07 6.686707e+06 1.673664e+07 1.141991e+07 7.721615e+06 6.323735e+06 1.302946e+07 7.828796e+06 8.413813e+06 9.055099e+06 1.011202e+07 1.394092e+07 1.202501e+07 7.699614e+06 1.288615e+07 1.076866e+07 1.423092e+07 9.705471e+06 9.287490e+06 7.540503e+06 9.917671e+06 8.591252e+06 7.722277e+06 8.580068e+06 1.332301e+07 C7 H14 N2 O3_8.855 8.308482e+06 4.921567e+06 4.953898e+06 4.651123e+06 1.356174e+05 3.502890e+06 5.069496e+06 5.216876e+06 134022.19 3.616484e+06 4.921626e+06 4.500254e+06 115168.94 4.528170e+06 4.713450e+06 4.675461e+06 1.870214e+05 4.642088e+06 4.477598e+06 4.594901e+06 5.358267e+04 3.881301e+06 4.781330e+06 6.197057e+06 14468.201 3.802120e+06 4.691210e+06 4.113025e+06 1.826586e+04 4.417728e+06 4.294709e+06 5.159585e+06 104550.97 4.882414e+06 4.730923e+06 4.047545e+06 6.496389e+04 4.337734e+06 4.550683e+06 4.513647e+06 1.104442e+05 4.397430e+06 5.245178e+06 5.083702e+06 1.094942e+05 4.205955e+06 4.731620e+06 4.261153e+06 7.871141e+06 1.098758e+07 7.910735e+06 2.297084e+06 3.384887e+06 5.390165e+06 5.380653e+06 5.724675e+06 9.170111e+06 1.374090e+07 1.043333e+07 5.468623e+06 8.011520e+06 9.064252e+06 5.081411e+06 1.067996e+07 3.903077e+06 9.281162e+05 2.994491e+06 2.327548e+06 2.784331e+06 2.233089e+06 6.239331e+06 5.687053e+06 5.638561e+06 2.664884e+06 2.024823e+06 5.881497e+06 7.670062e+06 4.195602e+06 1.146565e+07 3.251712e+06 5.672603e+06 1.255986e+07 1.680357e+06 3.501445e+06 2.145340e+06 2.897796e+06 4.714565e+06 1.251669e+07 3.972236e+06 3.424269e+06 3.698864e+06 6.420576e+06 4.033888e+06 2.642411e+06 8.750211e+06 4.402594e+06 2.838389e+06 1.157925e+06 3.024848e+06 1.795965e+06 1.993013e+06 6.165874e+06 1.802412e+06 1.119564e+07 1.260922e+06 2.055873e+06 1.940009e+06 3.088987e+06 3.746604e+06 5.678634e+06 1.311857e+06 2.438888e+06 3.239964e+06 2.293010e+06 3.004676e+06 2.577199e+06 2.581303e+06 9.479508e+06 5.176612e+06 3.718737e+06 1.684831e+06 8.449843e+06 1.506344e+06 4.146989e+06 2.775364e+06 3.532874e+06 5.255798e+06 4.750507e+06 1.236632e+07 3.002341e+06 2.818612e+06 2.446077e+06 4.219234e+06 5.703229e+06 1.732328e+06 5.776390e+06 8.425150e+06 6.748878e+06 2.480437e+06 4.680905e+06 4.746645e+06 6.570002e+06 8.259761e+06 1.297492e+07 1.237441e+07 1.887685e+06 4.144471e+06 4.884744e+06 5.878276e+06 6.550498e+06 2.844280e+06 4.067492e+06 3.291611e+06 1.051138e+07 3.512724e+06 1.961110e+06 6.178745e+06 2.453540e+06 2.286539e+06 6.308679e+06 2.013020e+06 1.145212e+07 2.220528e+06 4.489081e+06 6.086851e+06 2.262353e+06 3.975310e+06 7.941526e+06 2.190639e+06 3.251474e+06 1.475550e+07 2.168419e+06 1.295004e+07 5.868675e+06 5.429055e+06 2.958708e+06 4.539087e+06 3.617978e+06 3.980157e+06 4.703854e+06 5.503086e+06 1.418785e+06 5.486853e+06 4.315572e+06 8.883665e+05 6.284619e+06 2.272137e+06 2.019853e+06 4.902688e+06 2.337622e+06 1.060397e+07 5.096943e+06 1.620852e+07 1.793007e+06 1.987577e+06 1.427681e+07 8.419626e+06 4.338706e+06 3.040310e+06 4.034533e+06 4.719557e+06 2.135697e+06 7.017792e+06 7.446736e+06 3.774427e+06 3.371591e+06 6.406836e+06 6.056011e+06 5.577433e+06 3.631316e+06 7.953094e+06 4.749327e+06 4.148935e+06 2.565137e+06 1.794839e+06 2.990938e+06 1.668864e+06 3.118503e+06 1.370597e+07 6.036463e+06 1.917233e+06 4.501459e+06 5.739412e+06 3.356959e+06 2.402734e+06 2.251696e+06 2.600023e+06 3.240013e+06 2.923275e+06 1.346681e+06 8.813104e+06 1.292471e+06 5.880053e+06 4.030854e+06 4.069105e+06 8.405314e+06 3.879889e+06 1.170620e+07 2.397041e+06 5.687900e+06 6.398151e+06 1.959208e+06 1.196603e+07 6.620284e+06 2.859805e+06 8.559238e+06 7.482591e+06 3.065764e+06 7.297059e+06 1.678099e+06 5.699077e+06 6.556263e+06 2.937043e+06 1.048657e+07 8.704792e+06 5.889494e+06 2.642273e+06 4.009242e+06 3.086423e+06 5.306383e+06 4.244997e+06 5.986670e+06 C4 H13 N10 O P_8.896 1.799744e+06 1.406396e+06 2.091655e+06 1.395353e+06 1.729626e+05 9.849688e+05 1.684357e+06 1.622957e+06 138101.00 1.139471e+06 1.857013e+06 1.795496e+06 109124.67 1.078310e+06 1.499140e+06 1.701453e+06 1.960130e+05 1.467390e+06 1.261052e+06 1.612506e+06 5.327839e+04 1.238658e+06 1.990463e+06 1.785977e+06 16324.812 1.255730e+06 1.296546e+06 1.403034e+06 1.783845e+04 1.315569e+06 1.605977e+06 1.700585e+06 95611.61 1.515466e+06 1.565537e+06 1.404535e+06 5.548990e+04 1.420634e+06 1.625319e+06 1.673902e+06 9.768778e+04 1.498193e+06 1.472245e+06 1.824888e+06 9.996762e+04 9.006315e+05 1.256237e+06 1.874565e+06 9.896440e+05 1.810573e+06 1.104609e+06 2.503077e+06 2.313325e+06 1.133291e+06 3.766022e+06 2.746197e+06 1.248373e+06 2.405477e+06 2.818263e+06 9.394096e+05 2.166586e+06 1.861011e+06 1.150825e+06 2.021771e+06 1.033916e+06 1.007578e+06 3.409596e+06 1.248750e+06 1.696788e+06 1.981161e+06 2.017925e+06 1.456470e+06 7.909042e+05 1.792135e+06 4.153245e+06 1.108480e+06 1.100654e+06 2.835093e+06 3.519128e+06 2.039226e+06 1.303552e+06 1.115923e+06 1.311248e+06 1.268673e+06 2.010814e+06 2.035479e+06 8.697577e+05 1.868931e+06 1.124869e+06 2.786044e+06 1.490345e+06 1.410349e+06 7.621489e+05 2.651640e+06 2.784256e+06 1.520235e+06 1.956059e+06 3.076377e+06 6.698661e+05 1.629566e+06 1.215403e+06 1.435006e+06 2.078920e+06 1.711719e+06 2.028415e+06 2.157314e+06 9.529621e+05 2.207141e+06 1.608751e+06 1.295755e+06 1.008927e+06 1.434624e+06 1.198881e+06 1.293289e+06 1.615148e+06 2.021653e+06 1.358636e+06 1.582386e+06 2.269918e+06 1.622148e+06 1.318001e+06 1.742629e+06 6.986337e+05 7.777261e+05 1.668310e+06 1.355139e+06 1.722953e+06 8.811059e+05 1.702040e+06 1.065630e+06 2.960028e+06 3.140971e+06 1.069079e+06 1.178948e+06 2.537431e+06 8.357017e+05 1.224122e+06 2.237030e+06 1.935612e+06 2.449536e+06 1.286237e+06 8.416425e+05 2.249516e+06 2.508246e+06 2.293677e+06 4.405295e+05 1.063260e+06 1.209263e+06 1.216528e+06 1.090007e+06 1.502839e+06 1.179533e+06 2.201107e+06 1.750322e+06 1.472555e+06 1.400107e+06 2.207556e+06 1.590519e+06 1.249828e+06 1.768903e+06 2.272349e+06 1.802664e+06 1.418617e+06 2.204437e+06 2.416098e+06 2.486889e+06 2.027933e+06 1.443397e+06 3.173501e+06 1.709986e+06 1.392783e+06 1.371343e+06 2.055683e+06 1.621063e+06 1.811294e+06 7.736768e+05 2.590691e+06 2.871797e+06 1.965220e+06 8.280431e+05 4.811874e+05 1.539549e+06 3.683661e+06 1.608846e+06 1.107255e+06 1.704331e+06 2.244568e+06 2.621940e+06 1.879241e+06 2.323665e+06 2.008932e+06 1.125435e+06 4.173447e+06 1.849695e+06 6.253738e+05 1.406073e+06 1.347892e+06 1.335459e+06 2.034036e+06 1.284213e+06 3.874735e+06 1.512035e+06 1.769349e+06 2.494147e+06 1.010354e+06 1.058604e+06 2.102313e+06 6.648319e+05 1.651797e+06 7.068978e+05 2.709179e+06 1.894035e+06 1.690292e+06 1.517820e+06 9.766325e+05 2.586811e+06 1.554370e+06 1.372749e+06 1.074366e+06 1.600593e+06 1.486102e+06 2.360687e+06 2.135052e+06 1.326315e+06 2.251154e+06 1.779426e+06 2.345992e+06 2.361015e+06 2.345082e+06 3.220751e+06 1.341101e+06 1.245060e+06 2.310769e+06 2.288535e+06 2.790182e+06 2.647513e+06 3.460732e+06 1.791954e+06 1.252206e+06 1.735917e+06 1.635470e+06 1.082672e+06 9.534548e+05 2.124644e+06 2.295519e+06 2.153678e+06 2.279639e+06 7.995820e+05 2.447480e+06 1.535128e+06 2.091840e+06 2.130507e+06 1.222747e+06 1.564141e+06 1.433909e+06 1.241830e+06 4.811761e+06 2.716335e+06 1.853232e+06 5.034256e+05 2.479875e+06 1.779104e+06 THREONINE 4.830191e+08 2.543570e+08 2.310493e+08 2.534607e+08 4.395688e+05 1.730862e+08 2.885853e+08 2.508991e+08 488080.15 2.097563e+08 2.459119e+08 2.893583e+08 337016.16 2.282709e+08 2.386997e+08 2.257509e+08 5.270838e+05 2.139491e+08 2.280259e+08 2.530674e+08 1.369087e+05 1.971981e+08 2.423631e+08 3.552859e+08 141585.569 2.154616e+08 2.159130e+08 2.301784e+08 1.831524e+05 2.116181e+08 2.157917e+08 2.925009e+08 361848.63 2.261818e+08 2.328673e+08 2.262757e+08 1.557613e+05 2.158136e+08 2.760640e+08 2.663557e+08 3.085463e+05 2.022906e+08 2.589553e+08 2.747538e+08 2.529811e+05 2.021851e+08 2.020113e+08 2.689306e+08 1.145938e+08 2.525721e+08 2.435501e+08 2.846723e+08 3.708604e+08 3.260854e+08 4.652171e+08 2.796485e+08 2.017298e+08 3.445533e+08 4.206335e+08 1.772165e+08 3.568769e+08 2.953736e+08 3.036709e+08 3.786350e+08 1.072539e+08 1.427820e+08 4.017047e+08 2.823964e+08 3.629521e+08 2.905817e+08 1.328916e+08 2.116067e+08 1.231365e+08 1.270159e+08 4.435771e+08 1.723532e+08 2.491859e+08 3.184414e+08 5.769835e+08 2.828058e+08 1.305032e+08 1.591349e+08 2.869676e+08 1.899884e+08 3.636199e+08 3.656286e+08 2.526167e+08 3.871231e+08 2.675112e+08 4.285274e+08 2.341532e+08 1.247378e+08 1.521495e+08 3.715373e+08 2.704419e+08 2.186309e+08 2.435245e+08 2.479894e+08 3.679674e+07 3.072621e+08 3.679934e+08 1.893203e+08 2.380435e+08 1.399313e+08 4.113670e+08 4.251953e+08 2.637336e+08 3.222515e+08 2.381068e+08 3.094375e+08 1.553223e+08 2.225521e+08 2.420382e+08 1.294794e+08 7.271279e+07 3.292637e+08 2.486883e+08 1.422539e+08 3.844193e+08 3.275431e+08 1.751237e+08 2.065565e+08 1.249387e+08 2.523921e+08 2.261837e+08 1.810466e+08 2.978663e+08 1.652460e+08 2.442069e+08 1.895078e+08 2.336884e+08 4.050254e+08 1.791147e+08 2.986608e+08 2.751980e+08 1.103685e+08 1.758391e+08 1.798999e+08 1.867780e+08 3.352198e+08 1.923109e+08 1.260928e+08 2.023672e+08 3.001272e+08 2.086984e+08 1.182686e+08 6.039983e+07 1.770040e+08 1.728296e+08 1.818938e+08 2.056341e+08 2.002774e+08 2.823181e+08 2.595336e+08 2.890064e+08 2.919659e+08 3.367613e+08 3.627592e+08 1.550191e+08 2.402754e+08 3.714380e+08 3.593235e+08 3.123845e+08 3.184337e+08 3.415921e+08 2.783562e+08 3.248746e+08 2.569026e+08 2.029404e+08 3.300449e+08 2.975306e+08 3.321745e+08 4.457432e+08 1.887139e+08 2.370852e+08 9.567147e+07 5.639787e+08 4.020370e+08 2.454969e+08 5.063714e+07 6.300824e+06 3.221030e+08 3.705618e+08 9.998409e+07 9.659052e+07 2.304113e+08 4.015009e+08 3.636834e+08 3.464346e+08 2.808913e+08 3.089611e+08 9.150798e+07 6.844070e+07 2.467944e+08 1.379815e+07 2.344104e+08 3.293486e+08 1.450221e+08 3.017734e+08 3.164786e+08 5.001887e+08 1.598385e+08 3.165223e+08 3.890622e+08 1.276959e+08 6.343234e+07 1.274092e+08 1.758546e+08 2.551129e+08 1.026676e+08 2.821841e+08 2.755052e+08 2.732123e+08 2.621261e+08 1.251060e+08 3.327638e+08 2.568398e+08 1.716609e+08 2.020705e+08 2.394477e+08 2.617591e+08 2.230272e+08 3.584701e+08 1.930623e+08 2.491016e+08 2.099652e+08 4.015221e+08 2.201260e+08 2.617852e+08 5.698524e+08 1.433292e+08 1.968800e+08 3.419093e+08 2.315297e+08 4.136334e+08 2.211471e+08 4.881946e+08 3.525937e+08 1.833788e+08 1.751754e+08 1.852428e+08 1.431288e+08 5.936633e+07 4.150659e+08 1.866027e+08 1.371420e+08 3.645121e+08 1.826632e+08 3.580615e+08 2.736561e+08 1.329677e+08 4.208918e+08 1.734100e+08 2.542386e+08 4.203591e+08 1.345008e+08 4.947637e+08 3.906462e+08 5.142463e+08 2.633817e+07 4.052282e+08 4.726503e+08 C3 H7 N O_8.903 2.379439e+07 1.154299e+07 1.045231e+07 1.199799e+07 2.078600e+06 7.122070e+06 1.251618e+07 1.359669e+07 1459854.82 8.958132e+06 1.013310e+07 1.463714e+07 1301874.82 8.852989e+06 9.888634e+06 1.105149e+07 2.424290e+05 9.699273e+06 1.008177e+07 1.168247e+07 1.188172e+06 8.289877e+06 1.276724e+07 1.622804e+07 1592957.335 7.717480e+06 1.073442e+07 9.909487e+06 1.535144e+06 8.807706e+06 1.070886e+07 1.364508e+07 1292193.71 1.039957e+07 1.069440e+07 1.066406e+07 1.283020e+06 9.193009e+06 1.031521e+07 1.348856e+07 9.974495e+05 9.255979e+06 1.286918e+07 1.168849e+07 8.416029e+05 7.972448e+06 1.032690e+07 1.181639e+07 4.866527e+06 1.232366e+07 9.655481e+06 1.130391e+07 1.666829e+07 1.331067e+07 2.428778e+07 1.227447e+07 8.442262e+06 1.541298e+07 2.041875e+07 7.495199e+06 1.475376e+07 1.253819e+07 1.309244e+07 1.862972e+07 4.440675e+06 6.081419e+06 1.868267e+07 1.383776e+07 1.651267e+07 1.457990e+07 6.735346e+06 1.079607e+07 5.016042e+06 5.263312e+06 2.123826e+07 5.513848e+06 1.173638e+07 1.632993e+07 2.763190e+07 1.295741e+07 5.261212e+06 8.136327e+06 1.291388e+07 9.147795e+06 1.089241e+07 1.578866e+07 1.165896e+07 1.929294e+07 1.258731e+07 2.351409e+07 1.103959e+07 9.098712e+06 6.598263e+06 1.867165e+07 1.197314e+07 9.505830e+06 1.063365e+07 1.186264e+07 1.275185e+06 1.493440e+07 1.617855e+07 6.141860e+06 1.165397e+07 6.712498e+06 1.906986e+07 1.955749e+07 1.110239e+07 1.587447e+07 1.248790e+07 1.295926e+07 7.604023e+06 1.164090e+07 1.230513e+07 5.852816e+06 3.138971e+06 1.580016e+07 1.246001e+07 5.665560e+06 1.865862e+07 1.502140e+07 9.300599e+06 1.066998e+07 5.708730e+06 1.108330e+07 9.695445e+06 8.695025e+06 1.376460e+07 7.162446e+06 1.023059e+07 8.071707e+06 1.176828e+07 2.029399e+07 8.423391e+06 1.387320e+07 1.328272e+07 4.461072e+06 7.006948e+06 7.592664e+06 9.119712e+06 1.610385e+07 8.908386e+06 7.151205e+06 9.757696e+06 1.507723e+07 9.160478e+06 4.649410e+06 2.424029e+06 7.156312e+06 8.573291e+06 8.892708e+06 8.738813e+06 9.094710e+06 1.431478e+07 1.011047e+07 1.100302e+07 1.340416e+07 1.577253e+07 1.861777e+07 7.165738e+06 1.117046e+07 1.671853e+07 1.589006e+07 1.342722e+07 1.395143e+07 1.622355e+07 1.313252e+07 1.539068e+07 1.149669e+07 8.333551e+06 1.594265e+07 1.510652e+07 1.523944e+07 2.043995e+07 8.747516e+06 1.015848e+07 3.573090e+06 2.769006e+07 1.719601e+07 1.147219e+07 2.293872e+06 9.050761e+05 1.332196e+07 2.121102e+07 4.327674e+06 3.245760e+06 1.048346e+07 1.720685e+07 1.561478e+07 1.681225e+07 1.285379e+07 1.381681e+07 3.875404e+06 2.338003e+06 9.679437e+06 1.544872e+06 9.735469e+06 1.535852e+07 6.699629e+06 1.382350e+07 1.442968e+07 2.452987e+07 7.236320e+06 1.713307e+07 1.905535e+07 5.749050e+06 2.832079e+06 6.276137e+06 9.160449e+06 1.260275e+07 4.721663e+06 1.487494e+07 1.267108e+07 1.357838e+07 1.001239e+07 3.986811e+06 1.350494e+07 1.043029e+07 7.770625e+06 4.760211e+06 1.349834e+07 1.099762e+07 1.253494e+07 1.700813e+07 8.728991e+06 1.013485e+07 9.666327e+06 2.016171e+07 1.058221e+07 9.936729e+06 2.286665e+07 4.455694e+06 9.003633e+06 1.568695e+07 9.636288e+06 1.820022e+07 1.215418e+07 2.275575e+07 1.769236e+07 1.089738e+07 7.914107e+06 9.596039e+06 5.505651e+06 2.004097e+06 1.886626e+07 9.706877e+06 5.519739e+06 1.689094e+07 8.273945e+06 1.739920e+07 1.189340e+07 6.627595e+06 1.598450e+07 8.015004e+06 1.313673e+07 1.495446e+07 6.612984e+06 2.462523e+07 1.646672e+07 2.633013e+07 2.358566e+06 1.847051e+07 2.099088e+07 C3 H5 N6 O16 P3_8.98 3.109707e+06 4.972341e+06 4.538456e+06 4.920715e+06 1.303682e+05 2.222251e+06 5.228994e+06 5.780928e+06 120579.47 3.160658e+06 4.782050e+06 4.096075e+06 157327.30 4.308735e+06 4.120719e+06 4.807854e+06 1.833580e+05 4.327499e+06 4.361274e+06 4.458166e+06 5.786191e+04 3.505205e+06 4.859952e+06 5.949544e+06 17275.877 3.306366e+06 4.636314e+06 4.119860e+06 2.013444e+04 3.947239e+06 4.425154e+06 5.281041e+06 119460.62 4.037378e+06 4.323162e+06 4.117878e+06 6.847873e+04 4.270551e+06 4.206542e+06 4.302906e+06 9.698737e+04 3.593079e+06 6.704215e+06 4.301910e+06 9.675121e+04 3.555567e+06 3.953564e+06 4.652686e+06 4.587325e+06 3.112196e+06 3.178838e+06 7.188664e+06 5.126994e+06 5.044195e+06 4.402407e+06 5.664863e+06 4.281247e+06 6.126370e+06 6.613082e+06 6.587119e+06 7.927159e+06 4.501871e+06 4.825602e+06 5.199823e+06 4.775487e+06 4.368728e+06 4.299668e+06 3.193209e+06 2.744826e+06 3.870487e+06 6.413252e+06 4.416805e+06 4.557724e+06 6.184699e+06 3.740830e+06 6.804955e+06 5.059572e+06 7.182776e+06 3.843305e+06 5.649610e+06 3.232012e+06 5.107630e+06 3.555403e+06 4.805915e+06 2.943506e+06 4.870033e+06 1.644406e+06 1.684000e+06 2.914565e+06 2.899203e+06 5.748932e+06 4.205141e+06 2.140395e+06 3.340663e+06 4.173759e+06 5.938206e+06 5.200927e+06 1.519930e+06 2.712379e+06 4.434718e+06 2.867129e+06 3.655000e+06 2.350923e+06 5.472097e+06 2.917172e+06 3.153878e+06 3.887755e+06 4.060724e+06 1.874121e+06 4.497669e+06 2.111531e+06 3.198420e+06 2.828526e+06 4.419790e+06 3.712544e+06 2.096947e+06 5.615072e+06 3.118684e+06 2.208077e+06 2.665122e+06 1.884859e+06 2.365475e+06 1.358739e+06 1.246870e+06 2.210282e+06 3.123671e+06 2.369194e+06 1.795126e+06 2.249460e+06 3.359374e+06 2.421083e+06 3.343731e+06 1.816339e+06 1.766153e+06 2.211833e+06 2.400644e+06 3.733721e+06 1.584261e+06 2.440685e+06 2.118030e+06 2.262302e+06 3.098232e+06 2.301159e+06 2.444065e+06 3.150494e+06 2.327654e+06 2.325080e+06 3.740308e+06 1.650706e+06 2.474128e+06 3.026413e+06 2.484314e+06 2.995646e+06 4.935643e+06 5.400710e+06 3.726080e+06 4.184316e+06 3.797124e+06 4.449999e+06 3.936020e+06 5.642211e+06 7.096051e+06 3.969899e+06 3.619813e+06 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3.512525e+06 1.766018e+06 5.772611e+06 8.263535e+06 1.123275e+07 2.016972e+06 5.389843e+06 4.922183e+06 3.043248e+06 2.595623e+06 2.508881e+06 5.997847e+06 3.000300e+06 1.514285e+06 1.563754e+06 2.668085e+06 1.498247e+07 3.593178e+06 2.135443e+06 4.085437e+06 1.036785e+07 7.877398e+06 3.171215e+06 4.702193e+06 5.660950e+06 1.244412e+07 1.823500e+07 1.632729e+06 6.386619e+06 3.156060e+07 2.512045e+06 2.814261e+06 5.566913e+06 2.946819e+06 4.713425e+06 1.044964e+07 2.145200e+06 3.074344e+06 2.089427e+06 1.656674e+07 4.374445e+06 2.074560e+07 6.482431e+06 3.224031e+06 7.798301e+06 9.201707e+06 1.638645e+06 3.806629e+06 1.401146e+06 1.567728e+06 4.679605e+06 1.100131e+07 2.802050e+06 6.611927e+06 3.954568e+06 1.000962e+07 2.661646e+07 7.398138e+06 4.041822e+06 3.087401e+06 5.301910e+06 7.278347e+06 1.258628e+07 9.050441e+06 6.090762e+06 1.263267e+07 2.008736e+07 4.387252e+06 4.755704e+06 1.176662e+06 1.296671e+06 2.778808e+06 3.405653e+06 Tetrahydro-5-oxo-2- furancarboxyli_9.002 8.296132e+08 1.213107e+09 1.064840e+09 1.067261e+09 5.842626e+05 1.446688e+08 1.112409e+09 9.796993e+08 904292.20 8.839077e+08 1.022026e+09 1.031708e+09 1426542.92 8.642921e+08 8.606983e+08 9.313788e+08 1.442049e+06 8.944735e+08 8.986147e+08 9.365988e+08 1.206287e+05 8.028660e+08 1.111523e+09 1.144786e+09 56837.325 7.934638e+08 8.627373e+08 8.890402e+08 4.560372e+05 8.703924e+08 9.422475e+08 1.010413e+09 300445.56 9.400305e+08 9.034693e+08 8.872204e+08 3.883888e+05 9.357742e+08 9.312685e+08 9.849487e+08 4.749590e+05 8.388925e+08 9.544397e+08 1.108603e+09 4.565486e+05 8.655266e+08 7.966399e+08 9.854194e+08 9.819647e+08 3.981326e+08 8.331903e+08 2.189175e+09 1.332643e+09 1.036276e+09 9.955940e+08 1.545601e+09 6.781104e+08 1.106083e+09 9.263080e+08 2.525928e+09 8.880024e+08 7.736015e+08 6.750837e+08 8.114625e+08 1.799602e+09 1.231421e+09 9.739031e+08 4.843450e+08 4.957308e+08 7.157625e+08 2.818367e+09 6.771811e+08 8.561889e+08 1.693519e+09 6.880787e+08 2.460206e+09 1.045821e+09 1.908949e+09 7.834452e+08 1.604771e+09 5.554940e+08 1.614942e+09 5.355652e+08 1.392915e+09 5.896199e+08 1.432486e+09 2.551788e+08 3.269476e+08 4.638275e+08 4.475075e+08 1.033060e+09 2.388155e+09 3.314913e+08 6.883002e+08 8.881709e+08 2.241806e+09 2.154928e+09 3.554400e+08 2.091239e+09 8.106175e+08 5.329159e+08 1.217389e+09 3.916848e+08 1.460431e+09 4.114057e+08 5.101007e+08 7.302871e+08 6.005480e+08 3.614013e+08 1.046425e+09 3.048843e+08 5.823665e+08 5.314553e+08 1.774735e+09 2.958903e+09 3.790124e+08 8.198380e+08 8.858823e+08 3.418738e+08 4.386593e+08 3.231665e+08 3.303894e+08 2.146834e+08 1.779759e+08 3.768688e+08 5.221116e+08 4.057213e+08 2.681177e+08 4.269149e+08 5.645115e+08 3.983000e+08 7.746917e+08 2.853384e+08 2.685994e+08 3.022070e+08 3.552010e+08 5.944901e+08 2.732945e+08 3.805487e+08 3.497568e+08 3.845269e+08 4.459695e+08 4.208479e+08 3.015040e+08 5.930685e+08 3.421402e+08 5.577262e+08 4.405686e+08 2.677390e+08 2.788197e+08 4.341502e+08 3.270451e+08 5.559538e+08 1.128177e+09 1.206304e+09 6.627008e+08 7.248944e+08 6.256534e+08 6.685156e+08 8.543433e+08 1.000878e+09 1.541163e+09 8.214384e+08 8.730935e+08 7.279313e+08 9.136280e+08 9.331064e+08 9.775329e+08 1.281519e+09 1.046789e+09 1.177268e+09 8.906405e+08 4.022052e+08 7.735510e+08 5.686813e+08 1.452505e+09 1.609484e+09 1.764615e+09 5.789808e+08 1.889486e+09 1.713256e+09 4.292482e+08 8.136032e+08 1.394976e+09 2.123877e+09 1.510203e+09 7.202705e+08 7.229190e+08 5.469262e+08 6.049908e+08 3.912971e+08 1.223921e+09 1.397762e+09 1.814322e+09 4.090419e+08 1.250157e+09 7.327235e+08 6.604886e+08 5.213165e+08 5.627478e+08 1.234216e+09 6.524774e+08 4.791385e+08 5.788872e+08 5.985424e+08 2.829418e+09 7.482924e+08 5.665653e+08 6.430965e+08 1.706264e+09 1.403666e+09 6.196627e+08 8.017312e+08 1.098910e+09 1.830104e+09 3.306260e+09 3.168381e+08 1.075510e+09 5.215039e+09 4.438214e+08 6.729477e+08 1.036327e+09 6.189210e+08 1.131879e+08 1.808665e+09 5.120931e+08 7.129945e+08 4.640418e+08 3.235646e+09 9.280279e+08 3.297252e+09 1.054848e+09 6.357191e+08 1.558569e+09 1.754790e+09 5.888258e+08 6.695411e+08 4.064592e+08 6.137746e+08 1.107688e+09 1.842237e+09 6.217296e+08 1.231320e+09 1.113962e+09 1.884825e+09 3.330391e+09 1.343363e+09 7.865772e+08 6.532423e+08 1.073629e+09 1.400722e+09 2.290980e+09 1.497553e+09 1.375841e+09 2.761589e+09 3.412549e+09 1.105693e+09 9.057855e+08 2.588160e+08 2.488291e+08 5.189236e+08 8.070957e+08 C11 H12 N2 O9 S_9.002 1.307529e+06 2.628276e+06 2.553284e+06 2.898983e+06 1.203453e+05 1.422803e+06 3.024816e+06 2.598746e+06 93582.28 2.428337e+06 2.541551e+06 2.799644e+06 121907.53 2.379633e+06 2.548049e+06 2.534301e+06 1.418525e+05 2.272480e+06 2.381511e+06 2.643724e+06 4.383104e+04 1.631099e+06 3.036066e+06 3.684795e+06 12190.760 2.017504e+06 2.262088e+06 2.319032e+06 1.417689e+04 2.324858e+06 2.546317e+06 2.842387e+06 87756.80 2.391004e+06 2.492647e+06 2.183747e+06 5.053708e+04 2.446551e+06 2.710121e+06 2.769553e+06 7.895674e+04 2.416542e+06 2.358384e+06 2.680704e+06 8.100276e+04 2.748108e+06 1.896606e+06 2.796402e+06 2.618455e+06 4.277944e+05 1.296116e+06 8.480012e+06 3.320120e+06 1.784109e+06 2.385472e+06 6.707034e+06 1.535696e+06 3.521269e+06 2.304197e+06 6.522830e+06 2.206714e+06 2.794330e+06 1.461025e+06 2.299184e+06 6.200615e+06 2.218355e+06 2.965768e+06 8.636984e+05 1.125570e+06 1.438845e+06 8.624896e+06 1.256440e+06 1.790599e+06 5.950147e+06 1.388036e+06 8.191606e+06 2.549832e+06 7.869996e+06 2.168933e+06 5.568277e+06 1.165800e+06 5.398705e+06 9.845456e+05 3.583631e+06 1.196995e+06 6.180442e+06 1.702549e+05 2.380528e+05 9.448659e+05 8.248005e+05 2.751932e+06 8.138082e+06 1.864629e+05 1.519064e+06 2.288672e+06 1.027697e+07 8.851404e+06 5.550188e+05 7.380570e+06 2.506262e+06 8.471610e+05 3.302332e+06 7.087685e+05 5.386960e+06 8.090557e+05 7.591813e+05 2.610724e+06 1.308753e+06 1.338811e+05 2.807781e+06 2.242528e+05 9.775924e+05 4.991866e+05 7.539051e+06 1.252058e+07 4.268029e+05 1.991896e+06 2.138820e+06 2.371295e+05 5.049494e+05 4.162949e+05 4.068821e+05 1.558348e+05 2.028672e+05 5.403134e+05 8.952945e+05 3.716987e+05 1.156889e+05 8.263806e+05 1.128077e+06 5.821085e+05 1.963182e+06 3.703547e+05 1.334494e+05 4.322955e+05 3.681977e+05 1.476890e+06 1.207534e+05 6.779010e+05 6.704580e+05 5.114584e+05 1.189773e+06 6.100404e+05 3.184778e+05 6.989512e+05 3.331141e+05 1.567216e+06 5.523570e+05 2.290645e+05 2.624349e+05 6.103408e+05 3.427720e+05 1.270655e+06 1.832939e+06 2.530148e+06 1.591392e+06 1.182258e+06 1.318764e+06 1.161197e+06 2.170658e+06 2.981347e+06 4.055982e+06 1.814941e+06 2.739097e+06 1.267061e+06 2.393669e+06 1.604386e+06 2.911935e+06 4.574493e+06 3.547180e+06 3.768466e+06 1.971509e+06 8.513408e+05 1.348924e+06 1.315238e+06 3.684874e+06 5.068388e+06 7.774173e+06 1.102868e+06 6.412575e+06 4.504726e+06 4.073840e+05 2.235772e+06 3.831562e+06 8.058623e+06 4.479790e+06 1.805455e+06 1.828087e+06 9.359508e+05 1.089577e+06 4.913370e+05 3.348454e+06 1.726542e+05 8.803347e+06 4.359729e+05 3.459509e+06 1.900525e+06 9.067834e+05 9.012665e+05 9.155732e+05 3.820710e+06 1.416869e+06 4.122341e+05 1.266552e+06 1.154040e+06 1.091216e+07 1.456821e+06 8.350922e+05 1.186782e+06 4.042215e+06 3.728857e+06 1.241804e+06 2.053527e+06 2.805767e+06 8.080500e+06 1.495608e+07 3.081755e+05 3.027602e+06 2.307209e+07 6.786936e+05 1.331824e+06 2.462460e+06 1.036662e+06 1.191307e+06 5.271554e+06 7.360617e+05 1.691867e+06 9.755094e+05 1.343304e+07 3.011731e+06 1.596688e+07 3.181283e+06 1.629260e+06 5.125757e+06 4.929776e+06 8.849074e+05 7.638915e+05 5.582912e+05 8.566867e+05 2.969754e+06 6.785855e+06 1.186973e+06 2.632340e+06 2.836777e+06 7.633081e+06 1.622412e+07 4.071958e+06 1.324470e+06 1.413007e+06 3.936864e+06 5.997017e+06 9.179002e+06 6.259287e+06 3.271501e+06 8.162528e+06 1.483974e+07 2.515107e+06 2.303198e+06 2.403271e+05 1.754774e+05 9.072764e+05 1.558875e+06 C4 H5 N O_9.002 5.144849e+07 6.309109e+07 5.856149e+07 6.082194e+07 1.900729e+05 3.218579e+07 6.370891e+07 6.157776e+07 247901.30 5.640694e+07 6.120415e+07 5.672774e+07 190798.69 5.353153e+07 5.410568e+07 5.376807e+07 2.221268e+05 5.688279e+07 5.412277e+07 6.044332e+07 2.851394e+05 4.958180e+07 6.128112e+07 7.506985e+07 19332.711 4.359943e+07 5.431598e+07 4.969783e+07 2.074671e+04 5.897474e+07 5.368967e+07 6.824776e+07 120544.41 5.445568e+07 5.033440e+07 5.970923e+07 2.524821e+05 5.407553e+07 5.523122e+07 5.967439e+07 1.114259e+05 5.187915e+07 6.176786e+07 6.172954e+07 2.800516e+05 5.222424e+07 4.977807e+07 6.057926e+07 5.880860e+07 2.348091e+07 5.038199e+07 1.306975e+08 8.024935e+07 5.361814e+07 5.928398e+07 8.630838e+07 4.254095e+07 6.651942e+07 4.924114e+07 1.366569e+08 5.495778e+07 4.351070e+07 4.028458e+07 5.429774e+07 9.506031e+07 7.181871e+07 6.163936e+07 2.902367e+07 3.303369e+07 4.402457e+07 1.640909e+08 4.179663e+07 4.769485e+07 1.082879e+08 3.989378e+07 1.424515e+08 5.994502e+07 1.199623e+08 4.902646e+07 8.077062e+07 3.538939e+07 9.677105e+07 3.254271e+07 7.544220e+07 3.424859e+07 8.606109e+07 1.635903e+07 1.931156e+07 3.094397e+07 2.913471e+07 5.863730e+07 1.434812e+08 1.756446e+07 4.338403e+07 5.204965e+07 1.313754e+08 1.330758e+08 1.765803e+07 1.407680e+08 5.243104e+07 3.232203e+07 6.885028e+07 2.193834e+07 8.023861e+07 2.544689e+07 2.997630e+07 4.218179e+07 3.761276e+07 2.214190e+07 5.869052e+07 1.594487e+07 3.365067e+07 3.248416e+07 1.048844e+08 1.962802e+08 2.463865e+07 5.375393e+07 4.923076e+07 1.645509e+07 2.263022e+07 1.962546e+07 2.215647e+07 1.144264e+07 1.182796e+07 2.241540e+07 2.783978e+07 2.590557e+07 1.206934e+07 2.728096e+07 3.700778e+07 2.440655e+07 4.825643e+07 1.716671e+07 1.735872e+07 1.649204e+07 1.930473e+07 3.813691e+07 1.491555e+07 2.299888e+07 2.469523e+07 2.311720e+07 2.692536e+07 2.135299e+07 1.970544e+07 3.742274e+07 1.868805e+07 3.612759e+07 2.448457e+07 1.242676e+07 1.518969e+07 2.459632e+07 1.852475e+07 3.524651e+07 6.298530e+07 7.406341e+07 4.452646e+07 4.505923e+07 3.506847e+07 3.912208e+07 5.392287e+07 6.084032e+07 8.271750e+07 4.988828e+07 5.310302e+07 4.050926e+07 5.734903e+07 5.190961e+07 5.962205e+07 7.587351e+07 6.115452e+07 6.995757e+07 5.567777e+07 2.609584e+07 4.408060e+07 3.867320e+07 7.454643e+07 9.687207e+07 1.166961e+08 3.336542e+07 1.149114e+08 1.115809e+08 2.462785e+07 5.114576e+07 8.199694e+07 1.269214e+08 8.274993e+07 4.713895e+07 4.361978e+07 3.001785e+07 3.599252e+07 2.365011e+07 6.590252e+07 7.774813e+07 1.162456e+08 2.605364e+07 7.524264e+07 4.593026e+07 4.000779e+07 3.219406e+07 3.336562e+07 7.577815e+07 3.603703e+07 3.040432e+07 3.387393e+07 3.609188e+07 1.684558e+08 4.507100e+07 3.274600e+07 4.102197e+07 9.347612e+07 6.893639e+07 3.588469e+07 4.710843e+07 5.888096e+07 9.831768e+07 1.899187e+08 2.111438e+07 6.243517e+07 3.232328e+08 3.203660e+07 4.236221e+07 7.289791e+07 3.737657e+07 2.372024e+07 1.064750e+08 2.788884e+07 4.261515e+07 3.211195e+07 1.862108e+08 5.626520e+07 2.031177e+08 5.794672e+07 3.950332e+07 9.967933e+07 1.025526e+08 3.047077e+07 4.024650e+07 2.231970e+07 3.158575e+07 6.437832e+07 1.064320e+08 3.823614e+07 7.914906e+07 6.449340e+07 1.161343e+08 2.162575e+08 8.321400e+07 4.267086e+07 4.001151e+07 6.444208e+07 8.853054e+07 1.266607e+08 8.849453e+07 6.773696e+07 1.312159e+08 2.139305e+08 7.022091e+07 5.767896e+07 1.681144e+07 1.336672e+07 3.171686e+07 5.466294e+07 GLUTAMATE 1.190613e+09 1.393374e+09 1.232763e+09 1.253336e+09 9.689332e+05 1.870452e+08 1.289542e+09 1.133929e+09 1349876.85 1.024203e+09 1.168125e+09 1.169657e+09 1647578.92 1.066908e+09 9.708821e+08 1.053883e+09 1.530177e+06 1.119695e+09 1.016380e+09 1.072372e+09 1.988815e+05 9.724130e+08 1.263013e+09 1.331818e+09 78153.638 9.197080e+08 1.006329e+09 1.037988e+09 5.116867e+05 1.006714e+09 1.083862e+09 1.155461e+09 445930.80 1.145361e+09 1.038602e+09 1.035036e+09 4.751273e+05 1.085083e+09 1.074785e+09 1.141767e+09 5.544441e+05 9.815630e+08 1.107931e+09 1.278180e+09 6.089206e+05 1.009401e+09 9.337392e+08 1.144308e+09 1.142189e+09 5.881030e+08 9.622744e+08 2.563240e+09 1.526265e+09 1.177318e+09 1.120992e+09 1.791021e+09 7.878681e+08 1.241463e+09 1.053738e+09 2.819779e+09 1.012605e+09 8.961452e+08 7.611837e+08 9.382656e+08 2.077367e+09 1.425235e+09 1.103034e+09 5.537022e+08 5.603855e+08 8.247350e+08 3.289835e+09 7.743029e+08 9.890905e+08 1.969638e+09 8.001073e+08 2.852710e+09 1.173432e+09 2.156448e+09 8.828405e+08 1.858505e+09 6.306953e+08 1.838430e+09 6.197680e+08 1.560099e+09 6.823069e+08 1.675346e+09 3.907475e+08 4.103738e+08 5.347765e+08 5.186047e+08 1.172991e+09 2.727065e+09 3.777378e+08 7.965900e+08 1.043868e+09 2.554922e+09 2.513400e+09 4.111868e+08 2.390073e+09 9.059292e+08 6.022939e+08 1.413285e+09 5.761678e+08 1.664059e+09 4.794688e+08 6.621603e+08 8.351111e+08 6.889536e+08 4.922117e+08 1.205564e+09 4.357573e+08 6.702830e+08 6.114384e+08 2.076907e+09 3.370420e+09 4.376667e+08 9.417102e+08 1.030061e+09 3.908533e+08 4.879523e+08 3.722425e+08 3.834999e+08 2.957266e+08 2.004379e+08 4.365021e+08 6.014854e+08 4.687551e+08 3.057106e+08 4.904020e+08 6.392595e+08 4.606993e+08 9.011810e+08 3.352641e+08 3.064611e+08 3.427663e+08 4.409242e+08 6.986685e+08 3.721406e+08 4.413859e+08 4.038656e+08 4.512968e+08 5.176488e+08 4.695341e+08 3.505030e+08 6.810219e+08 4.299702e+08 7.103633e+08 5.029607e+08 3.446566e+08 3.531155e+08 5.434697e+08 3.742867e+08 6.380290e+08 1.290733e+09 1.377047e+09 7.575350e+08 8.289953e+08 7.187481e+08 7.723888e+08 9.658126e+08 1.154805e+09 1.767939e+09 9.401249e+08 1.021858e+09 8.310054e+08 1.026813e+09 1.091162e+09 1.148915e+09 1.499650e+09 1.208700e+09 1.346749e+09 1.011304e+09 4.708653e+08 8.885037e+08 6.591672e+08 1.627310e+09 1.837758e+09 2.053008e+09 6.501903e+08 2.116835e+09 1.974240e+09 4.911082e+08 9.126700e+08 1.585879e+09 2.430151e+09 1.730986e+09 8.355023e+08 8.394538e+08 6.213988e+08 6.993862e+08 5.016392e+08 1.394118e+09 1.596937e+09 2.113758e+09 4.796342e+08 1.423026e+09 8.486413e+08 7.616660e+08 5.983746e+08 6.294117e+08 1.424340e+09 7.440282e+08 5.699158e+08 6.584059e+08 7.310207e+08 3.204489e+09 8.604922e+08 7.245596e+08 7.416377e+08 2.011054e+09 1.583899e+09 7.261344e+08 9.258302e+08 1.264636e+09 2.117711e+09 3.746927e+09 4.197314e+08 1.253310e+09 5.857431e+09 5.122644e+08 7.728208e+08 1.177169e+09 7.131611e+08 2.093596e+08 2.091448e+09 5.809765e+08 8.305823e+08 6.307190e+08 3.624003e+09 1.144380e+09 3.811382e+09 1.213981e+09 7.273693e+08 1.799487e+09 2.026924e+09 6.782212e+08 9.150230e+08 5.813449e+08 7.990075e+08 1.279697e+09 2.119731e+09 7.149704e+08 1.413498e+09 1.273931e+09 2.161082e+09 3.935217e+09 1.557651e+09 8.935060e+08 7.388369e+08 1.257390e+09 1.613222e+09 2.616454e+09 1.719357e+09 1.586141e+09 3.141663e+09 3.889582e+09 1.274968e+09 1.049358e+09 2.933535e+08 3.814745e+08 6.014584e+08 9.040413e+08 C4 H4 N8 O P2_9.003 3.791550e+06 6.120487e+06 6.074594e+06 5.860566e+06 1.472709e+05 1.565100e+06 6.348992e+06 5.700254e+06 119636.26 4.857705e+06 5.729296e+06 5.721497e+06 151212.70 4.915080e+06 4.441314e+06 5.504012e+06 1.725377e+05 5.231275e+06 4.694848e+06 5.398515e+06 5.652921e+04 5.147454e+06 5.623818e+06 5.895701e+06 16081.136 4.736563e+06 5.546805e+06 4.701735e+06 1.756335e+04 5.106689e+06 5.088092e+06 5.491222e+06 104115.44 5.693746e+06 4.597780e+06 5.319569e+06 5.978585e+04 5.446374e+06 5.049984e+06 6.109699e+06 9.564734e+04 4.402527e+06 6.155119e+06 5.431820e+06 9.146480e+04 3.846228e+06 4.783139e+06 6.025596e+06 5.153850e+06 2.395731e+06 4.535608e+06 1.230043e+07 8.199972e+06 1.000636e+07 4.524408e+06 7.300192e+06 4.246906e+06 5.771169e+06 4.311262e+06 1.114046e+07 5.123237e+06 3.678045e+06 4.282122e+06 4.116814e+06 6.711066e+06 6.611860e+06 4.660429e+06 2.414222e+06 2.778685e+06 3.458091e+06 1.319671e+07 4.200154e+06 4.706860e+06 1.110878e+07 3.115558e+06 1.169353e+07 5.683327e+06 7.632303e+06 4.441206e+06 7.931822e+06 3.162948e+06 9.500967e+06 3.522389e+06 8.029623e+06 3.835732e+06 7.621334e+06 1.476588e+06 1.613385e+06 2.577175e+06 2.373660e+06 3.659166e+06 1.245051e+07 2.302205e+06 2.850027e+06 4.570980e+06 1.127895e+07 4.294597e+06 1.800364e+06 1.340979e+07 4.536767e+06 2.839692e+06 6.164592e+06 2.091951e+06 6.653019e+06 2.253430e+06 2.978885e+06 4.305953e+06 3.934938e+06 2.518340e+06 6.014605e+06 1.625193e+06 3.123172e+06 4.205133e+06 9.163369e+06 1.077081e+07 2.097525e+06 5.241282e+06 4.485155e+06 2.327117e+06 1.923720e+06 1.511071e+06 1.828696e+06 1.170923e+06 9.338054e+05 2.702234e+06 3.064130e+06 2.487599e+06 1.333330e+06 2.178240e+06 3.470869e+06 2.281114e+06 2.268280e+06 1.424839e+06 1.605634e+06 1.841211e+06 2.082328e+06 2.640523e+06 1.465224e+06 2.442722e+06 2.082992e+06 2.069350e+06 2.522137e+06 2.486832e+06 1.802168e+06 3.393320e+06 1.944838e+06 3.736485e+06 2.180644e+06 1.459097e+06 1.687911e+06 2.404475e+06 1.858980e+06 2.910560e+06 9.946865e+06 7.840655e+06 3.751671e+06 6.331083e+06 3.722966e+06 3.937585e+06 4.810127e+06 6.245876e+06 6.869265e+06 4.632561e+06 4.691781e+06 4.194318e+06 5.693816e+06 6.248514e+06 5.864573e+06 7.136610e+06 6.029773e+06 5.912872e+06 5.702262e+06 2.658785e+06 3.598296e+06 3.288692e+06 7.520654e+06 7.865487e+06 8.658430e+06 3.640908e+06 8.515018e+06 7.976388e+06 2.502482e+06 4.353037e+06 8.635157e+06 1.176941e+07 7.737983e+06 4.464982e+06 3.422195e+06 3.094412e+06 2.605273e+06 2.165805e+06 5.136605e+06 3.144088e+05 7.490538e+06 2.450742e+06 5.997439e+06 3.746982e+06 3.906446e+06 3.280427e+06 3.604840e+06 8.006511e+06 3.950693e+06 4.091842e+06 2.862450e+06 4.009605e+06 1.532420e+07 4.523585e+06 3.307627e+06 3.192721e+06 1.041550e+07 6.904063e+06 2.809891e+06 4.341220e+06 5.568731e+06 6.846325e+06 1.424941e+07 1.818771e+06 4.401161e+06 2.483141e+07 2.384238e+06 2.472068e+06 4.426522e+06 3.385804e+06 2.814848e+06 1.006680e+07 3.115744e+06 3.708754e+06 2.557246e+06 5.888915e+06 5.083574e+06 8.949964e+06 6.012820e+06 3.625920e+06 6.285758e+06 8.411092e+06 2.954265e+06 4.616819e+06 2.253776e+06 3.727883e+06 7.296949e+06 8.804863e+06 3.146152e+06 8.241700e+06 5.626705e+06 9.569816e+06 1.452558e+07 8.251635e+06 4.668456e+06 3.723849e+06 6.322953e+06 7.982535e+06 1.180873e+07 7.693996e+06 6.555609e+06 1.447076e+07 1.827473e+07 6.106804e+06 6.128094e+06 1.389623e+06 1.825974e+06 2.613076e+06 4.540606e+06 L-ALANINE 1.639881e+09 2.717364e+08 1.500480e+09 1.408367e+09 6.585926e+05 6.996081e+07 1.165760e+09 1.098396e+09 424003.40 8.945556e+08 9.493833e+08 9.434087e+08 509422.88 8.441516e+08 8.670372e+08 9.745274e+08 3.041346e+05 8.289841e+08 8.907285e+08 9.377461e+08 2.788968e+05 8.188516e+08 9.819333e+08 1.104915e+09 159826.098 8.221236e+08 9.100345e+08 8.684449e+08 4.575030e+05 8.832913e+08 9.248543e+08 1.010452e+09 545853.85 8.784406e+08 9.124442e+08 8.683750e+08 3.475921e+05 8.710900e+08 9.875979e+08 9.558016e+08 5.007112e+05 8.735776e+08 9.644334e+08 9.514011e+08 1.827787e+05 8.394557e+08 8.454612e+08 9.885934e+08 9.637446e+08 5.749952e+08 5.634334e+08 1.167236e+09 1.207046e+09 1.015914e+08 1.099297e+09 1.568026e+09 1.110536e+09 1.782895e+09 1.189821e+09 1.124201e+09 1.305116e+09 1.459407e+09 1.274839e+09 9.970721e+08 1.045332e+09 6.790407e+08 1.238520e+09 1.039311e+09 1.093464e+09 8.890805e+08 1.451106e+09 1.272088e+09 1.020514e+09 8.864357e+08 9.437620e+08 1.136528e+09 8.058540e+08 1.492172e+09 1.554256e+09 1.156842e+09 1.055444e+09 7.595280e+08 6.059245e+08 6.448924e+08 8.688494e+08 1.165546e+09 7.250056e+08 8.160704e+08 1.003300e+09 9.158048e+08 8.436091e+08 9.267379e+08 8.565391e+08 1.087330e+09 7.018162e+08 9.161066e+08 8.960075e+08 1.313562e+09 9.444119e+08 1.183102e+09 8.983484e+08 9.936495e+08 1.052465e+09 1.336057e+09 1.064601e+09 8.231912e+08 6.255348e+08 8.521833e+08 1.001230e+08 7.594229e+08 7.505967e+08 5.927407e+08 7.489429e+08 1.338273e+09 1.153449e+09 1.119578e+09 6.560773e+08 8.464046e+08 1.239804e+09 1.138446e+09 7.681477e+08 6.338667e+08 8.537693e+08 1.194323e+09 1.030079e+09 1.009273e+09 8.602180e+08 5.619186e+08 1.123704e+09 8.918325e+08 1.159324e+09 1.327615e+09 8.207388e+08 7.984693e+08 9.758063e+08 5.590375e+08 8.662538e+08 8.797137e+08 1.113416e+09 1.005061e+09 6.295833e+08 1.028990e+09 8.547164e+08 9.426642e+08 9.219600e+08 8.682588e+08 1.311139e+09 9.830267e+08 1.161057e+09 8.937223e+08 7.680583e+08 6.017365e+08 7.158978e+08 8.528343e+08 9.458337e+08 9.713218e+08 1.039806e+09 1.283645e+09 5.855708e+08 8.566890e+08 1.151276e+09 9.594219e+08 1.045151e+09 1.088078e+09 5.979565e+08 9.144964e+08 7.827427e+08 8.163823e+08 7.933831e+08 1.059983e+09 1.437455e+09 1.041596e+09 1.417023e+09 8.077438e+08 8.318420e+08 8.353393e+08 9.208510e+08 9.350349e+08 9.824753e+08 7.903743e+08 7.165001e+08 5.800362e+08 8.644945e+08 9.799544e+08 7.450431e+08 1.074197e+09 9.129866e+08 8.343582e+08 8.271248e+08 6.634850e+08 6.881215e+08 1.123282e+09 1.103921e+09 1.061809e+09 6.370036e+08 8.762369e+08 9.735543e+08 6.222073e+08 8.345044e+08 8.074428e+08 8.994708e+08 1.018000e+09 9.752418e+08 1.127561e+09 9.922996e+08 1.169184e+09 7.993922e+08 9.015504e+08 4.475570e+08 1.279390e+09 7.947938e+08 8.858406e+08 7.364073e+08 8.832998e+08 7.583397e+08 1.017713e+09 6.305802e+08 5.639898e+08 1.247515e+09 7.446720e+08 6.251887e+08 1.315274e+09 7.839363e+08 3.744879e+08 8.262275e+08 4.546750e+08 9.735930e+08 1.117186e+09 9.267800e+08 1.764991e+09 1.233420e+09 9.774546e+08 1.413754e+09 9.318183e+08 6.511934e+08 5.985360e+08 1.523840e+09 1.331233e+09 6.477896e+08 1.459639e+09 1.463409e+09 7.349885e+08 7.907750e+08 1.228471e+09 1.279178e+09 9.210496e+08 1.219432e+09 6.599059e+08 9.520592e+08 1.251996e+09 1.377323e+09 1.179486e+09 1.131040e+09 9.840256e+08 1.272686e+09 9.479433e+08 6.827598e+08 1.215128e+09 1.115795e+09 9.384692e+08 9.874360e+08 1.215160e+09 C4 H9 N O3 S_9.019 9.882404e+06 5.035271e+06 5.725744e+06 6.113256e+06 2.214995e+05 3.294443e+06 5.968026e+06 5.442537e+06 198782.83 5.568950e+06 5.537054e+06 5.543020e+06 269599.70 4.665297e+06 4.943456e+06 5.137427e+06 3.227053e+05 5.388083e+06 4.536815e+06 5.817869e+06 9.441652e+04 4.901171e+06 5.373376e+06 7.189946e+06 27321.031 4.422658e+06 4.837160e+06 5.016655e+06 3.020658e+04 4.836747e+06 4.475799e+06 7.602999e+06 176099.82 4.661867e+06 5.016773e+06 4.659844e+06 1.073789e+05 4.908948e+06 5.770899e+06 5.934562e+06 1.750675e+05 4.703057e+06 5.287658e+06 5.583826e+06 1.877236e+05 4.891180e+06 5.116027e+06 5.419882e+06 3.683472e+06 2.762812e+06 9.878444e+07 4.183176e+06 5.242831e+06 5.575785e+06 3.896970e+06 3.555754e+06 4.244658e+06 1.532523e+07 5.958159e+06 3.585714e+06 4.917782e+06 3.502213e+06 4.819240e+06 1.865657e+07 2.882241e+06 6.862665e+06 8.466314e+06 4.053938e+06 1.028973e+07 7.099514e+06 2.529019e+06 4.712652e+06 5.330830e+06 3.922695e+06 4.020138e+06 5.119600e+06 4.151896e+06 1.729745e+07 7.554129e+06 4.418585e+06 9.714036e+06 1.979188e+06 4.574822e+06 9.741526e+06 3.207169e+06 4.077429e+06 2.949654e+06 2.356822e+06 2.595587e+06 7.176782e+06 3.248929e+06 1.158055e+07 2.367639e+06 4.645196e+06 4.833967e+06 1.544121e+07 2.006923e+06 4.174850e+06 1.314893e+06 3.639968e+06 3.744273e+06 2.650725e+06 2.975236e+06 5.053547e+06 6.126260e+06 5.674485e+06 5.671872e+06 2.512316e+06 4.414869e+06 6.696668e+06 1.671854e+06 9.080605e+06 7.731540e+06 2.330485e+06 2.906567e+06 1.920060e+07 9.401796e+06 1.520663e+07 9.935283e+06 6.546006e+06 1.474537e+06 5.200619e+06 2.906617e+06 1.959518e+06 2.486018e+06 3.153925e+06 2.992666e+06 4.323853e+06 6.820855e+06 2.918333e+06 4.238487e+06 3.536877e+06 4.797440e+06 3.641847e+06 2.912161e+06 1.219050e+07 2.949774e+06 3.980638e+06 2.517839e+06 4.794665e+06 5.003080e+06 1.796950e+06 5.118205e+06 4.063383e+06 3.811966e+06 2.307003e+06 3.257356e+06 3.098376e+06 2.691956e+06 3.573881e+06 7.501338e+06 3.693104e+06 2.636765e+06 4.976792e+06 4.682632e+07 4.842106e+06 3.045515e+06 2.342263e+06 2.422159e+06 1.684849e+07 2.924741e+06 3.502196e+06 2.640979e+06 1.295575e+07 5.243018e+06 5.009630e+06 2.840775e+06 2.638670e+06 3.778938e+06 5.872966e+06 1.144426e+07 1.532388e+07 1.044840e+07 2.450493e+06 3.327580e+06 2.191048e+06 1.161850e+07 8.238972e+06 5.171364e+06 2.112527e+06 2.135875e+06 1.090261e+07 3.330689e+06 2.847332e+06 2.390616e+06 4.684205e+06 2.999926e+06 3.089841e+06 2.214366e+06 2.604377e+06 1.145890e+07 5.152445e+06 2.434425e+06 3.539472e+06 1.711261e+06 3.180798e+06 2.595004e+06 3.197384e+06 5.171988e+06 1.881049e+06 5.311213e+06 2.216559e+06 4.574606e+06 9.530563e+06 2.874575e+06 1.938962e+06 3.832312e+06 2.462487e+06 2.740021e+06 2.220901e+06 4.646507e+06 2.336675e+06 4.634408e+06 3.318453e+06 1.994612e+06 3.198479e+06 3.460591e+06 2.594256e+06 2.185114e+06 3.118424e+06 3.033408e+06 5.099443e+06 3.698665e+06 1.945015e+06 4.167634e+06 2.639034e+06 6.908738e+06 3.761805e+06 2.285719e+06 2.735514e+06 2.127561e+06 2.292332e+06 2.419825e+06 2.531260e+06 3.478350e+06 5.797706e+06 2.348083e+06 4.657944e+06 3.719152e+06 5.505766e+06 3.286024e+06 1.864576e+06 6.041495e+06 6.349195e+06 2.312975e+06 6.555237e+06 5.018802e+06 2.316866e+06 7.816030e+06 2.150521e+06 4.341455e+06 9.466179e+06 2.797787e+06 3.266398e+07 1.998382e+07 2.093441e+06 1.623784e+07 1.003747e+07 6.601709e+06 2.152609e+06 6.948262e+06 3.045589e+07 1-AMINOCYCLOPROPANECARBOXYLATE 1.970786e+08 1.863954e+08 1.850548e+08 1.803777e+08 6.375781e+05 9.444163e+07 1.694921e+08 1.898295e+08 363931.97 1.739681e+08 1.642730e+08 1.830503e+08 636963.75 1.609104e+08 1.529140e+08 1.576445e+08 6.341198e+05 1.665522e+08 1.650844e+08 1.795478e+08 4.210887e+05 1.536071e+08 1.687345e+08 2.181748e+08 266443.029 1.347838e+08 1.739760e+08 1.451188e+08 1.242582e+05 1.522524e+08 1.899446e+08 1.845143e+08 360606.40 1.542169e+08 1.617259e+08 1.678705e+08 4.714110e+05 1.559357e+08 1.668434e+08 1.820332e+08 3.195598e+05 1.607192e+08 1.803731e+08 1.816704e+08 3.142257e+05 1.447128e+08 1.450860e+08 1.859334e+08 1.824925e+08 1.231586e+08 1.326588e+08 3.428105e+08 2.627085e+08 1.788265e+08 2.397990e+08 2.491292e+08 1.335672e+08 2.215049e+08 1.947816e+08 2.873335e+08 2.194306e+08 1.996030e+08 1.702405e+08 1.985261e+08 1.939983e+08 1.514461e+08 2.541769e+08 1.282001e+08 1.457294e+08 1.638618e+08 3.062472e+08 1.632089e+08 1.331576e+08 2.239988e+08 1.839922e+08 2.926463e+08 1.830495e+08 1.773484e+08 2.137688e+08 2.641848e+08 1.148880e+08 2.011189e+08 1.272326e+08 1.660858e+08 1.599023e+08 2.108274e+08 1.140188e+08 1.569586e+08 1.251816e+08 1.679921e+08 1.524450e+08 3.109939e+08 7.593954e+07 1.822062e+08 1.649198e+08 2.922720e+08 2.653730e+08 1.939735e+08 2.922914e+08 1.986193e+08 1.543002e+08 2.530830e+08 1.628456e+08 2.362011e+08 1.612884e+08 1.598602e+08 1.515606e+08 1.511301e+08 1.225902e+08 1.595302e+08 8.946868e+07 1.117892e+08 1.244246e+08 2.391264e+08 3.273046e+08 1.552219e+08 1.431194e+08 2.257713e+08 1.417530e+08 1.396247e+08 1.188536e+08 1.124170e+08 8.001695e+07 1.198225e+08 1.165733e+08 1.058262e+08 1.202919e+08 9.961818e+07 1.476220e+08 1.571231e+08 1.590862e+08 1.803834e+08 9.471929e+07 1.585933e+08 1.476592e+08 7.995032e+07 1.161905e+08 1.292562e+08 1.248637e+08 1.782215e+08 1.086850e+08 1.066596e+08 1.547693e+08 1.508337e+08 1.675542e+08 8.917701e+07 1.487417e+08 1.309346e+08 1.116163e+08 8.409865e+07 1.182458e+08 8.133551e+07 1.440047e+08 1.571504e+08 1.807808e+08 1.577134e+08 1.472810e+08 1.589344e+08 1.021856e+08 1.786291e+08 1.947881e+08 2.167292e+08 1.694391e+08 1.697963e+08 1.663165e+08 1.557827e+08 1.926400e+08 1.700700e+08 1.595154e+08 1.809890e+08 1.936463e+08 1.644841e+08 1.693565e+08 1.262304e+08 1.561337e+08 1.519532e+08 2.554397e+08 2.596029e+08 1.297078e+08 2.191456e+08 2.263317e+08 1.281948e+08 2.001685e+08 2.335913e+08 2.456710e+08 2.335523e+08 1.670803e+08 1.805567e+08 1.473573e+08 1.430209e+08 1.288631e+08 2.039154e+08 1.802160e+08 2.335294e+08 9.288631e+07 1.742799e+08 1.384851e+08 1.252271e+08 1.370831e+08 1.433551e+08 2.523958e+08 1.388193e+08 1.394124e+08 1.795875e+08 1.049244e+08 3.085116e+08 1.431954e+08 9.307166e+07 1.382301e+08 1.717478e+08 1.863464e+08 1.280242e+08 1.533411e+08 1.469684e+08 1.852059e+08 3.717989e+08 9.494095e+07 9.542942e+07 6.013324e+08 1.339820e+08 1.193368e+08 1.922980e+08 1.640794e+08 3.961428e+07 1.476023e+08 1.062552e+08 1.725387e+08 1.573050e+08 2.967046e+08 2.231264e+08 3.197727e+08 1.477987e+08 1.778875e+08 2.240385e+08 2.327009e+08 1.276903e+08 2.243374e+08 1.776952e+08 9.324825e+07 1.792555e+08 2.761203e+08 1.283669e+08 1.005206e+08 1.858291e+08 1.832365e+08 3.564518e+08 2.244679e+08 1.222353e+08 1.601867e+08 1.997899e+08 2.033938e+08 2.584012e+08 2.625450e+08 2.048342e+08 2.654286e+08 3.475352e+08 2.520080e+08 2.141429e+08 1.701883e+08 8.388790e+07 1.612971e+08 2.137154e+08 C23 H26 N3 O14 P_9.064 1.912291e+05 3.072898e+05 5.461564e+05 8.881234e+05 1.000645e+05 1.772661e+05 5.049179e+05 8.742790e+05 89562.92 3.499544e+05 5.837231e+05 7.701569e+05 78280.22 4.313440e+05 2.930865e+05 4.833932e+05 1.379950e+05 3.941080e+05 6.780854e+05 4.446083e+05 3.464005e+04 5.594293e+05 5.658618e+05 7.055510e+05 10811.831 4.849692e+05 4.430894e+05 4.594481e+05 1.263238e+04 5.703129e+05 4.373332e+05 6.784435e+05 71186.65 5.249609e+05 4.712537e+05 4.931447e+05 4.008855e+04 6.046600e+05 4.118262e+05 6.097500e+05 5.655895e+04 4.636195e+05 6.771864e+05 5.727138e+05 5.303159e+04 4.094888e+05 4.561265e+05 5.929481e+05 2.764911e+05 1.088106e+05 2.457703e+05 3.924639e+06 6.263867e+05 1.310534e+06 1.421854e+05 7.212527e+05 6.580375e+05 2.125603e+05 2.946001e+05 2.321984e+06 4.759576e+05 3.668982e+05 1.792213e+05 1.150260e+05 3.192715e+06 1.015955e+06 2.025123e+05 1.097765e+05 1.002851e+05 3.004128e+05 3.941009e+06 2.522459e+05 7.423464e+05 1.666094e+06 2.434465e+05 1.090145e+06 1.704069e+05 8.136874e+05 1.162431e+05 4.604287e+05 1.792406e+05 1.174215e+06 2.226734e+05 9.218820e+05 1.013902e+05 5.497249e+05 1.410539e+05 9.280113e+04 9.829949e+04 1.900831e+05 4.286300e+05 1.578150e+06 1.624633e+05 9.715153e+04 8.809547e+04 1.172290e+06 1.651276e+06 1.044004e+05 3.867583e+06 9.990695e+04 1.022735e+05 4.844776e+05 1.339178e+05 1.050692e+06 2.121565e+05 1.897193e+05 1.251962e+05 1.339385e+05 3.593522e+05 5.875285e+05 1.650241e+05 2.388407e+05 2.064901e+05 1.209701e+06 2.145739e+06 1.721455e+05 3.902271e+05 3.708390e+05 3.223954e+05 2.791160e+05 1.756306e+05 2.410364e+05 7.810130e+04 2.914642e+05 2.183690e+05 2.574493e+05 8.445576e+04 1.173817e+05 1.390068e+05 1.630429e+05 1.640459e+05 1.202943e+05 1.670194e+05 1.196607e+05 9.013165e+04 8.736089e+04 1.985550e+05 1.015348e+05 1.513562e+05 1.106059e+05 8.457121e+04 3.004291e+05 9.043779e+04 2.132428e+05 1.074242e+05 1.117975e+05 1.298731e+05 2.618095e+05 1.352390e+05 1.965049e+05 9.596536e+04 3.735539e+05 8.975195e+04 1.952583e+06 5.929878e+05 1.534845e+05 5.114603e+05 1.600252e+05 2.505412e+05 4.871111e+05 6.303855e+05 4.177038e+05 6.578276e+05 1.217006e+05 1.118984e+05 4.827744e+05 4.063993e+05 2.448338e+05 2.792498e+05 4.299317e+05 3.357193e+05 5.891053e+05 1.101253e+05 3.907403e+05 1.806991e+05 8.533443e+05 4.411651e+05 1.029390e+06 1.628267e+05 7.507577e+05 1.812576e+06 9.013722e+04 1.113224e+05 3.530742e+05 2.979149e+06 4.362425e+05 1.920517e+05 1.905738e+05 1.003234e+05 8.680537e+04 2.284853e+05 1.398573e+06 1.607750e+05 1.266039e+06 1.186027e+06 2.718693e+05 3.178272e+05 1.134010e+05 1.709665e+05 2.129458e+05 1.312228e+05 1.457624e+05 1.552240e+05 8.359520e+04 9.745508e+04 2.425525e+06 3.888713e+05 1.069876e+05 2.907182e+05 3.991952e+05 4.585317e+05 1.525427e+05 2.681648e+05 1.944973e+05 1.100720e+06 9.287111e+05 1.368554e+05 1.629867e+05 8.487073e+06 8.974190e+04 1.727203e+05 9.001581e+04 2.397524e+05 6.385109e+04 5.569020e+05 1.737892e+05 4.300824e+05 3.182910e+05 1.694855e+06 1.331893e+05 2.548308e+06 8.760222e+05 2.739173e+05 2.365477e+05 4.117239e+05 2.141968e+05 1.492914e+05 2.092856e+05 8.517987e+04 3.157546e+05 3.447153e+05 7.619441e+04 3.186893e+05 1.157225e+05 1.119753e+06 1.089577e+06 1.298065e+05 1.190397e+05 2.033835e+05 9.555617e+05 2.313253e+05 3.355611e+05 3.074694e+05 1.715527e+05 1.246965e+06 2.976012e+06 2.664816e+05 3.218531e+05 3.855156e+05 1.343656e+06 1.151498e+05 1.152482e+05 C3 H6 N7 O3 P_9.096 8.095190e+07 2.576223e+07 2.532609e+07 2.032207e+08 2.539824e+06 1.674464e+08 1.732956e+08 3.796112e+07 2627800.22 2.866741e+07 3.449377e+07 3.692507e+07 25739080.71 2.409188e+07 9.803192e+06 2.946540e+07 1.630850e+07 4.012265e+07 4.209574e+07 2.861056e+07 9.089472e+05 1.301316e+07 1.266072e+07 5.274040e+07 9662391.589 3.642428e+07 2.060035e+07 2.218566e+07 6.088780e+06 2.567030e+07 1.295799e+08 5.650814e+07 17421751.55 2.282465e+07 3.610384e+07 1.985039e+07 1.011751e+07 3.738539e+06 2.426308e+08 3.398057e+07 2.491375e+07 2.887357e+07 2.016573e+08 4.064849e+07 1.650034e+07 1.323879e+08 1.849812e+07 3.471852e+07 2.602797e+07 8.566498e+07 3.441956e+07 4.708252e+07 2.907512e+07 7.788081e+07 8.997012e+06 2.808120e+07 6.506206e+07 2.563105e+07 3.127040e+07 3.483881e+07 7.076581e+05 1.565911e+07 4.682617e+07 6.270551e+07 2.908588e+07 4.174628e+07 1.807733e+08 4.011399e+07 2.307016e+07 1.637246e+08 8.693288e+06 8.387666e+07 1.934977e+07 3.904805e+07 6.238644e+07 6.887493e+07 4.263405e+07 3.455377e+07 1.138032e+07 6.713216e+07 2.056715e+07 5.438104e+07 7.715768e+07 3.906505e+07 1.750416e+07 2.882856e+06 3.728491e+07 7.190472e+06 2.101594e+07 2.531331e+07 1.761779e+07 9.955773e+06 1.970607e+07 6.409200e+07 5.933741e+07 2.150955e+07 1.145932e+08 7.514642e+07 2.772189e+07 2.844985e+07 3.503359e+06 1.216905e+08 2.454860e+07 1.639850e+08 3.488298e+07 4.189774e+07 1.543565e+07 5.599643e+06 2.007137e+07 9.653376e+06 2.565650e+07 3.619223e+07 6.657409e+07 1.073868e+07 1.273092e+07 6.968479e+07 6.406440e+07 6.407471e+07 7.220337e+07 5.515103e+07 3.821132e+07 1.309304e+07 1.577331e+08 3.030982e+07 3.214881e+07 3.205488e+07 1.444613e+07 3.396505e+07 1.568547e+07 2.322849e+07 5.592721e+07 2.428536e+07 2.935693e+07 1.311906e+08 2.465811e+07 1.671307e+08 1.447432e+08 9.261483e+06 4.655613e+07 3.846945e+07 8.264283e+07 2.426466e+07 2.438120e+07 3.323892e+07 1.362502e+07 3.758695e+07 2.925199e+07 1.517189e+07 3.285647e+07 3.221254e+07 1.988766e+07 1.312092e+08 2.914057e+07 5.026069e+07 3.505944e+07 3.076295e+07 3.117965e+08 3.776981e+07 4.241958e+07 8.189157e+06 5.376522e+07 3.416774e+07 1.462025e+07 2.597167e+07 3.439978e+07 2.641153e+07 8.675929e+07 1.081825e+08 3.495354e+07 3.465666e+07 2.262665e+07 5.228369e+07 4.343356e+07 9.665569e+06 4.586911e+07 2.959786e+07 2.724395e+07 2.964023e+07 6.934763e+07 2.178642e+07 4.272786e+07 7.400869e+07 4.316517e+07 3.278825e+07 2.550263e+07 2.810481e+07 1.475483e+08 1.644694e+08 1.391955e+08 1.835713e+07 9.321531e+07 6.487021e+06 1.171412e+08 2.262789e+07 2.685735e+07 1.379328e+07 1.554726e+07 3.424772e+07 3.442758e+07 1.824998e+08 1.536323e+08 3.599666e+07 4.574053e+08 1.828241e+07 1.125582e+07 1.684404e+08 2.036149e+07 3.949467e+07 6.773528e+07 1.256795e+07 2.906065e+07 5.202190e+07 3.502063e+07 2.779933e+07 1.319171e+08 2.836437e+07 3.317290e+07 5.025417e+07 1.174028e+07 3.554529e+07 2.321021e+07 3.128591e+07 2.328745e+07 1.398064e+08 4.292679e+07 2.034466e+07 3.632433e+07 3.472904e+07 1.869709e+07 1.395380e+07 2.252696e+08 2.735903e+07 2.726183e+07 2.879326e+07 3.207852e+07 4.667755e+07 2.239896e+08 2.528290e+07 3.457669e+07 2.369864e+07 3.765660e+07 3.279193e+07 1.566135e+07 6.768264e+06 9.676181e+06 6.736520e+06 1.903543e+07 1.734016e+07 4.105436e+07 1.504700e+07 1.695646e+07 2.802344e+07 4.176425e+07 1.041785e+07 3.943024e+07 3.408055e+07 4.232155e+07 3.214157e+07 2.421869e+07 1.214311e+07 1.813785e+07 1.659847e+08 HOMOSERINE 1.199909e+09 9.425211e+08 9.631830e+08 9.714594e+08 3.732820e+05 5.852562e+08 9.181479e+08 9.447462e+08 258760.63 9.047912e+08 8.988098e+08 9.667569e+08 424104.17 8.765127e+08 8.243135e+08 8.760693e+08 4.059066e+05 8.728542e+08 8.775155e+08 8.947924e+08 1.308128e+05 8.318596e+08 9.177492e+08 1.080568e+09 37374.106 7.612202e+08 9.380615e+08 8.379151e+08 2.484963e+05 8.206644e+08 9.057454e+08 9.489407e+08 223734.57 8.732893e+08 9.191216e+08 8.604227e+08 1.596538e+05 8.683711e+08 8.551894e+08 9.539676e+08 3.092360e+05 8.560747e+08 9.567715e+08 9.114606e+08 2.190802e+05 8.098067e+08 8.230559e+08 9.573684e+08 8.564452e+08 7.706729e+08 6.326493e+08 1.601588e+09 1.330299e+09 9.137492e+08 1.416493e+09 1.545364e+09 7.082276e+08 1.217458e+09 1.106483e+09 8.060648e+08 1.274293e+09 1.276993e+09 1.057769e+09 1.146764e+09 7.549161e+08 6.901479e+08 1.537598e+09 8.049071e+08 1.078168e+09 9.784450e+08 1.051669e+09 9.255447e+08 6.418586e+08 1.003295e+09 1.061627e+09 1.062429e+09 9.095219e+08 1.302068e+09 1.485456e+09 1.207421e+09 6.883649e+08 8.181396e+08 8.017177e+08 7.794418e+08 9.900930e+08 1.104623e+09 8.461203e+08 1.164426e+09 7.789484e+08 1.191791e+09 8.161041e+08 1.470934e+09 4.832263e+08 1.132317e+09 9.740821e+08 1.199675e+09 1.086515e+09 1.548844e+09 7.318076e+08 1.142281e+09 1.053366e+09 1.218891e+09 1.110317e+09 9.548588e+08 1.141336e+09 1.017985e+09 7.598874e+08 8.866054e+08 8.543221e+08 8.643549e+08 5.902011e+08 6.225747e+08 7.796281e+08 1.080367e+09 8.543216e+08 1.081214e+09 7.459446e+08 1.323149e+09 9.871621e+08 9.500396e+08 8.776378e+08 7.872170e+08 6.552414e+08 9.671186e+08 8.255364e+08 6.412031e+08 8.152426e+08 7.425197e+08 9.362828e+08 1.007300e+09 1.140248e+09 1.086749e+09 7.004756e+08 1.189657e+09 1.222375e+09 5.283040e+08 6.456691e+08 9.622301e+08 8.200470e+08 1.310904e+09 7.615489e+08 6.121377e+08 1.094062e+09 1.081880e+09 1.051416e+09 5.964917e+08 8.558901e+08 8.747578e+08 8.356351e+08 6.599076e+08 7.006092e+08 5.199943e+08 8.630624e+08 7.395130e+08 9.412791e+08 9.286478e+08 8.362110e+08 9.371508e+08 5.362006e+08 9.869582e+08 9.297016e+08 9.913990e+08 9.151606e+08 8.973076e+08 9.422160e+08 8.369651e+08 1.138658e+09 8.508676e+08 6.722943e+08 8.148941e+08 9.259283e+08 9.336646e+08 1.282682e+09 6.168196e+08 9.430985e+08 5.940570e+08 1.272605e+09 1.162577e+09 7.709862e+08 7.689874e+08 6.305009e+08 9.113118e+08 1.261378e+09 9.517905e+08 9.578003e+08 1.345090e+09 9.262500e+08 1.190210e+09 9.711753e+08 9.736355e+08 8.146400e+08 9.196125e+08 7.398076e+08 8.427456e+08 5.472942e+08 7.942890e+08 8.479513e+08 7.605445e+08 8.736738e+08 8.161034e+08 1.226867e+09 8.593036e+08 8.224973e+08 1.206840e+09 5.784065e+08 9.658973e+08 8.509373e+08 4.637110e+08 7.548484e+08 5.769598e+08 1.037554e+09 7.450934e+08 8.236010e+08 6.842255e+08 8.303303e+08 9.421496e+08 7.253990e+08 4.654026e+08 1.122544e+09 8.333706e+08 5.636111e+08 1.090503e+09 1.052763e+09 4.936517e+08 1.030202e+09 6.607896e+08 1.076174e+09 1.065223e+09 7.664589e+08 1.476934e+09 6.897869e+08 7.722811e+08 1.162066e+09 1.048663e+09 9.676757e+08 9.749437e+08 1.527499e+09 1.327023e+09 4.837478e+08 7.529791e+08 1.029281e+09 7.439741e+08 5.391033e+08 1.102471e+09 1.331759e+09 9.522148e+08 1.016083e+09 5.405282e+08 1.021468e+09 1.189482e+09 9.071518e+08 1.052841e+09 1.049468e+09 8.836965e+08 1.032783e+09 8.248968e+08 1.446268e+09 1.229684e+09 1.308767e+09 6.010375e+08 1.083059e+09 1.305744e+09 C3 H7 N O_9.102 6.815851e+07 5.422897e+07 5.639594e+07 5.068578e+07 1.898216e+06 3.920797e+06 5.139550e+07 4.728651e+07 1239381.64 4.457659e+07 4.573990e+07 4.710530e+07 1221922.10 4.018720e+07 4.266010e+07 4.615946e+07 1.183973e+06 4.409839e+07 4.175036e+07 4.443106e+07 1.096412e+06 3.903899e+07 4.577144e+07 5.258464e+07 1687624.942 4.012059e+07 4.575800e+07 4.120074e+07 1.523632e+06 4.286243e+07 4.226944e+07 4.723676e+07 108891.87 4.542423e+07 4.240520e+07 4.295689e+07 1.312929e+06 4.214959e+07 4.565647e+07 4.740506e+07 1.075019e+06 4.114450e+07 4.620045e+07 4.576655e+07 1.041131e+06 4.107992e+07 4.050652e+07 4.716794e+07 3.988725e+07 3.402209e+07 3.221249e+07 7.825652e+07 6.702648e+07 4.176729e+07 6.780824e+07 8.026968e+07 3.266273e+07 6.182927e+07 5.813178e+07 3.534865e+07 6.816171e+07 6.467992e+07 4.878847e+07 5.340897e+07 3.572740e+07 3.373684e+07 7.889649e+07 4.009020e+07 5.309690e+07 4.610466e+07 5.283323e+07 4.436079e+07 3.791618e+07 5.381861e+07 5.003770e+07 4.875409e+07 4.266651e+07 6.555827e+07 6.976657e+07 5.812771e+07 3.321844e+07 3.825253e+07 3.886026e+07 3.471707e+07 5.129785e+07 5.569334e+07 4.361593e+07 5.426106e+07 3.766323e+07 5.677447e+07 4.190336e+07 6.587480e+07 2.299176e+07 6.054425e+07 4.512685e+07 5.544460e+07 5.199844e+07 7.893420e+07 3.495054e+07 5.358311e+07 5.297092e+07 6.130018e+07 5.514233e+07 5.065184e+07 5.908062e+07 5.368612e+07 3.672324e+07 4.597159e+07 3.954908e+07 4.217367e+07 2.915064e+07 3.063664e+07 3.747821e+07 5.329976e+07 4.144621e+07 5.743761e+07 3.419478e+07 6.275625e+07 5.078703e+07 4.519134e+07 4.250360e+07 3.881388e+07 3.092957e+07 4.894227e+07 4.128437e+07 3.181840e+07 4.104130e+07 3.785969e+07 4.447999e+07 4.905637e+07 5.674204e+07 5.907323e+07 3.522096e+07 6.139434e+07 5.833760e+07 2.651030e+07 3.105804e+07 4.691538e+07 3.825767e+07 6.494863e+07 3.627659e+07 2.881191e+07 5.117636e+07 5.370891e+07 5.760572e+07 2.922101e+07 4.586790e+07 4.158512e+07 3.925014e+07 3.328311e+07 3.364697e+07 2.518671e+07 4.353121e+07 3.570775e+07 4.645966e+07 4.809699e+07 4.480844e+07 5.216356e+07 2.348459e+07 4.421911e+07 4.695944e+07 4.966825e+07 4.570483e+07 4.865839e+07 4.570546e+07 4.049410e+07 5.432618e+07 4.184065e+07 3.251237e+07 3.973198e+07 4.516832e+07 4.460076e+07 6.472393e+07 2.891641e+07 4.567525e+07 2.798626e+07 6.541912e+07 6.104669e+07 3.544313e+07 3.851790e+07 2.789074e+07 4.596525e+07 5.709565e+07 4.707868e+07 4.741810e+07 7.032599e+07 5.216906e+07 6.139444e+07 4.110036e+07 5.198242e+07 4.008606e+07 4.426301e+07 3.778192e+07 4.116531e+07 2.599023e+07 3.915202e+07 4.977174e+07 3.838647e+07 4.474793e+07 3.767374e+07 5.476744e+07 4.331391e+07 4.364355e+07 5.960492e+07 3.051394e+07 4.283522e+07 4.259156e+07 2.404335e+07 3.607808e+07 2.950428e+07 4.993995e+07 3.583829e+07 4.306416e+07 3.303041e+07 4.008077e+07 4.384988e+07 3.833157e+07 2.416294e+07 4.940232e+07 4.139326e+07 2.689894e+07 5.378808e+07 5.075630e+07 1.553651e+07 5.057815e+07 3.191967e+07 5.540162e+07 5.394317e+07 3.394059e+07 8.852392e+07 3.034595e+07 3.764945e+07 6.002609e+07 4.682736e+07 4.652086e+07 5.258581e+07 8.547180e+07 6.867640e+07 2.184569e+07 3.719435e+07 4.465429e+07 3.866286e+07 2.644612e+07 5.869986e+07 6.599107e+07 4.556914e+07 4.678037e+07 2.737664e+07 4.913052e+07 6.005193e+07 4.278667e+07 4.952006e+07 4.925374e+07 4.250138e+07 5.466836e+07 4.001637e+07 7.486147e+07 6.170379e+07 6.527951e+07 2.947902e+07 5.693877e+07 7.847179e+07 C7 H14 N2 O4_9.105 1.940327e+06 1.286953e+06 2.196244e+06 1.532010e+06 1.173481e+05 9.395155e+05 1.620439e+06 1.578244e+06 89470.72 1.387313e+06 1.657962e+06 1.586586e+06 110693.89 1.524391e+06 1.521591e+06 1.444391e+06 1.283630e+05 1.426351e+06 1.559907e+06 1.679027e+06 4.400877e+04 1.181037e+06 1.573953e+06 2.113617e+06 12691.498 1.229945e+06 1.513153e+06 1.309001e+06 1.571675e+04 1.393101e+06 1.554148e+06 1.788082e+06 78255.21 1.511422e+06 1.555508e+06 1.293935e+06 4.936096e+04 1.497436e+06 1.510798e+06 1.703455e+06 7.214509e+04 1.457401e+06 1.489739e+06 1.806004e+06 7.354539e+04 1.308235e+06 1.319492e+06 1.666460e+06 1.878139e+06 1.414361e+06 9.842820e+05 1.696935e+06 1.688077e+06 8.797236e+05 2.717898e+06 2.868088e+06 4.067830e+06 5.042823e+06 3.550448e+06 1.948114e+06 2.145216e+06 2.458986e+06 1.551705e+06 2.061969e+06 1.111500e+06 8.911016e+05 1.258212e+06 1.303874e+06 9.661478e+05 9.308131e+05 2.155558e+06 9.918429e+05 1.477588e+06 1.137488e+06 2.850583e+06 1.486365e+06 2.635286e+06 2.710530e+06 2.955774e+06 1.418856e+06 2.021979e+06 1.980036e+06 1.474029e+06 1.745990e+06 1.162188e+06 1.430201e+06 9.505195e+05 1.811823e+06 1.656707e+06 1.529955e+06 1.489680e+06 1.704779e+06 1.570162e+06 1.610416e+06 2.220147e+06 3.407640e+06 2.281215e+06 1.620287e+06 1.253201e+06 1.793983e+06 2.424926e+06 1.607351e+06 1.102298e+06 1.948209e+06 8.916620e+05 1.459321e+06 7.896057e+05 1.853911e+06 1.351652e+06 1.538105e+06 7.871040e+05 1.607691e+06 1.781460e+06 1.417055e+06 1.568277e+06 1.283166e+06 1.118847e+06 2.666174e+06 2.222955e+06 2.669526e+06 8.543700e+05 1.640734e+06 6.392964e+05 1.070391e+06 1.061950e+06 9.673582e+05 9.076432e+05 8.660013e+05 2.537589e+06 1.346773e+06 1.268478e+06 2.685227e+06 1.001201e+06 2.619722e+06 1.077219e+06 9.461254e+05 1.174274e+06 1.248267e+06 1.450750e+06 2.085026e+06 1.072828e+06 1.181815e+06 1.273430e+06 1.722102e+06 1.304102e+06 8.466676e+05 9.686229e+05 1.546191e+06 1.161633e+06 5.849569e+05 1.031020e+06 1.978568e+06 1.793148e+06 1.707590e+06 1.480342e+06 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1.709999e+06 1.217833e+06 1.564801e+06 1.215404e+06 1.481154e+06 2.880535e+06 8.338243e+05 1.450371e+06 2.675855e+06 7.606550e+05 1.622845e+06 1.694872e+06 1.626401e+06 1.800438e+06 1.840291e+06 9.063112e+05 1.893529e+06 1.431747e+06 1.970075e+06 2.072192e+06 1.185380e+06 2.297573e+06 1.796302e+06 1.675942e+06 1.942383e+06 2.290529e+06 1.762675e+06 1.165582e+06 1.654881e+06 1.641274e+06 C3 H4 N8 P2_9.108 3.548435e+06 2.535359e+06 2.673783e+06 2.552818e+06 1.461967e+05 1.345665e+06 2.531647e+06 2.665054e+06 121953.75 1.929659e+06 2.356014e+06 2.432387e+06 157575.45 2.560030e+06 2.148278e+06 2.292880e+06 1.833475e+05 2.204788e+06 2.062084e+06 2.067369e+06 6.117840e+04 2.977635e+06 2.282746e+06 2.754729e+06 18316.927 1.951570e+06 2.434833e+06 2.290865e+06 2.354875e+04 2.273284e+06 2.241592e+06 2.553821e+06 124851.72 2.004117e+06 2.424794e+06 2.226800e+06 7.354621e+04 2.352102e+06 2.511707e+06 2.244800e+06 1.089175e+05 2.215736e+06 2.631363e+06 2.464480e+06 1.092169e+05 2.022618e+06 2.260318e+06 2.416530e+06 1.851646e+06 2.203170e+06 1.740954e+06 3.082382e+06 3.606242e+06 3.763093e+06 3.722142e+06 3.536038e+06 1.791407e+06 2.507913e+06 2.853872e+06 1.699123e+06 4.254092e+06 3.391145e+06 2.972579e+06 3.158754e+06 1.823140e+06 1.629216e+06 3.810569e+06 2.219000e+06 2.698019e+06 2.899998e+06 2.158378e+06 2.499592e+06 1.828466e+06 2.772267e+06 2.581851e+06 2.727521e+06 2.385211e+06 2.817259e+06 3.315120e+06 2.900644e+06 1.873967e+06 1.879613e+06 2.142552e+06 1.802123e+06 2.691724e+06 2.289291e+06 1.994985e+06 3.171207e+06 1.933711e+06 2.821765e+06 2.182741e+06 3.228931e+06 1.588666e+06 3.233282e+06 2.382410e+06 2.323512e+06 2.538495e+06 4.106519e+06 1.539454e+06 3.064791e+06 2.730366e+06 3.282350e+06 2.976135e+06 2.657487e+06 2.979643e+06 2.982865e+06 2.413969e+06 2.604909e+06 2.943582e+06 2.534207e+06 1.804102e+06 1.343435e+06 2.878335e+06 2.328398e+06 1.588183e+06 3.095624e+06 1.570378e+06 3.419474e+06 3.549588e+06 2.873719e+06 2.367477e+06 2.012531e+06 1.677191e+06 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2.795610e+06 2.188527e+06 3.677785e+06 2.952909e+06 1.668985e+06 1.885351e+06 2.250836e+06 1.985137e+06 1.467305e+06 1.343291e+06 2.578208e+06 1.761931e+06 2.025852e+06 2.048327e+06 1.770325e+06 1.691672e+06 2.153499e+06 1.070958e+06 2.113616e+06 1.935061e+06 1.803196e+06 3.018859e+06 2.835260e+06 1.148771e+06 3.124525e+06 2.023913e+06 2.723555e+06 2.718051e+06 1.577069e+06 3.360114e+06 1.261607e+06 1.685751e+06 3.435222e+06 2.340706e+06 1.888697e+06 2.581474e+06 4.255859e+06 4.274982e+06 1.422748e+06 1.709441e+06 2.395542e+06 2.212013e+06 1.454093e+06 2.776515e+06 3.135583e+06 1.738361e+06 3.134983e+06 2.194889e+06 2.514622e+06 2.793886e+06 2.200567e+06 2.815930e+06 3.846356e+06 1.850498e+06 3.021261e+06 1.574150e+06 3.354874e+06 3.521045e+06 3.235617e+06 1.714813e+06 3.214285e+06 3.728514e+06 C10 H16 N2 O4_9.112 2.891714e+07 6.002034e+07 6.319321e+07 1.026552e+08 2.319277e+05 1.316586e+07 8.462276e+07 6.439052e+07 173718.25 8.045851e+07 6.151836e+07 6.006211e+07 217127.48 6.130443e+07 5.790757e+07 7.675276e+07 2.401198e+05 5.091891e+07 6.889251e+07 9.029426e+07 7.833247e+04 3.656475e+07 6.767723e+07 1.027276e+08 24159.951 4.892179e+07 4.334677e+07 6.319127e+07 3.190485e+04 6.085750e+07 7.286441e+07 7.415887e+07 160979.18 6.547165e+07 5.869174e+07 6.163703e+07 1.015490e+05 6.195245e+07 8.623133e+07 6.076226e+07 1.551014e+05 5.306944e+07 4.745466e+07 9.714871e+07 1.390561e+05 4.932085e+07 7.626921e+07 5.720374e+07 2.700888e+07 6.379974e+07 1.002269e+08 2.120350e+08 5.109845e+07 9.450283e+07 1.404184e+08 1.102465e+08 1.331058e+08 1.532170e+08 1.277625e+08 1.146803e+08 8.942772e+07 9.020466e+07 5.056316e+07 1.265846e+08 1.363179e+08 7.647661e+07 7.921374e+07 3.086397e+07 4.149792e+07 5.817433e+07 1.823919e+08 6.110307e+07 4.796781e+07 7.568499e+07 8.766580e+07 7.900678e+07 5.398049e+07 4.339031e+07 5.040382e+07 1.082110e+08 2.670692e+07 7.161143e+07 1.242572e+07 9.462468e+07 1.232771e+08 1.947828e+08 1.066021e+07 1.343665e+08 1.038318e+08 2.412541e+07 1.407711e+08 8.802263e+07 3.646344e+07 4.699927e+07 8.756497e+07 2.104320e+08 8.032296e+07 8.402328e+07 7.721684e+07 7.023283e+07 8.877818e+07 1.487984e+08 9.462346e+07 4.563791e+07 6.949943e+07 5.084491e+07 3.036398e+07 7.205411e+07 1.819007e+07 7.399777e+07 3.227382e+07 3.812557e+07 6.850067e+07 1.215402e+08 1.396669e+08 5.630903e+07 5.589250e+07 5.299667e+07 5.271696e+07 1.125628e+08 4.188226e+07 5.058310e+07 4.438040e+07 4.410501e+07 3.841173e+07 8.410695e+07 6.177878e+07 1.663945e+07 2.035822e+07 2.594395e+07 3.747956e+07 7.603216e+07 3.911871e+07 6.768036e+07 1.862896e+08 4.285823e+07 3.933595e+07 1.008949e+08 7.698748e+07 1.672351e+08 3.743757e+07 7.439629e+07 8.408393e+07 6.691498e+07 7.279151e+07 4.379367e+07 8.149557e+07 5.689499e+07 3.940288e+07 3.216434e+07 4.197644e+07 3.345246e+07 2.873694e+07 5.756755e+07 3.966609e+07 9.986346e+07 7.968946e+07 3.548348e+07 5.669091e+07 9.251566e+07 9.862896e+07 1.405330e+08 8.133263e+07 3.219113e+07 6.505534e+07 2.545332e+08 6.021243e+07 4.451720e+07 1.318064e+08 9.191073e+07 2.151760e+08 1.132337e+08 5.158459e+07 2.563425e+07 7.015619e+07 9.039471e+07 7.574586e+07 1.080690e+08 4.458545e+07 1.011897e+08 2.555562e+07 8.303838e+06 3.836595e+07 1.431629e+07 7.620127e+07 4.283440e+07 1.017212e+08 6.690530e+07 4.776361e+07 1.370477e+08 4.853595e+07 1.347847e+08 1.251623e+08 3.619554e+07 2.346132e+07 1.035000e+08 8.478748e+07 5.404554e+07 1.559691e+07 7.189690e+07 3.558193e+07 7.481206e+07 3.047111e+07 1.092868e+08 4.278767e+07 5.620800e+07 8.418849e+07 3.521728e+07 2.465949e+07 2.881477e+07 1.296492e+08 4.731804e+07 2.553795e+07 9.762158e+07 5.616485e+07 8.815428e+07 4.898999e+07 4.406667e+07 5.650181e+07 3.070640e+07 3.956032e+07 7.591224e+07 7.575766e+07 3.012640e+07 2.726501e+07 5.092816e+07 4.635329e+07 5.101207e+07 1.219192e+08 4.219635e+07 2.948576e+07 5.762270e+07 9.043227e+07 1.138139e+08 4.446939e+07 1.090081e+08 5.272802e+07 6.856597e+07 6.904793e+07 7.683606e+07 7.921437e+07 1.328033e+07 6.877152e+07 7.436876e+07 3.563212e+07 1.353016e+08 9.990864e+07 4.933551e+07 4.194375e+07 5.185626e+07 1.874789e+08 1.450551e+08 7.901875e+07 6.040277e+07 7.262563e+07 1.229055e+08 2.190573e+07 8.645218e+07 4.350338e+07 9.561986e+07 8.505847e+07 1.507465e+08 C5 H11 N O3_9.163 7.842058e+06 4.347328e+06 3.998382e+06 4.495710e+06 1.118935e+05 2.730248e+06 4.571132e+06 4.268872e+06 122270.91 4.222404e+06 3.950976e+06 3.716087e+06 91235.36 4.026991e+06 4.770565e+06 4.095884e+06 1.364463e+05 3.728401e+06 3.925192e+06 4.025800e+06 4.873714e+04 3.444208e+06 4.456567e+06 5.161159e+06 14386.856 3.553429e+06 3.883905e+06 3.820130e+06 1.619147e+04 3.899826e+06 3.905183e+06 4.524099e+06 83525.63 4.134554e+06 4.128504e+06 3.773295e+06 1.058279e+05 3.893232e+06 4.012306e+06 4.513947e+06 8.510281e+04 4.092611e+06 3.739631e+06 4.383968e+06 8.722793e+04 3.979938e+06 3.591104e+06 4.391193e+06 3.408798e+06 2.379712e+06 4.653039e+06 4.503124e+06 4.076052e+06 3.720462e+06 2.708629e+06 6.918424e+06 6.684628e+06 1.249484e+07 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8.824596e+06 5.755141e+06 3.189659e+06 1.354652e+07 1.637335e+07 C7 H12 N2 O3_9.208 2.949060e+05 7.979001e+05 5.851745e+05 7.501566e+05 1.808685e+05 5.178018e+05 6.401388e+05 8.223106e+05 180785.08 7.045102e+05 5.704624e+05 7.836021e+05 156977.55 6.791064e+05 7.313859e+05 6.421238e+05 2.185857e+05 6.152268e+05 6.775299e+05 6.461740e+05 7.914102e+04 6.235838e+05 7.382781e+05 8.035916e+05 23155.199 6.473982e+05 6.939809e+05 6.540779e+05 2.599176e+04 5.898515e+05 6.376471e+05 8.227741e+05 128822.61 6.360850e+05 7.008920e+05 6.321274e+05 8.538495e+04 6.600462e+05 8.461730e+05 6.225225e+05 1.434728e+05 5.890716e+05 7.110362e+05 7.045359e+05 1.414409e+05 6.731563e+05 5.797612e+05 7.655853e+05 1.700655e+05 1.741420e+05 5.551617e+05 6.588958e+05 1.927760e+05 3.034431e+05 1.401251e+06 4.710045e+05 3.418155e+05 9.390002e+05 7.091172e+05 1.066071e+06 7.513370e+05 6.770274e+05 8.344460e+05 7.004054e+05 1.084580e+06 1.065931e+06 7.662236e+05 5.280673e+05 5.299036e+05 9.494960e+05 1.113761e+06 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5.645849e+05 2.034609e+05 3.281899e+05 1.596821e+05 4.427542e+05 1.302719e+06 2.612948e+06 8.794396e+05 2.310318e+05 3.510423e+05 4.439401e+05 7.321588e+05 3.112981e+05 9.790636e+05 1.526990e+06 1.735485e+05 4.820679e+05 8.960306e+05 2.399022e+05 2.678943e+05 5.206044e+05 7.578408e+05 8.155815e+05 1.122467e+06 8.568900e+05 3.190728e+05 2.154795e+05 3.747964e+05 4.679390e+05 1.927733e+05 3.805367e+05 5.907501e+05 4.184805e+05 2.087779e+05 1.740386e+05 2.456506e+05 1.877162e+05 1.805508e+05 1.701750e+05 2.514986e+05 2.725175e+05 5.165164e+05 2.087212e+05 7.791605e+05 1.810677e+05 2.932410e+05 1.757092e+05 5.082486e+05 2.392645e+05 3.384975e+05 1.877467e+05 2.751237e+05 1.772482e+05 1.793550e+05 3.209902e+05 6.214365e+05 1.973286e+05 1.662314e+05 3.503419e+05 3.610861e+05 1.538859e+05 7.554464e+05 5.062137e+05 2.973169e+05 2.916484e+05 1.764787e+05 5.007328e+05 1.822065e+05 1.645704e+05 3.375372e+05 4.773656e+05 3.184585e+05 1.961766e+05 1.956204e+05 2.775859e+05 5.493283e+05 1.691297e+05 3.431160e+05 1.829350e+05 9.563810e+05 2.493373e+05 8.016622e+05 3.531660e+05 1.818428e+05 2.638782e+05 2.425643e+05 1.882634e+05 6.193202e+05 3.996521e+05 4.701818e+05 5.352260e+05 6.927631e+05 2.006211e+05 1.632415e+05 1.704216e+05 1.082476e+06 1.711641e+05 2.138486e+05 6.978015e+05 5.081327e+05 3.423360e+05 3.348366e+05 2.893900e+05 9.794748e+05 4.287392e+05 6.930536e+05 2.368803e+05 1.001037e+06 3.757594e+05 3.229678e+05 3.160181e+05 2.589357e+06 1.057736e+06 1.284660e+06 C6 H10 N2 O5_9.307 3.838701e+06 2.136097e+06 2.231109e+06 2.468529e+06 2.463695e+05 1.956210e+06 2.580817e+06 2.950926e+06 168948.70 1.966268e+06 2.431221e+06 2.553180e+06 138966.22 2.138152e+06 2.048677e+06 2.447312e+06 2.061361e+05 2.099118e+06 2.302806e+06 2.409800e+06 6.808025e+04 1.907591e+06 2.702589e+06 2.791888e+06 22388.616 2.089632e+06 2.259075e+06 2.377186e+06 2.240473e+04 2.013675e+06 2.273844e+06 2.357405e+06 114793.76 2.618644e+06 2.104000e+06 2.165215e+06 7.559090e+04 2.385736e+06 2.382212e+06 2.528006e+06 1.123462e+05 2.179525e+06 2.496930e+06 2.566948e+06 1.175031e+05 1.815217e+06 2.235826e+06 2.489645e+06 2.472720e+06 1.919996e+06 1.845540e+06 2.175959e+06 2.554746e+06 1.792469e+06 3.445060e+06 6.161396e+06 2.652016e+06 3.184376e+06 6.300906e+06 2.050787e+06 2.688812e+06 5.149250e+06 2.602942e+06 2.027171e+06 1.776320e+06 1.289972e+06 2.717628e+06 2.334146e+06 2.588418e+06 2.139044e+06 2.399563e+06 1.449277e+06 1.958116e+06 1.985199e+06 2.856993e+06 3.483164e+06 2.228276e+06 4.249106e+06 4.444432e+06 3.409375e+06 2.822629e+06 1.828423e+06 2.253854e+06 2.307267e+06 3.492856e+06 2.485723e+06 1.473168e+06 7.350439e+06 2.032211e+06 2.019414e+06 3.195439e+06 4.574255e+06 2.218803e+06 1.865007e+06 2.506180e+06 3.926873e+06 4.789767e+06 1.645276e+06 2.175862e+06 1.151828e+06 1.276455e+07 3.502424e+06 2.329742e+06 3.021285e+06 1.966372e+06 2.288732e+06 1.764066e+06 4.812700e+06 3.468889e+06 1.855233e+06 1.029851e+06 2.749975e+06 3.768197e+06 3.824183e+06 3.068692e+06 2.402062e+06 2.302623e+06 3.411017e+06 2.146087e+06 3.005598e+06 1.688880e+06 1.954598e+06 2.525511e+06 2.531659e+06 2.732835e+06 1.855039e+06 1.886605e+06 3.053605e+06 2.619916e+06 1.851246e+06 2.301781e+06 2.470740e+06 1.890931e+06 3.144986e+06 2.353950e+06 1.696013e+06 1.958706e+06 2.368909e+06 1.921245e+06 3.643568e+06 3.521518e+06 2.466151e+06 4.351801e+06 3.690105e+06 2.748449e+06 1.521819e+06 1.914029e+06 2.341935e+06 1.865546e+06 1.435644e+06 1.769777e+06 1.931357e+06 2.541759e+06 3.720763e+06 3.060064e+06 2.479644e+06 1.824989e+06 1.557519e+06 1.598789e+06 2.205136e+06 2.053066e+06 2.823283e+06 1.964620e+06 3.720584e+06 2.594406e+06 2.690558e+06 1.874951e+06 2.451797e+06 2.259012e+06 1.814095e+06 3.806136e+06 2.415660e+06 1.625062e+06 2.198373e+06 2.243862e+06 1.579703e+06 3.235115e+06 2.860907e+06 2.551426e+06 2.447163e+06 1.718504e+06 1.037371e+06 4.198085e+06 1.755052e+06 4.619653e+06 1.848108e+06 2.039942e+06 2.236063e+06 1.920342e+06 2.879357e+06 3.092273e+06 2.073126e+06 3.227105e+06 2.435957e+06 1.098411e+06 2.606038e+06 3.540904e+06 2.459346e+06 2.081843e+06 5.283959e+06 3.642036e+06 6.192927e+06 2.198602e+06 3.049850e+06 1.766613e+06 1.267018e+06 1.762502e+06 2.167878e+06 2.880405e+06 2.383308e+06 2.786918e+06 2.130756e+06 2.323547e+06 1.585205e+06 1.493485e+06 2.988797e+06 3.068599e+06 2.283636e+06 2.353983e+06 2.581998e+06 2.242361e+06 2.270180e+06 7.915208e+06 1.873692e+06 3.450806e+06 2.550233e+06 2.723610e+06 1.755659e+06 2.549168e+06 1.995842e+06 4.304877e+06 2.506676e+06 3.091276e+06 1.620220e+06 3.714742e+06 1.530474e+06 2.451900e+06 1.837917e+06 2.044956e+06 1.814666e+06 3.341079e+06 3.845479e+06 1.949955e+06 2.880313e+06 3.971578e+06 1.773787e+06 3.084263e+06 2.073146e+06 8.608634e+06 1.822508e+06 2.099044e+06 2.595324e+06 1.454971e+06 5.086850e+06 3.077958e+06 1.615281e+06 2.044311e+06 2.142164e+06 4.598227e+06 1.313664e+06 2.357434e+06 2.337804e+06 C9 H15 N3 O2 S_9.318 7.072266e+06 3.190794e+06 3.147542e+06 3.113902e+06 1.025118e+05 2.032621e+06 3.050298e+06 3.010076e+06 102672.41 2.734719e+06 3.215368e+06 3.344839e+06 84303.29 2.557443e+06 2.688748e+06 2.786418e+06 1.241872e+05 2.869295e+06 3.000489e+06 2.722698e+06 4.374837e+04 3.144449e+06 2.951047e+06 2.921837e+06 13651.564 3.132330e+06 2.451375e+06 3.125948e+06 1.562723e+04 3.488541e+06 2.593570e+06 3.071839e+06 96581.26 3.556250e+06 2.878634e+05 2.945819e+06 6.123197e+04 4.848745e+06 1.964046e+06 2.582891e+06 9.969272e+04 4.204087e+06 3.184797e+06 1.725625e+06 1.037414e+05 3.104109e+06 3.020197e+06 3.062584e+06 6.172270e+06 2.594822e+06 5.213302e+05 4.425492e+06 3.234169e+05 4.868477e+06 1.281681e+07 7.673442e+06 6.765268e+06 3.705461e+06 1.018167e+07 2.398972e+06 3.550089e+06 3.806515e+06 1.990434e+06 2.363129e+05 4.850442e+06 3.288876e+06 3.524632e+06 1.218261e+05 3.628411e+06 3.265147e+06 9.771066e+06 4.406786e+06 4.559888e+06 4.099829e+06 2.006559e+06 2.434631e+06 4.094613e+06 7.166059e+05 1.146437e+07 4.131377e+06 6.065712e+06 2.545295e+06 8.562436e+05 7.525800e+06 2.510819e+06 3.086426e+06 6.383015e+06 1.984624e+06 2.479047e+06 3.016447e+06 3.833655e+06 5.995397e+06 1.378509e+06 1.638466e+06 4.710999e+06 5.917519e+06 1.142596e+06 1.934972e+06 2.166315e+06 2.974151e+06 6.218222e+06 5.334257e+06 1.232791e+06 1.941457e+05 4.394311e+06 3.926091e+06 3.164508e+06 2.501523e+06 8.126638e+05 2.282927e+06 1.513398e+06 2.452416e+06 6.185436e+06 2.979803e+06 1.491423e+06 2.654032e+06 3.532517e+06 2.605628e+06 8.903673e+06 1.216897e+06 1.945143e+06 3.268333e+06 8.692127e+05 5.067689e+06 2.402823e+06 7.367843e+05 3.242816e+06 2.332310e+06 5.126999e+06 8.219452e+06 2.951165e+06 4.800682e+06 3.228102e+06 1.361754e+06 1.664474e+06 1.708875e+06 2.149021e+06 2.352770e+06 2.507969e+06 3.184850e+06 1.896366e+06 2.977540e+06 4.382906e+06 2.040129e+06 2.977735e+06 1.382621e+06 2.141803e+06 2.069591e+06 3.201944e+06 2.320578e+06 4.345024e+06 3.034002e+06 1.850074e+06 6.080924e+06 3.926254e+06 1.807898e+06 5.005887e+06 1.000332e+07 2.967252e+06 7.850606e+06 1.018070e+06 3.633678e+06 3.526168e+06 3.556887e+06 7.946462e+06 3.748872e+06 4.001893e+06 1.499761e+06 4.921220e+06 8.275732e+05 3.102998e+06 4.558738e+06 1.972536e+06 5.290074e+06 1.140609e+07 3.832692e+06 8.256106e+06 1.673210e+06 4.558973e+06 2.608478e+06 1.974447e+06 2.549645e+06 4.771671e+06 1.463826e+06 6.465284e+06 2.407804e+05 7.925267e+06 3.874503e+06 6.946562e+06 1.986893e+06 5.383292e+06 2.327480e+06 1.075084e+07 1.255785e+06 9.736959e+05 1.038717e+07 2.383495e+06 5.567294e+06 3.836435e+06 4.201828e+06 2.482974e+06 4.870569e+06 2.803728e+06 1.828750e+06 1.724475e+06 1.031397e+06 1.193058e+06 2.258323e+06 2.015473e+06 3.829384e+06 6.267465e+05 1.905197e+06 3.316910e+06 2.115113e+06 3.154413e+06 1.759292e+06 1.366723e+06 4.916635e+06 3.900457e+06 4.568525e+06 3.634324e+06 5.429324e+06 2.685435e+06 3.135404e+06 3.225394e+06 3.030020e+06 2.173184e+06 4.717632e+06 1.499113e+06 3.671801e+06 2.506949e+06 5.152783e+06 3.172942e+06 4.224725e+06 3.765426e+06 2.971251e+06 3.333668e+06 8.844644e+05 7.745148e+05 2.545553e+06 4.377532e+06 1.464662e+06 3.701177e+06 5.622849e+06 2.281787e+06 4.536546e+06 3.453561e+06 6.745786e+06 3.096485e+06 3.973548e+06 7.468748e+05 5.703836e+06 3.534164e+06 9.162332e+06 5.679881e+06 2.014402e+06 2.504640e+06 2.107432e+06 2.996901e+06 2.031122e+06 1.743799e+06 9.283489e+06 C9 H15 N3 O3 S_9.325 1.122657e+06 3.044238e+06 1.914584e+06 2.030151e+06 3.573495e+05 2.084254e+06 3.619801e+06 2.675739e+06 154735.67 2.723070e+06 3.097545e+06 2.487433e+06 104621.23 2.651399e+06 3.758578e+06 2.606611e+06 1.681967e+05 2.004836e+06 2.245240e+06 3.579934e+06 6.365196e+04 8.131581e+05 3.623082e+06 4.384337e+06 18038.111 1.631094e+06 3.314545e+06 2.527544e+06 1.765050e+04 8.701606e+05 3.246092e+06 3.297786e+06 67490.21 1.190196e+06 5.882353e+06 2.438646e+06 4.200553e+04 5.277223e+05 3.744584e+06 4.009136e+06 7.806574e+04 4.024803e+05 1.883689e+06 4.870845e+06 6.316366e+04 2.057585e+06 2.316184e+06 2.871457e+06 2.946416e+06 1.828539e+06 8.116382e+05 4.922261e+06 6.894559e+06 1.719590e+05 2.951567e+06 3.726528e+06 3.531348e+06 4.161661e+06 3.349715e+06 2.745481e+06 5.671880e+06 3.010470e+06 2.613995e+06 6.293618e+06 5.867979e+06 2.296125e+06 2.700101e+06 5.040906e+06 3.124097e+06 4.466634e+06 5.666690e+06 2.798556e+06 3.695629e+06 1.971339e+06 3.871652e+06 3.257467e+06 4.075053e+06 2.359233e+06 4.884068e+06 4.977852e+06 4.010362e+06 3.002321e+06 4.715888e+06 3.318017e+06 3.070396e+06 3.889711e+06 3.351075e+06 4.738883e+06 2.869952e+06 3.378746e+06 3.931260e+06 3.131704e+06 2.788778e+06 1.883499e+06 4.469961e+06 4.403480e+06 1.295092e+06 2.430224e+06 2.710613e+06 2.242372e+06 5.248419e+06 2.549604e+06 1.725493e+06 5.084110e+06 2.298110e+06 3.579765e+06 8.724800e+05 1.358943e+06 1.123351e+06 1.985091e+06 2.407236e+06 3.860377e+06 2.496584e+06 2.450092e+06 2.728597e+06 3.656790e+06 5.838643e+06 4.136495e+06 4.271435e+06 1.502581e+06 2.337142e+06 4.257699e+06 2.492989e+06 3.352367e+06 3.047592e+06 4.769719e+06 2.808120e+06 2.902977e+06 5.432629e+06 6.049101e+06 2.741618e+06 3.455241e+06 2.166931e+06 3.211409e+06 2.020123e+06 2.384786e+06 2.242010e+06 2.433311e+06 2.515945e+06 2.819023e+06 2.319162e+06 4.483083e+06 3.110854e+06 2.943525e+06 3.851880e+06 2.595157e+06 2.636741e+06 3.652234e+06 2.553993e+06 1.188470e+06 2.354504e+06 5.369457e+06 2.299550e+06 4.656242e+05 5.811826e+06 2.228562e+06 5.434335e+05 4.885791e+06 3.348467e+06 4.491615e+06 6.447686e+05 8.356794e+06 2.119255e+06 2.001226e+06 2.467926e+06 2.545278e+06 1.938161e+06 3.760966e+06 3.977080e+06 4.863828e+06 2.073086e+06 3.265538e+06 8.526127e+06 3.770780e+06 3.748954e+06 3.870268e+06 4.835442e+06 6.054756e+06 4.105091e+06 2.985167e+06 1.332123e+06 1.469333e+06 3.435642e+06 1.053060e+06 2.684063e+06 2.959339e+06 4.930769e+06 2.007775e+06 4.911909e+06 3.376713e+06 3.030741e+06 3.358701e+06 4.091636e+05 3.582650e+06 7.343146e+05 2.491122e+06 3.915837e+06 2.448527e+06 2.407369e+06 2.279383e+06 3.678955e+06 3.941525e+06 2.901462e+05 2.169443e+06 3.048303e+06 9.981621e+05 2.165356e+06 2.952761e+06 3.196192e+06 4.358870e+06 2.216343e+06 2.200858e+06 3.199474e+06 3.266607e+06 2.828402e+06 2.641970e+06 2.371654e+06 5.116639e+06 1.545834e+06 3.680030e+06 2.842413e+06 3.885605e+06 6.281594e+06 3.252882e+06 2.540578e+06 2.766421e+06 2.303101e+06 4.461623e+06 2.845509e+06 3.390415e+06 3.158021e+06 5.151646e+06 9.253711e+06 4.498106e+06 4.085283e+06 6.025302e+06 4.006808e+06 1.354162e+07 7.497439e+05 5.032790e+06 3.572495e+06 1.679396e+06 3.087702e+06 4.263838e+06 2.921558e+06 2.420603e+06 4.473304e+06 3.776758e+06 5.613523e+06 5.153004e+06 2.102156e+06 6.885429e+06 3.343800e+06 6.634162e+06 3.900172e+06 1.382305e+06 3.528349e+06 2.105279e+06 4.253788e+06 2.436074e+06 2.469260e+06 3.050875e+06 122.5416_9.33 1.059236e+06 2.915909e+06 1.857754e+06 1.982264e+06 3.646235e+05 1.999464e+06 3.548883e+06 2.524549e+06 161936.02 2.591550e+06 3.101752e+06 2.324038e+06 109112.07 2.288426e+06 3.630525e+06 2.928754e+06 1.717345e+05 1.851215e+06 2.203868e+06 3.202679e+06 6.838487e+04 8.462581e+05 3.620858e+06 4.179001e+06 20959.457 1.349204e+06 3.032790e+06 2.842926e+06 1.896223e+04 8.835256e+05 2.969119e+06 3.074894e+06 71984.44 1.198299e+06 5.715408e+06 2.444235e+06 4.456409e+04 5.018119e+05 3.338174e+06 3.616947e+06 7.972645e+04 3.508128e+05 2.519142e+06 4.363899e+06 6.374633e+04 2.141095e+06 1.989885e+06 2.833788e+06 2.666607e+06 1.682953e+06 8.381119e+05 4.309594e+06 6.660402e+06 1.827572e+05 2.699976e+06 4.665329e+06 3.454559e+06 3.924779e+06 3.061665e+06 2.622229e+06 6.153587e+06 2.892219e+06 2.462811e+06 5.945614e+06 5.968833e+06 2.094039e+06 2.654126e+06 4.615350e+06 2.998338e+06 4.283488e+06 5.057552e+06 2.777563e+06 2.881099e+06 1.918463e+06 3.719628e+06 4.487769e+06 4.165639e+06 2.305608e+06 4.072544e+06 4.553739e+06 4.542589e+06 3.548568e+06 4.339593e+06 3.163112e+06 2.830944e+06 4.797207e+06 3.293798e+06 6.462418e+06 2.723100e+06 3.287236e+06 3.459602e+06 3.118260e+06 2.980987e+06 1.783996e+06 3.108437e+06 3.708948e+06 1.173969e+06 1.897772e+06 2.326585e+06 1.922345e+06 4.737633e+06 2.357980e+06 1.804421e+06 4.793827e+06 2.025140e+06 4.618044e+06 8.287175e+05 1.510474e+06 1.144011e+06 2.434190e+06 2.341506e+06 3.595249e+06 2.404227e+06 2.165566e+06 4.158681e+06 3.020028e+06 5.759230e+06 4.198645e+06 3.451691e+06 1.392357e+06 2.682605e+06 3.460510e+06 2.431030e+06 3.247552e+06 3.740377e+06 4.473204e+06 2.610753e+06 2.815824e+06 5.301713e+06 5.782835e+06 3.134874e+06 2.475529e+06 2.115562e+06 2.936929e+06 1.844994e+06 2.103980e+06 2.022235e+06 2.430000e+06 2.705062e+06 2.818520e+06 2.293442e+06 4.264406e+06 2.821732e+06 2.977864e+06 2.776409e+06 2.505944e+06 2.241132e+06 3.358614e+06 2.305823e+06 1.101610e+06 2.017495e+06 5.071015e+06 2.297864e+06 3.263102e+05 5.780969e+06 2.079341e+06 5.418489e+05 5.323589e+06 2.905918e+06 4.077895e+06 6.479976e+05 7.711728e+06 1.949362e+06 1.946922e+06 2.383947e+06 2.373083e+06 1.674140e+06 4.044903e+06 3.470719e+06 4.847497e+06 1.836499e+06 2.720284e+06 8.016363e+06 3.655268e+06 3.209737e+06 3.613230e+06 4.080018e+06 5.572783e+06 3.607281e+06 2.692411e+06 1.139870e+06 1.453369e+06 4.081002e+06 1.034440e+06 2.716195e+06 2.876420e+06 4.695952e+06 2.086499e+06 4.480121e+06 2.249044e+06 3.785180e+06 2.372865e+06 1.121828e+06 4.206754e+06 6.553014e+05 2.422142e+06 3.318238e+06 2.357567e+06 2.213228e+06 2.060594e+06 2.680116e+06 3.800569e+06 2.883399e+05 1.935391e+06 3.089849e+06 9.793062e+05 2.073875e+06 2.860816e+06 3.054414e+06 4.244706e+06 2.228837e+06 2.057706e+06 3.129817e+06 3.163760e+06 2.482767e+06 2.417833e+06 2.362534e+06 4.529918e+06 1.297081e+06 3.756762e+06 2.683667e+06 3.469963e+06 6.003257e+06 2.836455e+06 2.251062e+06 2.575324e+06 2.182929e+06 3.739769e+06 2.357139e+06 3.062357e+06 2.996569e+06 4.613424e+06 8.574884e+06 4.084797e+06 4.212053e+06 4.895560e+06 3.632803e+06 1.075134e+07 7.206067e+05 4.423494e+06 2.945356e+06 1.678575e+06 2.903621e+06 3.697310e+06 2.710646e+06 2.645262e+06 4.159490e+06 2.397073e+06 4.992378e+06 4.522127e+06 1.923167e+06 5.538993e+06 2.648773e+06 5.927653e+06 2.718517e+06 1.327208e+06 3.411679e+06 2.043043e+06 3.605054e+06 2.284691e+06 2.404154e+06 2.799044e+06 C5 H14 N O6 P_9.346 3.785341e+05 1.441066e+06 1.610865e+06 1.507435e+06 1.368155e+05 1.072135e+06 1.659273e+06 1.898539e+06 118815.37 1.219277e+06 1.466518e+06 1.815684e+06 92542.19 1.216974e+06 1.401104e+06 1.729075e+06 1.339949e+05 1.165809e+06 1.435330e+06 1.708397e+06 4.899056e+04 1.151980e+06 1.464397e+06 2.014099e+06 16838.546 1.385558e+06 1.272895e+06 1.625278e+06 1.551871e+04 1.122950e+06 1.528817e+06 1.913191e+06 83223.88 1.264710e+06 1.416228e+06 1.698516e+06 5.364104e+04 1.203407e+06 1.457590e+06 1.765307e+06 9.149812e+04 1.196532e+06 1.559502e+06 1.765308e+06 8.523273e+04 1.228826e+06 1.274790e+06 1.656801e+06 6.527691e+05 5.181448e+05 8.010468e+05 3.842579e+06 9.801505e+05 2.118314e+06 1.474200e+06 2.813550e+06 1.986293e+06 3.746269e+06 2.417413e+06 2.246653e+06 1.180232e+06 1.132641e+06 1.149849e+06 1.970933e+06 2.193706e+06 7.627511e+05 1.618134e+06 5.786997e+05 1.095510e+06 6.970423e+05 3.797236e+06 1.191292e+06 1.035592e+06 2.487968e+06 1.671477e+06 2.738359e+06 1.125263e+06 1.795583e+06 3.647839e+06 3.665317e+06 9.127271e+05 1.561013e+06 6.197907e+05 1.428626e+06 1.035568e+06 1.819213e+06 5.048269e+05 7.194842e+05 7.746280e+05 9.981117e+05 1.070683e+06 3.490887e+06 1.221350e+06 1.330405e+06 1.172192e+06 3.037378e+06 2.841895e+06 5.900570e+05 2.760421e+06 9.452250e+05 1.018404e+06 2.218907e+06 8.665857e+05 2.308006e+06 6.410994e+05 8.449896e+05 9.826682e+05 1.060068e+06 7.279933e+05 1.023249e+06 8.134386e+05 1.326502e+06 1.160399e+06 2.215745e+06 4.882247e+06 7.736434e+05 2.218107e+06 8.199325e+05 1.756457e+06 1.575135e+06 5.551081e+05 6.071553e+05 7.441621e+05 1.480516e+06 1.426304e+06 9.038287e+05 1.563956e+06 3.767457e+05 1.208118e+06 1.160154e+06 7.390406e+05 1.538773e+06 6.408498e+05 1.464890e+06 9.474101e+05 6.022629e+05 1.804281e+06 9.020010e+05 1.130283e+06 1.332219e+06 1.253514e+06 1.537788e+06 1.136323e+06 1.099904e+06 2.534862e+06 1.341007e+06 9.297839e+05 1.186182e+06 1.759027e+06 8.182423e+05 8.478713e+05 9.218772e+05 1.313475e+06 1.009945e+06 1.119237e+06 1.121501e+06 1.022210e+06 1.365619e+06 1.303864e+06 1.073593e+06 1.210174e+06 1.110107e+06 1.518779e+06 1.063088e+06 9.371055e+05 1.322423e+06 1.067659e+06 1.260863e+06 1.078545e+06 1.550008e+06 1.194579e+06 1.911759e+06 1.303909e+06 6.441437e+05 7.550601e+05 1.835418e+06 2.443522e+06 1.367411e+06 1.535191e+06 1.913630e+06 2.415378e+06 7.758245e+05 1.389419e+06 1.362672e+06 1.878190e+06 1.148809e+06 1.637412e+06 6.660270e+05 7.978376e+05 7.582414e+05 5.458865e+05 2.253132e+06 1.041231e+05 2.077940e+06 6.705798e+05 8.816502e+05 1.813159e+06 1.565046e+06 7.541215e+05 6.289091e+05 1.643984e+06 5.751684e+05 5.802549e+05 1.529449e+06 1.321056e+06 3.781791e+06 5.590541e+05 4.877472e+05 6.887067e+05 1.941116e+06 7.907662e+05 8.544486e+05 6.887277e+05 8.553797e+05 2.118118e+06 1.447363e+06 6.429746e+05 5.591052e+05 1.517516e+07 8.952123e+05 6.979763e+05 1.882824e+06 7.160294e+05 5.010553e+05 1.169091e+06 8.810652e+05 2.707066e+06 2.354457e+06 2.064684e+06 1.786733e+06 4.518885e+06 1.287497e+06 1.280061e+06 8.102878e+05 1.061367e+06 6.030879e+05 1.222280e+06 8.719371e+05 9.883420e+05 1.318194e+06 2.521011e+06 7.648388e+05 8.648672e+05 1.779850e+06 1.510338e+06 1.792985e+06 1.978617e+06 1.275115e+06 1.110811e+06 1.242228e+06 1.219474e+06 9.461583e+05 1.299093e+06 1.597342e+06 1.803643e+06 2.563415e+06 8.839837e+05 1.375755e+06 1.560487e+06 1.294892e+06 1.143866e+06 1.569294e+06 METHIONINE SULFOXIDE 8.590663e+06 2.372822e+07 3.037263e+07 2.467605e+07 1.650517e+05 1.751032e+07 2.938254e+07 2.980304e+07 159956.90 2.626279e+07 2.456111e+07 2.915163e+07 137139.29 2.318825e+07 1.750155e+07 2.692511e+07 6.670263e+05 2.625343e+07 2.653471e+07 2.640483e+07 7.156723e+04 2.270939e+07 2.596417e+07 3.072861e+07 24155.771 2.351457e+07 2.571370e+07 2.414849e+07 3.634304e+04 2.412584e+07 2.594520e+07 2.727260e+07 116697.20 2.457979e+07 2.707551e+07 2.312752e+07 7.503776e+04 2.560121e+07 2.496202e+07 2.875714e+07 1.244634e+05 2.248615e+07 2.859048e+07 2.657356e+07 1.155582e+05 2.073487e+07 2.509846e+07 2.730760e+07 1.351541e+07 1.262644e+07 3.159934e+07 2.844669e+07 1.470275e+07 3.840390e+07 2.212842e+07 4.831933e+07 7.678190e+07 9.561604e+07 4.907238e+07 4.069661e+07 1.396429e+07 3.048211e+07 3.202928e+07 3.091194e+07 1.864856e+07 2.909877e+07 5.205567e+07 5.792243e+07 7.418629e+07 3.730436e+07 2.183147e+07 6.453586e+07 2.862806e+07 1.276205e+07 3.769483e+07 4.465173e+07 1.017402e+07 6.129482e+07 8.008574e+07 4.804914e+07 2.165999e+07 1.102560e+07 1.349499e+07 4.200090e+07 2.576263e+07 2.733683e+07 1.911365e+07 2.451078e+07 2.075105e+07 2.801231e+07 9.862859e+06 5.110537e+07 3.019226e+07 2.408244e+07 1.105432e+07 2.937304e+07 2.800716e+07 2.501004e+07 2.238195e+07 1.876470e+07 3.139974e+07 3.545185e+07 3.333940e+07 2.995687e+07 1.375829e+07 1.650565e+07 3.088540e+07 4.384051e+07 9.623514e+06 2.077827e+07 1.879754e+07 1.176613e+07 1.478645e+07 1.953866e+07 2.521744e+07 2.640548e+07 1.227609e+07 1.545810e+07 4.819442e+07 2.963371e+07 2.557729e+07 4.095430e+07 6.012803e+07 8.400744e+06 3.864225e+07 1.485137e+07 1.331031e+07 8.878819e+06 3.942769e+07 1.088650e+07 1.439183e+07 5.238717e+07 2.592263e+07 6.267044e+07 3.183101e+07 1.962757e+07 2.520287e+07 1.677735e+07 2.245719e+07 3.286446e+07 2.019729e+07 1.350833e+07 2.081821e+07 5.067066e+07 4.409693e+07 2.568868e+07 4.263548e+07 5.288273e+07 8.055825e+06 5.143615e+07 1.319762e+07 1.718215e+07 5.188757e+07 1.479459e+07 4.320710e+07 3.081420e+07 7.476375e+07 1.476867e+07 1.064242e+07 2.839348e+07 2.239163e+07 1.451518e+07 1.530025e+07 2.241001e+07 7.978827e+06 1.600029e+07 9.570058e+06 9.821655e+06 3.112587e+07 1.768067e+07 1.065952e+07 1.719786e+07 5.193290e+07 9.413805e+06 1.025370e+07 1.572335e+07 5.944096e+07 1.842740e+07 2.880695e+07 2.515265e+07 5.763525e+06 6.162743e+06 1.086461e+07 1.696435e+07 4.718489e+06 8.192703e+06 9.964647e+06 1.278587e+07 8.653772e+06 1.996080e+07 9.562185e+06 8.614549e+06 1.813461e+07 2.089138e+07 4.619305e+06 1.845201e+07 1.466495e+07 4.388057e+06 2.061299e+07 1.317066e+07 1.579804e+07 1.150781e+07 6.435509e+06 2.584370e+07 8.915104e+06 2.253648e+07 1.295548e+07 1.946587e+07 1.029673e+07 7.130406e+06 6.645896e+07 2.638622e+07 1.765100e+07 9.516481e+06 3.646094e+06 1.828270e+07 1.019087e+07 7.010673e+06 2.510976e+07 1.160469e+07 2.492677e+07 4.937977e+07 3.240439e+07 4.129296e+06 1.326589e+07 7.530166e+06 2.776482e+07 1.352157e+07 1.657189e+07 4.774605e+07 9.460595e+06 4.281771e+06 2.045781e+07 1.504041e+07 1.801055e+07 1.706308e+07 2.988481e+07 1.065247e+07 1.644909e+07 5.381974e+07 1.439540e+07 8.188816e+06 6.166002e+06 1.624392e+07 2.162911e+07 1.163377e+07 1.334581e+07 1.265894e+07 2.389235e+07 1.200917e+07 2.020270e+07 2.252372e+07 2.788180e+07 5.403243e+07 2.269622e+07 1.205737e+07 3.392045e+07 2.948031e+07 1.002697e+07 5.802910e+06 2.355984e+07 3.570125e+07 C6 H5 Cl N2 O4 S_9.393 3.029678e+06 2.871976e+06 2.865631e+06 3.132137e+06 8.157765e+04 1.516039e+06 3.023269e+06 2.627955e+06 86104.24 2.414755e+06 2.933413e+06 2.924633e+06 76349.22 2.869607e+06 2.285789e+06 2.390343e+06 4.004438e+05 2.799522e+06 2.421899e+06 2.314428e+06 4.444055e+04 2.984601e+06 2.978703e+06 3.313976e+06 16251.762 2.299586e+06 2.737145e+06 2.258163e+06 1.539329e+04 2.480707e+06 2.507354e+06 3.458166e+06 75868.86 2.600425e+06 2.391886e+06 2.464123e+06 4.457945e+04 1.928819e+06 3.832360e+06 2.909031e+06 6.395772e+04 2.146055e+06 2.578600e+06 3.353138e+06 7.168509e+04 1.894350e+06 3.175535e+06 2.321463e+06 2.226110e+06 2.972612e+06 3.546760e+06 2.630959e+06 2.402836e+06 3.851129e+06 3.348284e+06 3.658908e+06 3.387201e+06 2.521911e+06 3.925481e+06 3.860196e+06 4.148541e+06 2.461585e+06 3.199545e+06 2.920164e+06 2.931981e+06 2.779601e+06 2.664986e+06 2.801564e+06 3.011605e+06 3.353271e+06 2.759747e+06 2.782711e+06 3.143694e+06 3.719446e+06 2.612345e+06 3.090843e+06 2.691398e+06 1.992305e+06 2.912254e+06 2.266377e+06 2.963395e+06 2.376001e+06 2.796807e+06 3.639619e+06 2.333611e+06 2.079566e+06 2.217598e+06 2.854397e+06 2.701933e+06 2.723613e+06 2.818480e+06 2.187525e+06 4.187320e+06 2.027427e+06 3.417451e+06 3.312878e+06 2.422789e+06 1.802186e+06 4.509001e+06 2.723397e+06 2.860532e+06 2.943046e+06 2.372024e+06 2.819340e+06 3.040326e+06 2.839651e+06 2.713830e+06 2.535020e+06 2.691062e+06 1.914507e+06 3.176137e+06 2.566938e+06 2.944927e+06 2.514738e+06 4.538904e+06 2.158995e+06 2.959219e+06 1.793937e+06 2.555787e+06 2.603708e+06 2.167240e+06 2.188560e+06 2.416863e+06 3.283402e+06 2.727464e+06 2.028087e+06 2.974088e+06 2.009970e+06 3.070754e+06 2.439454e+06 3.148272e+06 1.924681e+06 1.845938e+06 2.589068e+06 2.371836e+06 3.330011e+06 2.427860e+06 2.215958e+06 2.330693e+06 2.163071e+06 2.655780e+06 2.624250e+06 2.481046e+06 1.995334e+06 2.038915e+06 2.728680e+06 2.011155e+06 2.571315e+06 2.257216e+06 2.009088e+06 2.445294e+06 1.536195e+06 3.205104e+06 4.698921e+06 3.366660e+06 2.511446e+06 1.080179e+06 2.363429e+06 2.764544e+06 2.058191e+06 3.120988e+06 2.444578e+06 2.968099e+06 2.043805e+06 2.446367e+06 2.794093e+06 2.598490e+06 3.073258e+06 2.397843e+06 2.795072e+06 2.040017e+06 3.687784e+06 2.333445e+06 2.229820e+06 2.412715e+06 2.962500e+06 3.567388e+06 2.906376e+06 2.737760e+06 2.755491e+06 2.913623e+05 2.150738e+06 3.276231e+06 1.383676e+06 2.669098e+06 2.464553e+06 2.632874e+06 2.982327e+06 3.142578e+06 2.396119e+06 2.518312e+06 2.893446e+06 1.398019e+05 2.989063e+06 2.209092e+06 2.603415e+06 2.880552e+06 3.240969e+06 2.840799e+06 2.950048e+06 2.980329e+06 3.016506e+06 3.056039e+06 2.254652e+06 1.850009e+06 3.979146e+06 2.178456e+06 2.466292e+06 2.126262e+06 3.137730e+06 2.543360e+06 2.271504e+06 2.460997e+06 3.162285e+06 2.721219e+06 3.209449e+06 2.509290e+06 3.078569e+06 1.497380e+05 2.630151e+06 2.502659e+06 2.154663e+06 2.749961e+06 1.971594e+06 2.594734e+06 2.182557e+06 2.427348e+06 2.076397e+06 3.038077e+06 2.174130e+06 3.931409e+06 1.963896e+06 2.447711e+06 3.106135e+06 1.816745e+06 2.570499e+06 3.073144e+06 2.359023e+06 2.061669e+06 2.688453e+06 4.509633e+06 2.526184e+06 2.667946e+06 2.338661e+06 2.530649e+06 2.065206e+06 3.090542e+06 3.107623e+06 1.837441e+06 3.015295e+06 2.511572e+06 3.044491e+06 2.826417e+06 2.493835e+06 3.164619e+06 4.761253e+06 2.352876e+06 2.156069e+06 2.833782e+06 1.850212e+06 2.925601e+06 3.666131e+06 C8 H19 N O5_9.393 5.883073e+05 1.538257e+07 2.133877e+07 1.944183e+07 1.814875e+05 1.441104e+07 2.031970e+07 1.942727e+07 156408.04 1.909063e+07 1.945392e+07 1.829740e+07 131569.62 1.520682e+07 1.879460e+07 1.833154e+07 6.168527e+05 1.870772e+07 1.841436e+07 1.948033e+07 7.008927e+04 1.663053e+07 1.924317e+07 4.197577e+05 26108.716 1.866303e+07 1.769596e+07 1.825380e+07 2.294759e+04 1.838361e+07 1.802897e+07 1.599447e+07 114754.97 2.109216e+07 1.915055e+07 1.596071e+07 7.211898e+04 2.031949e+07 1.700023e+07 1.886693e+07 1.149268e+05 1.834256e+07 2.076828e+07 1.562250e+07 1.230042e+05 1.969218e+07 1.614928e+07 1.986856e+07 2.363317e+06 3.936904e+05 4.341482e+05 2.950118e+05 4.795247e+05 5.009002e+05 4.758046e+05 3.808248e+05 5.388593e+05 4.505292e+05 5.141461e+05 2.581518e+05 4.389461e+05 5.237359e+05 4.734101e+05 4.711363e+05 2.538951e+05 7.857022e+05 4.874352e+05 3.889694e+05 4.208561e+05 3.750434e+05 2.356327e+05 4.664013e+05 4.779473e+05 2.567367e+05 4.745426e+05 2.997000e+05 3.889697e+05 3.551823e+05 6.005746e+05 3.693630e+05 3.087606e+05 6.913925e+07 3.565617e+05 3.514290e+05 4.857065e+05 4.488013e+05 4.057096e+05 3.574309e+05 4.380858e+05 5.482429e+05 3.979393e+05 2.319869e+05 3.695542e+05 5.164342e+05 4.546083e+05 3.013089e+05 2.695662e+05 5.174412e+05 1.548320e+05 4.585324e+05 3.810167e+05 3.102890e+05 4.829306e+05 3.274076e+05 4.176422e+05 4.013305e+05 4.315884e+05 4.535656e+05 4.863483e+05 3.740656e+05 3.815663e+05 3.498690e+05 3.600534e+05 2.809803e+05 8.508472e+06 4.489278e+05 3.753798e+05 3.230072e+05 4.491906e+05 5.389624e+05 3.612341e+05 4.191587e+05 4.102352e+05 4.018865e+05 3.950601e+05 4.446678e+05 3.664193e+05 4.027171e+05 4.219437e+05 4.039740e+05 6.191021e+05 5.570256e+05 4.113241e+05 3.400807e+05 4.784936e+05 4.204747e+05 3.890246e+05 5.085744e+05 4.873513e+05 4.859734e+05 3.643706e+05 4.371049e+05 3.719364e+05 3.772219e+05 5.169927e+05 3.796323e+05 3.335862e+05 4.297717e+05 3.483232e+05 3.485638e+05 3.780642e+05 3.894742e+05 3.779089e+05 4.113581e+05 4.081958e+05 5.088768e+05 4.012699e+05 3.883289e+05 3.045461e+05 3.622699e+05 4.874403e+05 3.826515e+05 4.091986e+05 4.573966e+05 3.759600e+05 4.539469e+05 4.974262e+05 3.708200e+05 4.205636e+05 3.672444e+05 4.006557e+05 4.059401e+05 4.824598e+05 3.547952e+05 5.131627e+05 3.170986e+05 4.546556e+05 3.544204e+05 5.500843e+05 2.226017e+05 1.743855e+05 1.535125e+06 4.051859e+05 2.687875e+05 2.986533e+06 3.109598e+05 4.407370e+05 5.352901e+05 3.851976e+05 8.702132e+05 3.624024e+05 2.992169e+05 1.494364e+06 7.092627e+07 1.182827e+06 2.268113e+06 3.947570e+05 4.020000e+05 4.393090e+05 3.941010e+05 3.550915e+05 2.882644e+05 4.508587e+05 3.977924e+05 3.488473e+06 3.153573e+05 4.059909e+05 1.868611e+09 3.026701e+05 5.245687e+05 3.077678e+06 6.594972e+05 3.171854e+05 3.586899e+05 3.628199e+05 3.693472e+06 3.930624e+05 3.338483e+05 2.838915e+05 4.307218e+05 9.148992e+06 9.963714e+05 3.685034e+07 3.476467e+05 2.809574e+05 3.588181e+05 3.858605e+05 9.229658e+05 8.580153e+05 4.302577e+05 9.423491e+05 3.203398e+05 4.885968e+05 3.242535e+05 2.994772e+05 4.636439e+05 4.365056e+05 4.628627e+05 4.054046e+05 4.102134e+05 3.871515e+05 3.511410e+05 3.927728e+05 4.248946e+05 2.995874e+05 2.730642e+05 3.913132e+05 3.383988e+05 3.524865e+05 2.984806e+05 3.857755e+05 4.092355e+05 3.299206e+05 3.530991e+05 3.732555e+05 1.710544e+05 4.187154e+05 3.982711e+05 4.707014e+05 3.201442e+05 5.393069e+05 4.490010e+05 C31 H11 N6 O P S_9.451 3.079479e+06 3.285240e+06 2.935478e+06 2.713919e+06 9.367221e+04 2.058817e+06 2.748083e+06 2.521904e+06 103135.03 3.252968e+06 2.731264e+06 4.013091e+06 82320.19 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5.022066e+06 6.313567e+06 5.532699e+06 7.454228e+06 7.161595e+06 C5 H15 N8 O6 P S_9.46 1.408468e+07 8.187447e+06 9.594637e+06 8.029019e+06 9.055325e+04 7.424532e+06 8.571507e+06 9.668150e+06 100292.80 8.083272e+06 8.892148e+06 8.612698e+06 81595.92 8.631378e+06 7.853814e+06 8.091541e+06 1.684941e+05 7.782464e+06 8.108821e+06 9.239241e+06 4.721567e+04 8.311628e+06 9.970325e+06 8.465670e+06 15435.614 9.071320e+06 6.934859e+06 6.931853e+06 1.838725e+04 8.315482e+06 9.607831e+06 1.146541e+07 80984.86 6.904578e+06 7.994314e+06 7.224283e+06 4.747071e+04 7.973615e+06 8.830795e+06 9.683318e+06 7.082736e+04 8.279299e+06 8.002636e+06 9.598313e+06 7.112956e+04 8.359840e+06 7.849682e+06 8.427142e+06 5.949139e+06 1.306885e+07 9.703861e+06 8.711675e+06 9.867165e+06 6.789357e+06 1.449440e+07 1.097472e+07 1.425979e+07 1.746062e+07 1.529880e+07 6.742752e+06 1.741682e+07 1.664929e+07 8.477125e+06 1.436374e+07 4.679282e+06 6.088892e+06 1.405903e+07 1.008277e+07 1.125073e+07 1.020751e+07 7.330830e+06 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7.281813e+06 8.778834e+06 7.059820e+06 3.584269e+06 9.399291e+06 1.259663e+06 6.568578e+06 1.218198e+07 7.652478e+06 6.481976e+06 1.059394e+07 9.317459e+06 1.316914e+07 7.165484e+06 7.805762e+06 8.440438e+06 7.591715e+06 1.092470e+07 1.009790e+07 7.785249e+06 3.748667e+06 1.131896e+07 7.159587e+06 9.379820e+06 5.719903e+06 9.250920e+06 1.270347e+07 6.744352e+06 5.279317e+06 6.088616e+06 1.615798e+06 7.951625e+06 9.654138e+06 1.445115e+07 8.471774e+06 1.579135e+07 1.249113e+07 C8 H7 N3 O4 S_9.46 2.249836e+07 1.611996e+07 1.816680e+07 1.425005e+07 1.068928e+05 1.121229e+07 1.743331e+07 1.436336e+07 126768.58 1.411261e+07 1.667207e+07 1.930666e+07 102034.75 1.346534e+07 1.419744e+07 1.294094e+07 5.324269e+05 1.557868e+07 1.470845e+07 1.431499e+07 5.497267e+04 1.528775e+07 1.698121e+07 1.908363e+07 17578.011 1.297065e+07 1.538902e+07 1.541255e+07 1.898848e+04 1.408099e+07 1.395460e+07 1.769862e+07 94612.64 1.502449e+07 1.513993e+07 1.417445e+07 6.126985e+04 1.430279e+07 1.701276e+07 1.105697e+07 9.172100e+04 1.843472e+07 1.732451e+07 1.667879e+07 8.800129e+04 1.225654e+07 1.462120e+07 1.622875e+07 1.169738e+07 1.854785e+07 1.280279e+07 8.939439e+06 2.133110e+07 3.173140e+07 2.629909e+07 1.534081e+07 1.853780e+07 2.295198e+07 2.624174e+07 1.258761e+07 1.692972e+07 1.884690e+07 2.099941e+07 1.864808e+07 1.217965e+07 1.069661e+07 1.832841e+07 2.027509e+07 1.844321e+07 1.551130e+07 1.154567e+07 2.038663e+07 1.969015e+07 1.132005e+07 1.956146e+07 1.136234e+07 1.620577e+07 1.490686e+07 2.851189e+07 1.949826e+07 1.426099e+07 1.265329e+07 1.639703e+07 1.665936e+07 2.176690e+07 1.438161e+07 1.330304e+07 1.348762e+07 1.419846e+07 1.335461e+07 1.743160e+07 8.902270e+06 1.570129e+07 1.948060e+07 1.761063e+07 1.284650e+07 1.070703e+07 1.625893e+07 5.581693e+06 1.916172e+07 2.233065e+07 1.330267e+07 1.657854e+07 1.498975e+07 1.810727e+07 1.760898e+07 1.898554e+07 1.613148e+07 2.407778e+07 1.479814e+07 1.515038e+07 1.324293e+07 2.007515e+07 8.526005e+06 5.107138e+06 1.663660e+07 1.010928e+07 1.450961e+07 2.039688e+07 2.021789e+07 9.328151e+06 1.548682e+07 1.627272e+07 1.768637e+07 1.718676e+07 2.029059e+07 1.483758e+07 1.420684e+07 1.565578e+07 1.201242e+07 2.435778e+07 1.972251e+07 8.738138e+06 1.465931e+07 2.166944e+07 1.845192e+07 1.505028e+07 1.668151e+07 1.866263e+07 1.864263e+07 1.308371e+07 1.753515e+07 1.705956e+07 1.593625e+07 1.943203e+07 1.366236e+07 1.457446e+07 1.209326e+07 1.917155e+07 1.406386e+07 1.255033e+07 1.226475e+07 1.361517e+07 2.286377e+07 1.621027e+07 2.086515e+07 2.625812e+07 1.596502e+07 8.721302e+06 1.017994e+07 2.203298e+07 1.617375e+07 1.683230e+07 1.443076e+07 1.428316e+07 5.417701e+06 2.996112e+07 1.481939e+07 1.523919e+07 1.576554e+07 1.838343e+07 1.127313e+07 1.245137e+07 1.586761e+07 1.559965e+07 5.796169e+06 2.267960e+07 1.599038e+07 1.365464e+07 1.180346e+07 6.831909e+06 1.965741e+07 1.658487e+07 1.332372e+07 5.968951e+06 1.228946e+07 1.927861e+07 1.524009e+07 1.700312e+07 1.400665e+07 1.465546e+07 1.370541e+07 1.602188e+06 1.376642e+07 1.053077e+07 1.148157e+07 1.188443e+07 1.669664e+07 1.952276e+07 1.896804e+07 1.567741e+07 1.118081e+07 2.745163e+07 1.982979e+07 9.208770e+06 3.939964e+06 1.898130e+07 1.310616e+07 8.025226e+06 1.016427e+07 1.369960e+07 1.609831e+07 1.331634e+07 1.266742e+07 2.583735e+06 1.096201e+07 1.439015e+07 1.242445e+07 7.279914e+05 1.731174e+07 1.407494e+07 1.579340e+07 1.456274e+07 5.775864e+06 1.003227e+07 8.777744e+06 1.808845e+07 1.464842e+07 1.064949e+07 1.810401e+07 4.626760e+06 1.316469e+07 2.052719e+07 1.285107e+07 9.980891e+06 2.044897e+07 2.002765e+07 1.930863e+07 1.682611e+07 1.599453e+07 1.606597e+07 1.335177e+07 1.656359e+07 1.737630e+07 1.410212e+07 9.581578e+06 1.529777e+07 1.045989e+07 1.256067e+07 1.083769e+07 1.604547e+07 1.760074e+07 1.210039e+07 1.527901e+07 1.541025e+07 5.078873e+06 1.632917e+07 1.749767e+07 2.007723e+07 1.866809e+07 2.314467e+07 1.998212e+07 120.50738_9.46 2.728995e+07 1.873350e+07 2.033040e+07 1.717396e+07 1.944660e+05 1.185847e+07 1.990241e+07 1.739415e+07 226892.56 1.431966e+07 1.965067e+07 2.178359e+07 177995.92 1.548297e+07 1.630661e+07 1.475565e+07 6.734334e+05 1.741397e+07 1.706100e+07 1.790068e+07 9.590768e+04 1.651400e+07 1.957709e+07 2.047792e+07 30289.344 1.463845e+07 1.824962e+07 1.805587e+07 3.403346e+04 1.565138e+07 1.577579e+07 1.955819e+07 163468.21 1.685570e+07 1.724039e+07 1.720138e+07 9.990700e+04 1.736845e+07 1.770783e+07 1.282570e+07 1.502989e+05 2.154985e+07 1.924438e+07 1.881034e+07 1.509936e+05 1.437880e+07 1.695281e+07 1.816248e+07 1.352069e+07 2.179649e+07 1.492232e+07 1.049230e+07 2.366439e+07 3.695623e+07 2.780974e+07 1.724661e+07 2.183892e+07 2.991220e+07 2.845810e+07 1.436380e+07 1.914951e+07 2.115882e+07 2.407421e+07 2.051069e+07 1.312080e+07 1.224160e+07 2.067505e+07 2.233741e+07 2.037576e+07 1.939406e+07 1.557528e+07 2.412217e+07 2.507564e+07 1.315224e+07 2.269948e+07 1.381562e+07 1.865199e+07 1.716108e+07 3.158331e+07 1.979753e+07 1.645003e+07 1.343677e+07 1.786867e+07 1.911223e+07 2.346828e+07 1.647535e+07 1.772437e+07 1.536597e+07 1.654041e+07 1.723309e+07 1.958287e+07 1.041136e+07 1.872310e+07 2.370040e+07 2.119384e+07 1.523033e+07 1.166973e+07 1.920109e+07 6.403278e+06 2.114740e+07 2.465674e+07 1.550174e+07 1.977039e+07 1.726439e+07 2.010046e+07 2.059827e+07 2.162561e+07 2.062181e+07 2.956566e+07 1.775084e+07 1.783081e+07 1.574969e+07 2.682835e+07 9.670394e+06 6.154353e+06 2.030672e+07 1.261902e+07 1.612991e+07 2.400784e+07 2.483898e+07 1.098587e+07 1.909794e+07 1.886839e+07 2.109522e+07 1.928734e+07 2.224752e+07 1.867464e+07 1.643287e+07 1.787115e+07 1.419203e+07 2.559383e+07 2.206164e+07 1.068495e+07 1.740167e+07 2.393090e+07 2.055910e+07 1.678848e+07 1.955663e+07 2.248264e+07 2.167576e+07 1.668990e+07 2.094942e+07 1.872645e+07 1.890193e+07 2.248912e+07 1.632043e+07 1.519082e+07 1.473576e+07 2.242058e+07 1.530669e+07 1.527068e+07 1.489806e+07 1.556839e+07 2.589351e+07 1.875792e+07 2.270234e+07 2.864123e+07 2.046388e+07 1.054723e+07 1.246459e+07 2.438883e+07 1.877628e+07 2.197704e+07 1.641072e+07 1.770887e+07 7.869452e+06 3.283882e+07 1.642290e+07 1.611334e+07 1.769142e+07 2.257558e+07 1.456962e+07 1.507976e+07 1.848839e+07 1.776687e+07 7.841011e+06 2.472847e+07 1.808915e+07 1.588957e+07 1.337269e+07 7.029822e+06 2.259154e+07 1.871639e+07 1.598648e+07 7.036248e+06 1.439723e+07 2.214911e+07 1.735873e+07 1.963847e+07 1.536452e+07 1.777320e+07 1.619691e+07 1.764535e+06 1.502301e+07 1.152911e+07 1.390161e+07 1.413794e+07 2.040768e+07 2.105928e+07 2.151747e+07 1.826447e+07 1.304853e+07 2.904917e+07 2.108083e+07 1.127577e+07 4.771104e+06 2.186463e+07 1.517500e+07 9.482098e+06 1.204260e+07 1.546861e+07 1.888267e+07 1.556121e+07 1.493145e+07 3.941357e+06 1.179644e+07 1.542922e+07 1.410707e+07 8.856020e+05 2.022158e+07 1.662534e+07 2.738199e+07 1.716868e+07 6.785117e+06 1.167472e+07 1.091590e+07 2.023425e+07 1.562402e+07 1.173309e+07 2.130759e+07 5.294265e+06 1.348963e+07 2.379878e+07 1.463610e+07 1.195829e+07 2.204723e+07 2.390516e+07 2.172017e+07 1.999914e+07 1.981494e+07 1.900151e+07 1.615305e+07 2.073840e+07 2.225146e+07 1.644331e+07 1.062655e+07 1.779977e+07 1.342033e+07 1.504688e+07 1.260435e+07 1.903265e+07 2.046336e+07 1.424830e+07 1.690363e+07 1.900273e+07 5.942727e+06 2.006183e+07 1.893474e+07 2.229100e+07 1.908637e+07 2.261686e+07 2.253809e+07 C4 H5 N O_9.46 3.260778e+08 1.928110e+08 2.012830e+08 2.022215e+08 5.492239e+05 1.525833e+08 1.981388e+08 2.113605e+08 675370.11 1.810353e+08 1.995631e+08 2.150506e+08 565100.24 1.758741e+08 1.865958e+08 1.894945e+08 1.020379e+06 1.792424e+08 1.820871e+08 2.065692e+08 2.379467e+05 1.767796e+08 1.899681e+08 2.494024e+08 547444.011 1.640784e+08 1.906408e+08 1.763202e+08 4.536704e+05 1.815729e+08 1.801285e+08 2.312653e+08 461790.91 1.841383e+08 1.929907e+08 1.901382e+08 3.097531e+05 1.781754e+08 1.857266e+08 2.024727e+08 5.090352e+05 1.762927e+08 2.128344e+08 2.095565e+08 1.746563e+05 1.746346e+08 1.669180e+08 2.080099e+08 1.580960e+08 2.153308e+08 2.088561e+08 1.889403e+08 2.490062e+08 1.682071e+08 3.175328e+08 2.323051e+08 3.059758e+08 3.644714e+08 3.128305e+08 1.550078e+08 3.006054e+08 3.242300e+08 2.706108e+08 2.998746e+08 1.281338e+08 1.411936e+08 2.832631e+08 2.178736e+08 2.564262e+08 1.905390e+08 1.965136e+08 2.915516e+08 2.606536e+08 1.309365e+08 2.600863e+08 1.458194e+08 2.149434e+08 2.353515e+08 4.230822e+08 2.234443e+08 1.701804e+08 1.237324e+08 1.715815e+08 1.819758e+08 2.454446e+08 2.602780e+08 1.843217e+08 1.753465e+08 2.526007e+08 2.821141e+08 2.110375e+08 9.493394e+07 1.726051e+08 2.739957e+08 2.533401e+08 1.614483e+08 1.147666e+08 2.990492e+08 4.576417e+07 2.552665e+08 1.880466e+08 1.577846e+08 2.474045e+08 1.783561e+08 2.183310e+08 2.078695e+08 1.966126e+08 2.187254e+08 2.312182e+08 1.870898e+08 1.783064e+08 1.773693e+08 1.592539e+08 1.125408e+08 4.549933e+07 2.562220e+08 1.926745e+08 1.715031e+08 2.499418e+08 3.000730e+08 1.809926e+08 2.260457e+08 1.946830e+08 2.132813e+08 2.176777e+08 2.696068e+08 2.168772e+08 1.658753e+08 2.318986e+08 2.506193e+08 2.845546e+08 2.950594e+08 1.984701e+08 1.509916e+08 2.727761e+08 1.775141e+08 1.691603e+08 2.635519e+08 2.967713e+08 2.921977e+08 1.712072e+08 2.587966e+08 2.180987e+08 1.849981e+08 2.909405e+08 1.682480e+08 1.660722e+08 2.267465e+08 2.566844e+08 1.807857e+08 1.926546e+08 1.988453e+08 2.016815e+08 1.752995e+08 2.051218e+08 3.174950e+08 1.791095e+08 2.338713e+08 1.494686e+08 1.771250e+08 2.478299e+08 1.788314e+08 2.243119e+08 2.213415e+08 1.743757e+08 2.644514e+08 2.235354e+08 1.742349e+08 2.155114e+08 1.888564e+08 2.257477e+08 1.986285e+08 2.711487e+08 1.593389e+08 2.605704e+08 1.160396e+08 2.527691e+08 2.148558e+08 2.079257e+08 1.042348e+08 5.589537e+07 2.186675e+08 2.058357e+08 1.556257e+08 5.719733e+07 1.534723e+08 2.733678e+08 2.102400e+08 2.079318e+08 2.362374e+08 1.962862e+08 1.561711e+08 1.650091e+08 1.596785e+08 1.068865e+08 1.693052e+08 2.190753e+08 2.014005e+08 2.075064e+08 2.087135e+08 2.206234e+08 1.431091e+08 2.152605e+08 2.566642e+08 1.335841e+08 4.564989e+07 2.249444e+08 1.552976e+08 1.498403e+08 9.648862e+07 1.830325e+08 2.336001e+08 1.552869e+08 1.495220e+08 6.821721e+07 1.154233e+08 1.743325e+08 1.395289e+08 1.134811e+07 2.310423e+08 1.601948e+08 2.320913e+08 2.103918e+08 1.133172e+08 1.367092e+08 1.857287e+08 2.151537e+08 1.882028e+08 9.189694e+07 2.652304e+08 4.685123e+07 1.588609e+08 2.424999e+08 1.538790e+08 1.375102e+08 2.447132e+08 2.247179e+08 2.616514e+08 2.091497e+08 1.942284e+08 1.889688e+08 1.958062e+08 2.025761e+08 2.294390e+08 1.524866e+08 9.868540e+07 2.151231e+08 1.620998e+08 2.023800e+08 1.724177e+08 2.187686e+08 1.990886e+08 1.746265e+08 1.970762e+08 1.512948e+08 5.130439e+07 2.394405e+08 2.203693e+08 2.820884e+08 1.859916e+08 2.853450e+08 2.746720e+08 GLUTAMINE 7.972632e+09 4.755704e+09 5.033117e+09 4.672908e+09 1.270493e+06 3.139341e+09 4.974907e+09 5.171964e+09 746752.20 4.254042e+09 4.967799e+09 5.041508e+09 701636.45 3.993364e+09 4.332825e+09 4.856383e+09 1.384394e+06 4.265272e+09 4.234530e+09 4.615122e+09 3.170920e+05 4.138186e+09 5.001999e+09 5.960179e+09 127888.696 3.801687e+09 4.634272e+09 4.219377e+09 3.363301e+05 4.239199e+09 4.288854e+09 5.502979e+09 331519.18 4.240324e+09 4.747650e+09 4.323599e+09 2.267832e+05 4.554176e+09 4.263372e+09 5.108633e+09 4.434711e+05 4.201628e+09 4.937706e+09 5.018574e+09 3.698534e+05 4.074961e+09 4.000963e+09 5.009623e+09 3.993459e+09 5.524905e+09 5.110661e+09 4.835124e+09 5.882765e+09 4.782633e+09 7.370015e+09 2.354695e+09 6.553364e+09 8.992445e+09 7.534864e+09 3.896432e+09 7.480310e+09 8.056610e+09 6.038893e+09 6.990145e+09 3.401638e+09 3.629231e+09 6.744039e+09 5.167309e+09 6.012809e+09 4.578297e+09 4.553877e+09 6.893220e+09 5.945404e+09 3.175757e+09 6.340558e+09 3.401665e+09 5.822761e+09 5.241152e+09 1.003269e+10 5.520266e+09 4.102426e+09 3.051826e+09 4.442523e+09 4.268759e+09 6.387192e+09 6.465728e+09 4.474100e+09 4.528408e+09 5.824001e+09 6.560844e+09 5.167610e+09 2.277404e+09 4.073415e+09 6.438376e+09 5.978034e+09 3.669973e+09 2.931652e+09 6.799790e+09 1.214083e+09 5.619833e+09 4.469178e+09 3.774599e+09 5.678085e+09 4.224652e+09 5.300936e+09 4.880036e+09 2.055979e+09 5.092646e+09 5.453750e+09 4.486338e+09 4.278106e+09 4.022029e+09 4.009089e+09 3.038128e+09 1.114885e+09 5.629707e+09 4.590550e+09 4.201317e+09 5.801232e+09 7.395772e+09 3.778234e+09 5.516086e+09 4.497996e+09 5.272274e+09 4.896513e+09 6.336974e+09 4.891783e+09 4.027903e+09 5.733737e+09 5.805722e+09 6.459549e+09 7.753262e+09 4.783408e+09 3.620774e+09 6.262057e+09 4.307004e+09 4.019475e+09 6.390132e+09 6.485074e+09 6.891603e+09 4.302844e+09 6.230642e+09 5.067857e+09 4.517654e+09 6.654501e+09 4.102587e+09 3.845849e+09 2.242219e+09 6.030610e+09 4.161698e+09 4.475618e+09 4.636373e+09 4.661358e+09 4.301562e+09 4.920389e+09 6.703025e+09 4.532409e+09 5.081986e+09 3.594057e+09 4.155234e+09 6.576650e+09 4.315669e+09 5.516054e+09 5.219203e+09 4.208733e+09 6.507401e+09 5.675053e+09 4.335637e+09 4.978684e+09 4.492890e+09 5.438243e+09 4.598636e+09 6.423737e+09 3.539456e+09 6.356589e+09 3.044342e+09 5.980664e+09 4.671824e+09 4.959557e+09 2.834736e+09 1.482238e+09 5.375946e+09 4.615921e+09 3.465901e+09 1.519814e+09 3.983115e+09 5.940592e+09 4.937636e+09 5.116363e+09 5.315183e+09 4.801488e+09 3.768913e+09 4.185988e+09 3.743759e+09 2.814200e+09 3.576397e+09 5.153100e+09 5.053785e+09 4.912818e+09 5.083791e+09 5.223436e+09 3.446266e+09 5.154720e+09 6.330629e+09 3.296580e+09 1.146645e+09 5.078224e+09 3.656839e+09 3.328332e+09 2.655275e+09 4.454217e+09 5.102234e+09 3.758350e+09 3.780050e+09 2.080568e+09 2.926745e+09 4.278832e+09 3.647107e+09 1.453048e+08 5.192270e+09 3.873538e+09 5.084678e+09 4.885795e+09 3.158468e+09 3.436144e+09 4.334201e+09 5.181667e+09 4.141539e+09 2.418431e+09 6.007587e+09 1.170121e+09 4.116654e+09 5.986835e+09 3.835653e+09 3.271777e+09 6.012256e+09 5.409895e+09 6.532168e+09 4.759440e+09 4.638167e+09 4.549859e+09 5.096306e+09 4.847168e+09 5.590843e+09 3.796816e+09 2.411203e+09 4.929675e+09 4.052490e+09 4.616991e+09 4.077053e+09 5.336750e+09 5.141547e+09 4.354464e+09 4.637561e+09 4.165819e+09 1.247254e+09 5.616009e+09 5.060428e+09 7.137485e+09 4.535817e+09 6.968945e+09 6.793312e+09 C18 H25 Cl N4 O10_9.462 1.173036e+07 4.763907e+06 6.704821e+06 5.691967e+06 9.217546e+04 4.171997e+06 5.548006e+06 6.649352e+06 92996.92 4.812930e+06 5.753551e+06 6.230121e+06 72430.39 4.997337e+06 5.526701e+06 5.285999e+06 1.536628e+05 5.948648e+06 3.876169e+06 5.600789e+06 4.232888e+04 4.096959e+06 7.032107e+06 7.016129e+06 11683.892 5.035305e+06 5.277800e+06 4.976559e+06 1.454951e+04 5.029457e+06 6.211791e+06 5.808157e+06 75658.76 4.809474e+06 5.881807e+06 4.384765e+06 4.752104e+04 5.165210e+06 5.969903e+06 6.529472e+06 6.905155e+04 4.706375e+06 6.422169e+06 5.212308e+06 7.398643e+04 5.226570e+06 4.688863e+06 6.079629e+06 4.137060e+06 6.848157e+06 8.364714e+06 6.681794e+06 8.060944e+06 3.790137e+06 9.339420e+06 5.114861e+06 1.091973e+07 1.356609e+07 1.153369e+07 5.041701e+06 1.155567e+07 1.177303e+07 8.441577e+06 1.036696e+07 3.053880e+06 4.073652e+06 8.958133e+06 7.996259e+06 7.785264e+06 5.164174e+06 5.084348e+06 8.261293e+06 1.056190e+07 2.717018e+06 5.328753e+06 3.272678e+06 8.032579e+06 6.463765e+06 1.513333e+07 6.814047e+06 2.956306e+06 2.436996e+06 5.947347e+06 2.656549e+06 4.947348e+06 5.509258e+06 4.341972e+06 5.680438e+06 7.558072e+06 6.599486e+06 8.071890e+06 2.158432e+06 4.261089e+06 8.480955e+06 6.013137e+06 5.157850e+06 2.612196e+06 1.079491e+07 3.530068e+05 8.912778e+06 6.057413e+06 2.535016e+06 7.228187e+06 4.079023e+06 8.289825e+06 7.861149e+06 6.175988e+06 6.942915e+06 5.564824e+06 5.671461e+06 5.993164e+06 4.533668e+06 3.379356e+06 3.165588e+06 1.651149e+05 8.176780e+06 5.505887e+06 3.318602e+06 9.675570e+06 9.150211e+06 5.410186e+06 6.174202e+06 6.854675e+06 6.434481e+06 6.914715e+06 1.006645e+07 4.874897e+06 5.240090e+06 8.417216e+06 8.493187e+06 6.128612e+06 1.007186e+07 6.009156e+06 4.331538e+06 8.127777e+06 4.302233e+06 4.564403e+06 8.946287e+06 7.891601e+06 9.339159e+06 5.209591e+06 5.935789e+06 6.610400e+06 4.103521e+06 9.832572e+06 5.657635e+06 3.353737e+06 6.850757e+06 8.084736e+06 3.238407e+06 6.130301e+06 3.590911e+06 4.582591e+06 3.929015e+06 6.309236e+06 1.050930e+07 3.197378e+06 6.068833e+06 1.990573e+06 4.666595e+06 9.937796e+06 5.438969e+06 6.655273e+06 7.184255e+06 3.733570e+06 5.956455e+06 3.716943e+06 4.694931e+06 6.751861e+06 5.695255e+06 7.002051e+06 5.327520e+06 9.285985e+06 3.940710e+06 7.768027e+06 3.321361e+06 7.711626e+06 5.976604e+06 6.479540e+06 2.327535e+06 6.148436e+05 6.312733e+06 6.398387e+06 3.350414e+06 9.042206e+05 4.309335e+06 5.506212e+06 5.944263e+06 7.031201e+06 7.786667e+06 6.407023e+06 4.496879e+06 8.420072e+05 5.807843e+06 2.778171e+06 4.152095e+06 7.270836e+06 3.361091e+06 6.374479e+06 5.314605e+06 4.885228e+06 4.031847e+06 4.098742e+06 7.278396e+06 4.288496e+06 4.499894e+05 4.948824e+06 4.970932e+06 1.885431e+06 2.237128e+06 4.028363e+06 7.009181e+06 4.593449e+06 3.695711e+06 1.539771e+06 4.101571e+06 4.239253e+06 3.312153e+06 1.764053e+05 6.036645e+06 4.368374e+06 6.554475e+06 6.656262e+06 2.188005e+06 3.033042e+06 3.904697e+06 7.152872e+06 4.836850e+06 2.023484e+06 5.813658e+06 2.911967e+05 4.111621e+06 8.339015e+06 4.762410e+06 2.206050e+06 8.656179e+06 5.903846e+06 9.871878e+06 5.749260e+06 5.688827e+06 4.403172e+06 4.434729e+06 6.431430e+06 7.053696e+06 3.468552e+06 1.790104e+06 6.990463e+06 4.280110e+06 5.634653e+06 5.050198e+06 5.349242e+06 7.288901e+06 5.068846e+06 4.183313e+06 4.243389e+06 5.708733e+05 6.250281e+06 8.089751e+06 1.036774e+07 5.999878e+06 1.031412e+07 9.379875e+06 C20 H21 P_9.464 6.905623e+06 3.016895e+06 3.710087e+06 2.997516e+06 9.190359e+04 2.039711e+06 3.591146e+06 3.751299e+06 90225.36 2.960089e+06 3.513010e+06 2.773420e+06 73410.16 2.661347e+06 3.737710e+06 3.804990e+06 1.574730e+05 2.178113e+06 2.263910e+06 3.679717e+06 4.581260e+04 2.979473e+06 4.058185e+06 2.944951e+06 13931.690 2.352883e+06 3.334697e+06 3.414559e+06 1.491170e+04 2.880532e+06 3.073418e+06 3.312531e+06 69594.34 3.478087e+06 2.677960e+06 2.989926e+06 4.748332e+04 3.660742e+06 3.239581e+06 2.524321e+06 8.382421e+04 2.907216e+06 2.829886e+06 3.794802e+06 8.699739e+04 3.380473e+06 3.130011e+06 2.892825e+06 2.721531e+06 3.516718e+06 4.156947e+06 3.406154e+06 4.592633e+06 1.929472e+06 5.670272e+06 4.639395e+06 5.617318e+06 7.184399e+06 5.440536e+06 2.750421e+06 5.052538e+06 6.352987e+06 4.711188e+06 5.724875e+06 2.364936e+06 2.457135e+06 5.613922e+06 2.678958e+06 4.846630e+06 3.706468e+06 2.784900e+06 4.972702e+06 5.315659e+06 2.275345e+06 4.838681e+06 2.337390e+06 4.870979e+06 4.710171e+06 8.640386e+06 4.369200e+06 2.131778e+06 2.322782e+06 3.781792e+06 3.607687e+06 5.280793e+06 3.290298e+06 2.525751e+06 3.340158e+06 4.099603e+06 5.377308e+06 3.528884e+06 1.364068e+06 2.220345e+06 5.035142e+06 4.291115e+06 3.066749e+06 2.079230e+06 6.534751e+06 1.286686e+05 5.313911e+06 2.164733e+06 2.338334e+06 5.262963e+06 2.739366e+06 4.075855e+06 3.838884e+06 2.428328e+06 3.864381e+06 3.487439e+06 2.762977e+06 3.257624e+06 3.790706e+06 2.661370e+06 1.745304e+06 1.162381e+05 4.545850e+06 4.050934e+06 3.558237e+06 4.835203e+06 5.465174e+06 3.185654e+06 4.841380e+06 3.748434e+06 3.924175e+06 4.193482e+06 5.344747e+06 3.421863e+06 3.512444e+06 4.416086e+06 4.786479e+06 5.185056e+06 5.755564e+06 4.012628e+06 2.626944e+06 5.288096e+06 3.037486e+06 3.400431e+06 5.120737e+06 6.101093e+06 5.770820e+06 3.544149e+06 4.896077e+06 3.673693e+06 3.914391e+06 5.278523e+06 2.481489e+06 2.736183e+06 3.614563e+06 4.202733e+06 3.905753e+06 3.736853e+06 5.076408e+06 3.649755e+06 1.808658e+06 4.233502e+06 3.559867e+06 2.259558e+06 3.782513e+06 3.846964e+06 3.368887e+06 4.192944e+06 3.418412e+06 4.274298e+06 6.813221e+06 2.658722e+06 4.750641e+06 3.279516e+06 3.342524e+06 4.982312e+06 3.709733e+06 4.417604e+06 3.499083e+06 5.539949e+06 2.465591e+06 4.945506e+06 2.064273e+06 3.943482e+06 3.719799e+06 3.859696e+06 1.641106e+06 4.095237e+05 4.145696e+06 3.847458e+06 2.099307e+06 5.005067e+05 2.199612e+06 4.717558e+06 3.516780e+06 2.254787e+06 4.457930e+06 3.439299e+06 1.660244e+06 2.139870e+06 3.061771e+06 1.795276e+06 2.908706e+06 4.189171e+06 3.187577e+06 3.360743e+06 3.411724e+06 2.867681e+06 2.531367e+06 3.300636e+06 4.226554e+06 2.365912e+06 1.738315e+05 3.996852e+06 1.714353e+06 4.283490e+06 1.471866e+06 3.258175e+06 3.999676e+06 5.805100e+06 2.704027e+06 1.105306e+06 2.159674e+06 3.203270e+06 2.293567e+06 1.798371e+05 4.794295e+06 2.523945e+06 3.947500e+06 3.816734e+06 2.049652e+06 3.322168e+06 4.020663e+06 4.240547e+06 2.726253e+06 1.052233e+06 2.708995e+06 3.210549e+05 3.217736e+06 2.951210e+06 2.190510e+06 1.948055e+06 5.044923e+06 3.480811e+06 4.732023e+06 3.670507e+06 2.584993e+06 3.045223e+06 3.296395e+06 2.803999e+06 4.631170e+06 2.411252e+06 1.312798e+06 4.358854e+06 2.189568e+06 3.870370e+06 2.956345e+06 4.224377e+06 3.245903e+06 2.728813e+06 2.975234e+06 2.368410e+06 2.882263e+05 4.068989e+06 3.820273e+06 5.787875e+06 3.215841e+06 5.176026e+06 5.317220e+06 Nitrosoguvacoline (2)_9.465 3.132584e+07 6.061469e+06 2.289556e+07 2.079401e+07 1.223548e+05 1.750630e+07 1.850064e+07 1.913286e+07 115321.74 1.542267e+07 1.818506e+07 1.949945e+07 85631.58 1.480104e+07 1.728643e+07 1.799649e+07 1.695131e+05 1.620374e+07 1.651684e+07 1.760502e+07 4.822905e+04 1.489683e+07 1.971014e+07 1.790870e+07 21984.289 1.752230e+07 1.659391e+07 1.636313e+07 2.020879e+04 1.733569e+07 1.466953e+07 2.041037e+07 70159.39 1.798906e+07 1.803823e+07 1.570610e+07 4.636996e+04 1.803310e+07 1.539491e+07 1.680575e+07 7.738086e+04 1.802983e+07 1.826383e+07 1.942060e+07 8.008017e+04 1.380244e+07 1.620015e+07 1.889011e+07 1.417677e+07 2.081425e+07 2.111996e+07 1.890350e+07 2.078117e+07 1.571653e+07 2.103312e+07 1.906703e+07 2.852173e+07 3.457551e+07 2.781208e+07 1.316044e+07 2.599667e+07 3.175412e+07 2.258196e+07 2.987005e+07 1.339909e+07 1.383283e+07 2.669853e+07 2.107709e+07 1.977832e+07 1.649623e+07 1.616165e+07 2.648307e+07 2.107051e+07 1.208898e+07 2.331377e+07 1.357396e+07 1.883849e+07 2.239057e+07 3.719433e+07 2.076542e+07 1.470318e+07 1.187205e+07 1.752199e+07 1.547486e+07 2.337902e+07 8.706920e+06 1.901558e+07 9.358381e+06 2.234151e+07 2.517922e+07 1.782722e+07 8.747909e+06 1.072266e+07 2.535482e+07 2.574638e+07 1.288145e+07 9.378826e+06 3.001054e+07 4.248342e+06 2.204973e+07 1.595332e+07 1.403920e+07 2.327500e+07 1.445186e+07 2.141779e+07 1.861164e+07 1.879882e+07 2.021606e+07 1.796217e+07 1.485892e+07 1.831642e+07 1.714434e+07 1.528957e+07 1.174054e+07 3.659230e+06 2.372022e+07 1.751140e+07 1.693866e+07 1.987363e+07 3.090516e+07 1.736341e+07 2.132382e+07 1.882218e+07 1.731650e+07 2.006391e+07 2.568372e+07 1.789429e+07 1.568466e+07 1.880229e+07 2.498091e+07 2.661116e+07 2.635691e+07 2.077152e+07 1.285967e+07 2.251938e+07 1.695750e+07 1.502592e+07 2.396394e+07 2.729135e+07 2.668602e+07 1.787894e+07 2.924978e+07 1.994392e+07 1.919083e+07 2.696975e+07 1.354556e+07 1.554868e+07 1.704745e+07 2.061412e+07 1.567175e+07 1.637559e+07 1.851347e+07 1.878413e+07 1.314811e+07 2.138577e+07 2.706692e+07 1.574857e+07 1.968904e+07 1.285406e+07 1.581772e+07 2.130341e+07 1.760454e+07 1.912618e+07 1.964314e+07 1.673185e+07 2.212461e+07 1.626639e+07 1.717417e+07 2.107054e+07 1.841035e+07 2.170064e+07 1.965413e+07 2.365178e+07 1.482727e+07 2.179868e+07 1.244553e+07 2.081965e+07 1.913158e+07 2.014597e+07 9.251258e+06 4.967334e+06 2.084291e+07 1.590362e+07 1.166417e+07 6.044580e+06 1.122881e+07 2.443734e+07 1.554809e+07 2.023740e+07 2.053762e+07 1.406735e+07 1.381151e+07 1.577337e+07 1.166686e+07 9.817486e+06 1.227846e+07 1.895978e+07 1.757362e+07 1.826890e+07 1.876642e+07 1.835429e+07 1.200451e+07 2.005142e+07 2.207519e+07 1.443811e+07 3.761989e+06 2.035415e+07 1.539959e+07 1.775957e+07 1.020659e+07 1.652623e+07 2.250137e+07 1.532742e+07 1.202243e+07 4.256045e+06 1.056432e+07 1.512085e+07 1.312737e+07 4.536790e+05 2.311846e+07 1.357604e+07 1.936291e+07 1.958768e+07 1.910469e+07 1.188861e+07 1.770802e+07 2.153389e+07 1.888085e+07 6.781951e+06 2.346997e+07 3.714206e+06 1.445928e+07 2.517732e+07 1.393888e+07 1.261279e+07 2.152067e+07 2.093138e+07 2.047044e+07 2.028360e+07 2.007984e+07 1.919955e+07 1.653716e+07 1.937985e+06 1.569532e+07 1.406354e+07 8.537327e+06 2.140420e+07 5.907066e+06 1.581866e+07 1.247677e+07 2.020194e+07 1.907822e+07 1.380632e+07 1.852251e+07 1.521289e+07 4.158499e+06 1.692169e+07 2.013108e+07 2.542925e+07 1.642798e+07 2.805841e+07 2.554746e+07 ë±-L-Glutamyl-L-glutamine_9.482 2.846328e+07 3.568276e+07 3.048365e+07 3.262673e+07 3.995915e+05 1.889405e+07 4.558396e+07 4.163777e+07 263035.67 2.403019e+07 3.626432e+07 3.644880e+07 188183.99 3.217859e+07 2.543770e+07 3.728018e+07 2.996104e+05 2.983573e+07 2.944450e+07 3.241255e+07 9.502275e+04 3.019147e+07 4.176638e+07 3.989446e+07 34509.821 2.390013e+07 3.279788e+07 3.774554e+07 3.393439e+04 3.176750e+07 2.579315e+07 3.818959e+07 175715.64 3.436347e+07 3.176083e+07 3.545101e+07 1.169965e+05 2.448883e+07 3.952313e+07 3.060327e+07 1.702246e+05 2.695064e+07 3.782763e+07 3.990859e+07 1.632753e+05 3.107762e+07 2.690786e+07 3.544729e+07 2.597032e+07 5.163277e+07 4.102047e+07 2.422920e+07 4.439548e+07 2.995928e+07 8.440792e+07 2.928389e+07 5.261462e+07 8.885747e+07 7.280641e+07 2.629132e+07 7.274553e+07 5.994758e+07 4.197645e+07 7.246805e+07 1.744796e+07 2.935973e+07 5.801488e+07 3.646525e+07 5.519512e+07 3.185407e+07 2.206485e+07 6.853486e+07 3.715766e+07 2.123440e+07 6.307130e+07 2.447389e+07 4.848287e+07 3.183673e+07 1.002959e+08 5.508449e+07 3.060635e+07 3.079820e+07 4.742852e+07 3.452084e+07 5.835348e+07 6.667272e+07 2.390950e+07 2.587142e+07 4.225740e+07 5.820096e+07 5.568354e+07 1.756860e+07 2.556635e+07 4.727822e+07 6.189455e+07 3.468388e+07 3.428567e+07 5.676551e+07 6.036757e+06 6.397312e+07 2.550378e+07 2.710187e+07 4.873010e+07 2.626646e+07 4.700878e+07 4.404082e+07 4.656727e+07 5.369290e+07 3.367789e+07 2.493938e+07 3.583817e+07 4.085349e+07 2.671696e+07 2.387857e+07 1.162982e+07 5.322675e+07 3.352352e+07 3.260682e+07 5.986934e+07 6.102587e+07 1.541662e+07 4.147139e+07 2.856369e+07 4.074212e+07 4.692977e+07 5.684781e+07 3.337072e+07 2.141999e+07 3.691268e+07 5.917455e+07 4.868861e+07 8.618068e+07 2.733339e+07 1.952996e+07 3.789926e+07 2.644629e+07 2.411547e+07 4.119406e+07 4.775379e+07 6.660277e+07 2.354947e+07 4.435030e+07 2.766398e+07 3.135814e+07 3.765806e+07 2.038352e+07 2.477578e+07 2.002343e+07 2.493147e+07 3.503075e+07 2.896991e+07 3.319501e+07 2.693310e+07 4.666499e+07 4.195993e+07 6.391060e+07 5.100583e+07 4.067394e+07 3.892411e+07 2.872478e+07 5.628714e+07 4.755373e+07 5.231877e+07 4.806741e+07 4.834062e+07 7.621430e+07 5.938935e+07 3.758262e+07 7.731361e+07 3.746446e+07 5.010224e+07 4.718546e+07 8.261566e+07 3.110965e+07 3.976133e+07 2.273376e+07 7.008817e+07 5.383502e+07 3.346674e+07 2.190410e+07 7.736550e+06 2.691574e+07 5.487505e+07 1.089519e+07 1.459886e+07 2.903401e+07 6.304588e+07 3.151452e+07 5.495472e+07 5.373969e+07 3.646741e+07 2.495598e+07 1.183153e+07 2.598070e+07 1.616946e+07 3.159776e+07 3.400400e+07 3.260638e+07 2.528159e+07 4.610425e+07 3.850733e+07 1.938604e+07 3.926406e+07 6.615634e+07 2.214285e+07 4.791586e+06 3.694666e+07 3.130959e+07 3.174549e+07 2.361161e+07 4.083244e+07 3.387596e+07 2.767121e+07 2.866259e+07 1.642380e+07 2.431502e+07 2.969112e+07 2.123264e+07 4.357776e+05 3.081107e+07 2.759897e+07 3.962838e+07 3.361991e+07 2.439178e+07 2.560220e+07 3.002955e+07 3.870271e+07 2.829374e+07 1.791250e+07 3.306274e+07 2.237376e+06 3.012062e+07 5.247871e+07 2.225485e+07 1.295564e+07 5.306242e+07 3.548067e+07 5.126751e+07 4.304959e+07 3.097235e+07 2.173384e+07 3.134640e+07 3.265385e+07 6.620261e+07 1.853999e+07 2.259813e+07 3.292878e+07 4.475698e+07 3.422519e+07 2.035208e+07 4.698745e+07 4.712236e+07 1.922465e+07 2.773053e+07 2.462289e+07 9.461430e+06 5.087326e+07 2.769760e+07 3.445382e+07 2.399795e+07 6.607602e+07 4.400789e+07 C7 H15 N3 O3_9.52 3.510717e+06 1.612774e+06 1.659455e+06 1.674331e+06 1.311941e+05 1.120232e+06 1.767212e+06 1.740311e+06 94426.97 1.490127e+06 1.634078e+06 1.889032e+06 79932.31 1.367863e+06 1.521415e+06 1.525469e+06 1.107804e+05 1.343259e+06 1.670699e+06 1.685482e+06 4.196313e+04 1.432665e+06 1.700666e+06 1.941344e+06 16837.012 1.289975e+06 1.536306e+06 1.588042e+06 1.522245e+04 1.465839e+06 1.596293e+06 1.848595e+06 71718.67 1.557959e+06 1.479744e+06 1.407794e+06 4.657295e+04 1.503086e+06 1.722083e+06 1.702175e+06 6.863248e+04 1.371904e+06 1.849718e+06 1.506372e+06 6.675184e+04 1.547565e+06 1.390140e+06 1.723749e+06 1.133064e+06 2.238568e+06 5.769441e+05 2.435694e+06 2.059822e+06 2.266296e+06 4.107126e+06 2.912383e+06 2.134223e+06 2.973057e+06 2.513268e+06 1.569869e+06 3.719228e+06 4.664845e+06 1.764744e+06 2.113330e+06 1.120618e+06 1.300582e+06 1.876216e+06 1.554180e+06 1.070511e+06 1.119048e+06 1.340718e+06 1.619094e+06 7.898938e+05 1.116204e+06 2.248116e+06 2.090399e+06 1.306114e+06 1.974191e+06 3.449597e+06 1.421108e+06 1.238222e+06 9.709065e+05 6.061771e+05 1.183220e+06 1.496089e+06 1.560329e+06 2.467442e+06 1.130981e+06 1.582278e+06 1.068820e+06 1.385537e+06 2.707059e+06 2.505491e+06 1.462370e+06 1.036603e+06 1.914348e+06 1.189143e+06 1.418038e+06 7.330106e+05 1.243934e+06 6.722366e+06 1.287753e+06 1.088439e+06 2.981415e+06 7.709843e+05 1.108878e+06 1.732042e+06 1.663368e+06 1.566271e+06 1.572554e+06 7.789433e+05 1.356089e+06 1.830428e+06 2.529361e+06 2.773626e+06 1.694213e+06 1.220215e+06 4.726265e+06 6.176819e+06 4.814174e+06 5.833619e+05 1.569953e+06 7.260109e+05 1.298196e+06 1.108490e+06 9.807139e+05 6.157771e+05 1.737398e+06 1.964419e+06 1.814107e+06 4.296549e+06 2.957560e+06 7.824882e+05 1.600613e+06 1.180777e+06 1.356062e+06 1.522824e+06 1.886204e+06 1.013529e+06 1.931078e+06 8.527194e+05 3.857386e+06 1.913553e+06 2.509595e+06 3.052083e+06 2.102982e+06 9.612009e+05 1.939336e+06 2.040323e+06 7.147942e+05 1.015391e+06 1.892802e+06 1.456074e+06 4.370061e+06 2.737956e+06 3.314759e+06 1.528753e+06 9.974243e+05 1.355750e+06 1.031540e+06 1.182633e+06 1.618618e+06 1.005770e+06 2.308538e+06 1.347601e+06 1.931323e+06 1.758459e+06 1.298106e+06 1.856668e+06 1.029624e+06 2.265131e+06 1.007912e+06 1.208739e+06 1.860576e+06 1.165376e+06 9.818996e+05 1.927244e+06 5.992440e+06 1.134292e+06 1.820763e+06 5.372362e+05 6.190616e+05 2.025156e+06 7.998877e+05 2.386174e+06 1.847932e+06 1.198599e+06 1.928735e+06 3.745938e+06 1.397338e+06 2.653548e+06 1.408355e+06 8.038071e+05 2.258047e+06 7.723390e+05 1.159133e+06 2.689709e+06 1.874041e+06 1.334600e+06 2.552776e+06 9.100555e+05 2.090004e+06 1.126008e+06 1.809638e+06 9.170140e+05 5.599631e+05 5.642828e+05 1.293784e+06 3.749986e+06 1.445970e+06 2.026546e+06 9.673752e+05 1.671182e+06 1.653916e+06 1.030059e+06 1.466394e+06 1.045060e+06 1.306744e+06 9.355406e+05 2.723980e+06 1.547855e+06 7.919799e+05 2.186985e+06 1.264783e+06 1.624233e+06 1.395508e+06 6.760467e+05 1.081910e+06 9.064462e+05 2.325509e+06 1.413426e+06 1.104603e+06 1.915948e+06 1.034978e+06 4.307310e+06 1.283279e+06 1.291348e+06 1.931105e+06 1.096668e+06 1.301898e+06 1.468745e+06 1.932842e+06 1.605161e+06 2.280717e+06 1.450106e+06 9.722342e+05 1.466675e+06 1.522693e+06 2.403908e+06 8.721427e+05 8.850234e+05 1.328907e+06 9.847877e+05 2.361556e+06 1.773095e+06 1.028449e+06 5.994387e+05 1.060749e+06 2.184446e+06 7.679195e+05 1.905919e+06 2.020165e+06 DIETHANOLAMINE 4.444223e+05 3.168346e+06 2.530327e+06 2.617597e+06 1.918340e+05 1.549931e+06 2.631683e+06 2.598257e+06 142131.27 2.611855e+06 2.191398e+06 2.257821e+06 1052916.28 2.649921e+06 3.167331e+06 3.352958e+06 1.587352e+05 1.849244e+06 2.232942e+06 2.321723e+06 1.824631e+05 2.013329e+06 2.285862e+06 3.260746e+06 152850.497 2.512678e+06 2.853441e+06 2.275632e+06 4.748239e+05 2.148387e+06 2.339272e+06 2.917943e+06 97826.63 2.503194e+06 2.952610e+06 2.516490e+06 1.671799e+06 1.904587e+06 2.518865e+06 2.788691e+06 1.499689e+06 2.118197e+06 2.486483e+06 3.324149e+06 1.516533e+06 2.155056e+06 2.025845e+06 2.809791e+06 6.787263e+06 2.074318e+06 1.725785e+06 5.585933e+05 4.011669e+05 7.205361e+05 4.085929e+05 4.365247e+05 4.038560e+05 5.434235e+05 1.216532e+06 3.719671e+05 3.373016e+06 5.586724e+05 3.330571e+05 4.808996e+05 1.388535e+06 7.992886e+06 4.759710e+07 4.928273e+05 6.950472e+05 5.229462e+05 9.756241e+05 4.117568e+05 4.214865e+05 1.543748e+06 6.124180e+05 8.405668e+05 8.605835e+05 8.521376e+05 5.992794e+05 9.797768e+05 1.570571e+06 1.590710e+06 3.830816e+05 2.143823e+06 5.685463e+05 1.045962e+06 2.337835e+06 4.883731e+05 4.147834e+05 3.529107e+05 1.073980e+06 9.638461e+05 1.122452e+06 3.321209e+06 1.273586e+06 7.265887e+05 9.106456e+05 8.264608e+05 4.891214e+05 3.246180e+05 3.090897e+05 1.093487e+06 6.117593e+05 6.993425e+05 5.011958e+05 1.001570e+06 5.820794e+05 8.678463e+05 3.533751e+05 1.891434e+06 5.687600e+05 2.309304e+06 4.919556e+05 5.241666e+05 2.183519e+07 9.236978e+05 3.244837e+05 5.656597e+05 1.660642e+06 4.614181e+05 5.527383e+05 9.661382e+05 8.366745e+05 2.765961e+06 1.781126e+06 1.172474e+06 4.072554e+05 6.384819e+05 1.118520e+06 2.707403e+06 4.858953e+05 4.180822e+05 6.133744e+05 6.719683e+05 3.555757e+05 5.525616e+05 1.800925e+06 4.671718e+05 6.587318e+05 4.032406e+05 1.358110e+06 3.974565e+07 4.781096e+05 1.321302e+06 6.542389e+05 7.916336e+05 4.731357e+05 9.464040e+05 1.967921e+06 3.758710e+05 9.247711e+05 5.327359e+05 5.061754e+05 4.090192e+06 5.090167e+06 2.566577e+06 8.154977e+06 4.031108e+06 1.143393e+07 7.938737e+06 1.263477e+07 4.975644e+06 2.119510e+06 8.953495e+06 1.084047e+06 3.415222e+06 4.139059e+06 3.285588e+06 6.562042e+06 6.248216e+06 1.303294e+07 3.100795e+06 1.635791e+07 1.626686e+07 1.129349e+06 1.468813e+06 9.971006e+05 1.449570e+06 1.168624e+06 1.247574e+06 5.913901e+05 5.123711e+05 9.684740e+05 5.175345e+06 9.606888e+05 1.838201e+06 8.296767e+05 7.986939e+06 7.969848e+05 1.842392e+06 1.606331e+06 4.666974e+06 3.094610e+05 1.618630e+06 2.066855e+06 2.544611e+06 1.392068e+06 1.262178e+06 2.436080e+06 8.606718e+05 6.738434e+05 9.891742e+05 9.757494e+05 9.083914e+05 6.329361e+05 4.026355e+06 5.991998e+05 2.560405e+06 5.387821e+06 7.217867e+05 1.284818e+06 6.691340e+05 1.252272e+06 3.886804e+06 1.067660e+06 3.916445e+06 1.891753e+06 1.331186e+06 1.463382e+06 4.867379e+05 5.201551e+06 1.669879e+06 6.165207e+06 1.662373e+06 1.539390e+06 3.411870e+06 2.154784e+06 2.279699e+06 8.813448e+05 9.602203e+05 1.958071e+06 9.281995e+06 9.996829e+05 1.924413e+07 1.178781e+06 9.014302e+05 8.498866e+05 6.993016e+05 6.939109e+06 2.619280e+06 3.419597e+06 6.419342e+06 1.820301e+06 5.826377e+06 9.864147e+05 5.679167e+06 3.702536e+05 3.548495e+06 2.973317e+06 2.139271e+06 7.619170e+06 2.464599e+06 3.069792e+06 2.473362e+06 2.006262e+06 3.615357e+06 8.905217e+06 2.307943e+06 2.978582e+06 8.694939e+05 3.513254e+06 2.397228e+07 C8 H14 N2 O6_9.592 1.546896e+06 1.408635e+06 2.298405e+06 1.901390e+06 1.863629e+05 1.677265e+06 2.019180e+06 2.351680e+06 116463.62 1.492837e+06 2.041348e+06 2.120780e+06 107890.80 1.501174e+06 1.888397e+06 2.075566e+06 1.543899e+05 1.716018e+06 1.626099e+06 1.950496e+06 4.732756e+04 1.234740e+06 2.747934e+06 2.495222e+06 15472.186 1.389807e+06 1.621637e+06 1.955092e+06 1.885930e+04 1.697305e+06 1.624632e+06 2.222438e+06 83213.70 1.983159e+06 1.529284e+06 2.102053e+06 5.118453e+04 1.649616e+06 2.181440e+06 2.016141e+06 7.476868e+04 1.627279e+06 1.878485e+06 2.216752e+06 8.081036e+04 1.593729e+06 1.577093e+06 2.128793e+06 1.168615e+06 2.400338e+06 3.684674e+06 2.057654e+06 2.046315e+06 2.133459e+06 2.863101e+06 3.006403e+06 3.052550e+06 2.644324e+06 3.092315e+06 1.338400e+06 2.438626e+06 2.515791e+06 3.500570e+06 3.551591e+06 1.577594e+06 1.358061e+06 3.676054e+06 1.965131e+06 2.637322e+06 2.419480e+06 2.062102e+06 3.394393e+06 1.714392e+06 2.058246e+06 3.912323e+06 1.629471e+06 2.569876e+06 1.970415e+06 6.737744e+06 2.800109e+06 1.565241e+06 1.525768e+06 1.469741e+06 2.410148e+06 2.091098e+06 2.607688e+06 8.867030e+05 2.479048e+06 3.176897e+06 2.620088e+06 1.574379e+06 2.215189e+06 1.134708e+06 3.011965e+06 2.585766e+06 3.280322e+06 1.790787e+06 2.378867e+06 9.695380e+05 2.397497e+06 1.893481e+06 1.609711e+06 1.944108e+06 1.527866e+06 2.694895e+06 2.480799e+06 2.214688e+06 2.883542e+06 1.487231e+06 2.065514e+06 1.971467e+06 2.178182e+06 1.238483e+06 1.716404e+06 2.055916e+06 2.206131e+06 2.099413e+06 1.385050e+06 3.411622e+06 2.573830e+06 1.651219e+06 2.178836e+06 2.095071e+06 1.164696e+06 2.111817e+06 2.028286e+06 3.206398e+06 1.029208e+06 1.648723e+06 1.608936e+06 2.072946e+06 5.129626e+06 1.730153e+06 1.740258e+06 2.329223e+06 8.983906e+05 2.083035e+06 1.832038e+06 1.562096e+06 3.575142e+06 1.605281e+06 1.064054e+06 2.094083e+06 2.167753e+06 2.461587e+06 7.691423e+05 1.540358e+06 1.914469e+06 2.179297e+06 1.592060e+06 1.553821e+06 2.230040e+06 2.247851e+06 2.253609e+06 1.528852e+06 2.861912e+06 3.375731e+06 2.900704e+06 2.119613e+06 1.370300e+06 4.192034e+06 2.215577e+06 2.182285e+06 1.604138e+06 2.464023e+06 3.561610e+06 2.343180e+06 1.675071e+06 4.039031e+06 3.337804e+06 2.216915e+06 2.051720e+06 3.617755e+06 1.256729e+06 2.162394e+06 1.284909e+06 4.140332e+06 2.780282e+06 1.876938e+06 1.144676e+06 7.249930e+05 1.200129e+06 2.225149e+06 6.755600e+05 1.014193e+06 1.687684e+06 2.869735e+06 2.189427e+06 3.587913e+06 2.089530e+06 2.160649e+06 1.087371e+06 1.906875e+06 2.204247e+06 6.546861e+05 2.015112e+06 1.522160e+06 1.449637e+06 1.862399e+06 1.804592e+06 3.815160e+06 1.318127e+06 1.476446e+06 3.428370e+06 9.690860e+05 1.118418e+06 2.531377e+06 1.162646e+06 1.882827e+06 1.468510e+06 3.218540e+06 2.696553e+06 1.219746e+06 2.195565e+06 7.302950e+05 2.460858e+06 2.333741e+06 2.350168e+06 1.237447e+06 2.108180e+06 2.145367e+06 5.777617e+06 3.158170e+06 1.413999e+06 1.703820e+06 2.026926e+06 2.555425e+06 1.988197e+06 2.741225e+06 2.687781e+06 1.271734e+06 1.266540e+06 2.333759e+06 2.097097e+06 4.156812e+06 2.119944e+06 2.609165e+06 2.230037e+06 2.780066e+06 1.470874e+06 1.644549e+06 1.280445e+06 2.263681e+06 3.196992e+06 1.602168e+06 4.315068e+06 2.538492e+06 2.608672e+06 2.159025e+06 1.733821e+06 3.666872e+06 3.931955e+06 1.906295e+06 2.688274e+06 2.525616e+06 1.793009e+06 3.391028e+06 1.278978e+06 1.045476e+06 9.168523e+05 3.412610e+06 2.410584e+06 GUANIDINOSUCCINATE 3.622065e+06 2.412636e+06 2.431316e+06 2.506004e+06 1.207573e+05 1.846571e+06 2.827850e+06 2.684813e+06 80491.83 2.332740e+06 2.506513e+06 2.616512e+06 75009.37 2.160600e+06 2.500484e+06 2.508221e+06 1.243983e+05 2.093809e+06 2.443599e+06 2.330047e+06 4.191887e+04 2.090229e+06 2.650524e+06 3.046196e+06 13048.321 2.304322e+06 2.398923e+06 2.204937e+06 1.446243e+04 2.226687e+06 2.452019e+06 2.841524e+06 70697.08 2.277172e+06 2.374586e+06 2.148462e+06 4.736991e+04 2.413534e+06 2.521848e+06 2.760743e+06 6.721917e+04 2.146041e+06 2.687578e+06 2.440755e+06 7.281340e+04 2.251259e+06 2.052687e+06 2.741962e+06 1.759234e+06 3.651428e+06 2.369031e+06 2.940096e+06 8.690722e+05 5.428087e+06 2.367148e+06 3.006686e+06 5.895458e+06 5.599092e+06 4.361105e+06 5.969115e+06 2.996192e+06 5.071739e+06 4.678500e+06 3.393796e+06 3.671611e+06 2.869122e+06 1.531518e+06 3.176740e+06 4.449300e+06 5.166937e+06 3.933514e+06 6.387571e+06 4.696119e+06 8.289538e+05 3.180533e+06 2.313552e+06 2.904655e+06 1.684070e+06 4.133128e+06 1.808950e+06 1.874237e+06 1.225451e+06 1.776966e+06 3.304626e+06 2.092320e+06 1.173859e+06 4.547603e+06 3.621437e+06 3.668267e+06 9.565645e+05 2.218013e+06 2.929625e+06 4.927750e+06 1.312478e+06 1.424029e+06 2.501068e+06 2.579730e+06 9.555630e+05 2.859564e+06 3.109673e+06 3.569003e+06 2.843204e+06 8.840721e+05 2.529230e+06 2.250618e+06 3.938688e+06 2.823271e+06 1.680282e+06 1.797541e+06 2.702025e+06 2.260015e+06 4.230053e+06 5.068420e+06 2.060145e+06 2.207875e+06 1.913672e+06 5.073366e+06 2.356303e+06 2.751167e+06 2.083828e+06 1.646730e+06 3.080161e+06 2.899493e+06 2.516534e+06 2.892844e+06 1.187647e+06 1.276076e+06 2.250527e+06 1.777172e+06 2.192350e+06 4.002429e+06 3.746839e+06 2.439205e+06 3.076376e+06 1.654443e+06 6.826522e+06 2.618443e+06 3.570039e+06 1.768759e+06 1.914756e+06 3.990780e+06 3.691791e+06 3.095852e+06 3.496104e+06 9.054973e+06 6.480753e+06 2.800094e+06 3.135471e+06 2.241512e+06 2.564670e+06 1.740130e+06 4.812941e+06 3.074525e+06 1.483986e+06 1.973047e+06 2.035892e+06 4.706921e+06 1.485829e+06 3.008585e+06 3.669171e+06 1.736771e+06 3.327017e+06 1.583329e+06 1.362787e+06 5.841863e+06 2.025000e+06 2.753790e+06 1.394748e+06 1.932855e+06 1.483194e+06 1.471540e+06 2.063039e+06 1.604948e+06 1.441414e+06 1.296548e+06 2.639790e+06 2.775489e+06 8.829223e+05 2.241463e+06 3.858606e+06 1.019450e+06 2.314249e+06 2.146225e+06 1.581063e+06 3.440668e+06 8.379112e+05 5.492800e+06 1.119950e+06 4.702117e+06 1.422043e+06 1.363761e+06 2.808398e+06 4.936685e+06 1.174105e+06 1.173157e+06 1.335700e+06 3.498311e+06 2.268409e+06 1.608408e+06 7.246492e+06 1.119812e+06 2.756179e+06 1.671230e+06 1.963054e+06 8.212037e+05 1.757909e+06 1.901140e+06 3.230354e+06 4.024421e+06 3.556244e+06 3.331343e+06 1.404593e+06 1.495291e+06 1.063203e+06 7.873309e+05 1.524939e+06 2.529475e+06 1.962169e+06 1.893749e+06 4.960972e+06 3.734629e+06 1.997493e+06 7.412361e+06 2.244960e+06 1.395591e+06 2.218852e+06 2.092868e+06 2.770129e+06 1.031487e+06 1.110213e+06 2.290062e+06 1.994067e+06 2.423565e+06 2.275733e+06 2.517432e+06 2.030372e+06 3.260843e+06 3.420895e+06 1.518860e+06 3.883648e+06 3.155546e+06 2.023484e+06 2.999965e+06 1.487009e+06 1.137389e+06 1.496209e+06 1.753419e+06 2.859640e+06 3.869900e+06 1.170527e+06 1.641294e+06 1.273672e+06 2.228250e+06 5.048799e+06 1.983359e+06 7.674083e+05 1.695733e+06 1.108646e+06 3.683917e+06 1.797517e+06 2.108746e+06 5.917926e+06 C5 H11 N O4_9.634 3.303331e+06 4.110156e+06 3.474708e+06 3.579769e+06 8.678512e+05 2.096571e+06 2.733552e+06 2.143586e+06 1082250.52 4.802763e+06 2.885313e+06 2.615166e+06 93869.34 3.817296e+06 2.811398e+06 3.519908e+06 1.368231e+05 4.072310e+06 3.553104e+06 3.128523e+06 5.288148e+04 2.798862e+06 2.810661e+06 2.510126e+06 43630.996 4.805719e+06 2.436244e+06 3.859504e+06 1.193490e+05 2.608900e+06 3.601396e+06 2.704675e+06 547828.31 3.359547e+06 4.036391e+06 3.650387e+06 7.690114e+04 3.269802e+06 2.873650e+06 3.236249e+06 1.491528e+06 2.834585e+06 2.679399e+06 2.640242e+06 5.079209e+05 3.198237e+06 5.365879e+06 2.207145e+06 2.295921e+06 3.103275e+06 5.036731e+06 9.187688e+05 1.976986e+06 2.827676e+06 2.192124e+06 2.276744e+06 3.463723e+06 4.146349e+06 3.086379e+06 3.082875e+06 4.632844e+06 6.045960e+06 2.481940e+06 4.695467e+06 2.553435e+06 4.436885e+06 1.964594e+06 2.242264e+06 1.651862e+06 1.823806e+06 1.976092e+06 1.697043e+06 1.876061e+06 2.728015e+06 2.231882e+06 7.311288e+06 3.329126e+06 5.167355e+06 4.638677e+06 3.601712e+06 4.374000e+06 2.808309e+06 2.120537e+06 3.065919e+06 3.164104e+06 3.405194e+06 2.215311e+06 4.816183e+06 2.941546e+06 2.259830e+06 2.482399e+06 7.531109e+06 1.990250e+06 7.366776e+06 5.068174e+06 3.926022e+06 3.453286e+06 3.471003e+06 6.240683e+06 5.084588e+06 3.059762e+06 3.653020e+06 3.995529e+06 5.255791e+06 2.904409e+06 2.202671e+06 2.001451e+06 2.722626e+06 5.403376e+06 2.467990e+06 1.628695e+06 3.865097e+06 1.622862e+06 7.208972e+06 5.203936e+06 2.965189e+06 1.713546e+06 6.494939e+06 3.088854e+06 5.012554e+06 3.380368e+06 5.463256e+06 3.201776e+06 2.865530e+06 1.824245e+06 3.544130e+06 2.284991e+06 3.015049e+06 3.019925e+06 1.683949e+06 3.281456e+06 3.561533e+06 3.159370e+06 5.094658e+06 4.102190e+06 3.678058e+06 2.296394e+06 3.122301e+06 2.848739e+06 3.842999e+06 2.695601e+06 3.158865e+06 3.074923e+06 3.582460e+06 2.709720e+06 2.756591e+06 8.868211e+06 2.184693e+06 4.703341e+06 1.735841e+06 3.945203e+06 2.374128e+06 2.671905e+06 2.786546e+06 3.974476e+06 3.001299e+06 2.352477e+06 1.473374e+06 8.909612e+05 3.359056e+06 4.336230e+06 4.770641e+06 1.645191e+06 2.011182e+06 4.312323e+06 3.326083e+06 3.254306e+06 2.547054e+06 3.573149e+06 1.945084e+06 3.085343e+06 1.568729e+06 4.125114e+06 1.493959e+06 1.966826e+06 4.244099e+06 1.692208e+06 2.354776e+06 3.012899e+06 5.053648e+06 6.902870e+06 1.869655e+06 2.574800e+06 3.476479e+06 3.635080e+06 4.963369e+06 1.200960e+06 1.498043e+06 2.418763e+06 4.862270e+06 3.942269e+06 4.348090e+06 4.785179e+06 2.923635e+06 5.846396e+06 6.578023e+06 2.802894e+06 3.349206e+06 1.967367e+06 2.324164e+06 9.788039e+05 5.727171e+06 3.760328e+06 2.432419e+06 2.163075e+06 4.099495e+06 5.045449e+06 2.214838e+06 3.492926e+06 3.991032e+06 3.221547e+06 2.530548e+06 2.264999e+06 1.981778e+06 1.905645e+06 1.943865e+06 1.789766e+06 2.669725e+06 2.601112e+06 2.455415e+06 3.851741e+05 2.419989e+06 3.512858e+06 1.864639e+06 3.686398e+06 1.434513e+06 1.616335e+06 4.709877e+06 3.078710e+06 2.501963e+06 2.693162e+06 1.869817e+06 5.113900e+06 2.339759e+06 3.842008e+06 2.971237e+06 3.364950e+06 4.519758e+06 3.116096e+06 2.100699e+06 2.325422e+06 4.161795e+06 2.938130e+06 2.002593e+06 5.250842e+06 4.494878e+06 1.645029e+06 2.700500e+06 3.468271e+06 1.849522e+06 4.486348e+06 4.213508e+06 6.471750e+06 3.365419e+06 2.244155e+06 4.077735e+06 2.943759e+06 3.727812e+06 1.752075e+06 8.682420e+06 3.943532e+06 3.335926e+06 GUANIDINOACETATE 6.418587e+07 3.046004e+07 3.136940e+07 3.344103e+07 1.163413e+05 2.241532e+07 3.350300e+07 3.315306e+07 84053.93 2.987303e+07 3.202815e+07 3.003777e+07 80139.72 2.923132e+07 2.974143e+07 3.186796e+07 1.271386e+05 2.891920e+07 2.956869e+07 3.141998e+07 4.419502e+04 2.693662e+07 3.172675e+07 3.779205e+07 20187.136 2.798968e+07 3.054414e+07 2.860406e+07 3.167311e+04 2.822982e+07 2.917643e+07 3.507354e+07 78634.42 2.955283e+07 3.128646e+07 2.730122e+07 5.257641e+04 3.040340e+07 3.018152e+07 3.258354e+07 7.687126e+04 2.734274e+07 3.539632e+07 3.228488e+07 7.607759e+04 2.760069e+07 2.641213e+07 3.327098e+07 4.019366e+07 3.695107e+07 1.993864e+07 9.019711e+07 3.279087e+07 2.880310e+07 6.341230e+07 4.654297e+07 3.898516e+07 5.066152e+07 3.570648e+07 3.567634e+07 7.595991e+07 9.255645e+07 5.051883e+07 4.934353e+07 3.575888e+07 1.689132e+07 3.568584e+07 3.934605e+07 2.077548e+07 2.587586e+07 7.755850e+07 3.489895e+07 4.365270e+07 4.803698e+07 3.346987e+07 2.996289e+07 2.155886e+07 6.779366e+07 7.448119e+07 5.049608e+07 2.399898e+07 2.403270e+07 1.729877e+07 1.446677e+07 5.555458e+07 2.949677e+07 3.095331e+07 2.943792e+07 3.191994e+07 3.235917e+07 3.134235e+07 2.808836e+07 2.134025e+07 3.814038e+07 4.697239e+07 4.065595e+07 2.608947e+07 6.691825e+07 2.328432e+07 4.904108e+07 1.873868e+07 6.319481e+07 6.683202e+07 3.995980e+07 2.947393e+07 4.479465e+07 1.469241e+07 3.821035e+07 1.970082e+07 2.200065e+07 2.292413e+07 1.709043e+07 1.584599e+07 3.971859e+07 3.056118e+07 3.005756e+07 1.537168e+07 7.181505e+07 3.087563e+07 3.006018e+07 1.957351e+07 2.956728e+07 3.085052e+07 1.911816e+07 2.180757e+07 2.377986e+07 4.073859e+07 2.678671e+07 3.930495e+07 7.139467e+07 6.644081e+07 5.818181e+07 2.684761e+07 2.239715e+07 6.716941e+07 7.898210e+06 2.317859e+07 6.120944e+07 2.834085e+07 3.134168e+07 2.541029e+07 2.404920e+07 2.282828e+07 2.440515e+07 3.024019e+07 3.721662e+07 3.165187e+07 3.309429e+07 2.822856e+07 2.592759e+07 2.575764e+07 1.960169e+07 1.393802e+07 3.225188e+07 2.739750e+07 4.451148e+07 2.490569e+07 2.523675e+07 2.174632e+07 2.605389e+07 2.558211e+07 3.416126e+07 5.391316e+07 2.141890e+07 3.060693e+07 3.401025e+07 4.724564e+07 1.907151e+07 1.460716e+07 3.149919e+07 3.733693e+07 2.821229e+07 3.189347e+07 2.112962e+07 3.908764e+07 2.458591e+07 2.662994e+07 4.219550e+07 2.497627e+07 1.625777e+07 6.189252e+07 2.707796e+07 6.522762e+07 2.952659e+07 5.530760e+07 4.043514e+07 4.243783e+07 1.082701e+07 1.437879e+07 3.749503e+07 2.208870e+07 2.866405e+07 6.187605e+07 2.846909e+07 2.742736e+07 2.619822e+07 2.802575e+07 1.963765e+07 2.378358e+07 1.984269e+07 1.930201e+07 1.670340e+07 2.058129e+07 1.823646e+07 1.181492e+07 3.402133e+07 1.644183e+07 2.769915e+07 5.299984e+07 2.141258e+07 2.220616e+07 2.278404e+07 1.852821e+07 2.944804e+07 4.081991e+07 2.127845e+07 3.242270e+07 1.341815e+07 6.627676e+07 2.277840e+07 1.446305e+07 5.018588e+07 3.234196e+07 6.685633e+06 3.264284e+07 2.161796e+07 3.119283e+07 2.824743e+07 2.987632e+07 3.913475e+07 2.933708e+07 3.037471e+07 2.880498e+07 2.774689e+07 1.875953e+07 5.496064e+07 1.719019e+07 2.159353e+07 1.423686e+07 3.359920e+07 5.111372e+07 4.351314e+07 1.895639e+07 2.952687e+07 2.177682e+07 1.086291e+07 3.044671e+07 2.874955e+07 2.251081e+07 4.314685e+07 3.598186e+07 4.289257e+07 3.066858e+07 2.130101e+07 2.935615e+07 3.615740e+07 4.241399e+07 2.261421e+07 5.616852e+07 2.011548e+07 5.817279e+07 3.326653e+07 C8 H17 N O8 S_9.645 2.199212e+05 8.571229e+05 1.123465e+06 1.038373e+06 1.115387e+05 7.619651e+05 1.002388e+06 1.022506e+06 79906.09 9.632290e+05 9.491385e+05 1.007052e+06 73540.19 1.035961e+06 8.587763e+05 9.448455e+05 1.028135e+05 8.893561e+05 1.074765e+06 1.020917e+06 4.022340e+04 8.511493e+05 1.009182e+06 1.030640e+06 14784.103 9.250090e+05 9.872498e+05 8.817089e+05 1.438473e+04 9.354928e+05 1.008016e+06 9.287904e+05 66460.10 1.056105e+06 9.908800e+05 8.950290e+05 4.319639e+04 9.630941e+05 9.119737e+05 9.895397e+05 6.913660e+04 1.011684e+06 9.229645e+05 1.045618e+06 7.186347e+04 9.303455e+05 1.018017e+06 9.032974e+05 7.274085e+05 6.271699e+05 9.059374e+05 1.839430e+06 7.800315e+05 5.937946e+05 1.073325e+06 8.825816e+05 8.615673e+05 6.470464e+05 6.989686e+05 2.660354e+06 9.320948e+05 7.274250e+05 6.817373e+05 9.445386e+05 2.593984e+06 1.453024e+06 5.754409e+05 1.054293e+06 8.602699e+05 1.152586e+06 2.679538e+06 6.586181e+05 6.187161e+05 2.012818e+06 1.005428e+06 8.574330e+05 1.031177e+06 1.144536e+06 2.973189e+06 1.071933e+06 8.750892e+05 1.432573e+06 6.941093e+05 1.383279e+06 8.141298e+05 1.395333e+06 5.501271e+05 1.149961e+06 1.075044e+06 6.735765e+05 1.008234e+06 1.912397e+06 1.126396e+06 9.931426e+05 6.198431e+05 1.494624e+06 2.313159e+06 4.996680e+05 2.309673e+06 1.209889e+06 8.380177e+05 8.773396e+05 7.873865e+05 1.025968e+06 9.751623e+05 6.297104e+05 1.029590e+06 1.304782e+06 7.266347e+05 1.089826e+06 5.676894e+05 1.028717e+06 6.868073e+05 1.110888e+06 2.754218e+06 6.679992e+05 9.120058e+05 8.616307e+05 8.844827e+05 3.935565e+05 4.965763e+05 1.315628e+06 8.257772e+05 9.356561e+04 9.163245e+05 5.420255e+05 1.059105e+06 4.796829e+05 4.764728e+05 6.928093e+05 3.889774e+05 2.707839e+06 4.026769e+05 5.202882e+05 4.529857e+05 7.333201e+05 7.983682e+05 2.843534e+05 4.732932e+05 8.154565e+05 9.253832e+05 1.683149e+05 5.206550e+05 5.563619e+05 5.103866e+05 5.791423e+05 5.389477e+05 3.989376e+05 1.369073e+05 4.898002e+05 9.523855e+05 8.244862e+05 8.483900e+05 1.704029e+06 1.193016e+06 9.787030e+05 1.298675e+06 8.674376e+05 1.555754e+06 1.038266e+06 6.517033e+05 1.572563e+06 8.536637e+05 1.094774e+06 1.133019e+06 1.631668e+06 1.244524e+06 9.643106e+05 1.688133e+06 1.974848e+06 7.851028e+05 1.587989e+06 1.022414e+06 1.108471e+06 7.175909e+05 1.155390e+06 1.324335e+06 1.370863e+06 1.141412e+06 1.064177e+06 8.996738e+05 1.178026e+05 7.382444e+05 6.431503e+05 3.975171e+05 8.448405e+05 7.326992e+05 3.925919e+05 6.646977e+05 8.050145e+05 5.698741e+05 1.909119e+05 1.340162e+06 1.136969e+06 9.223700e+04 1.056944e+06 3.363779e+05 1.992301e+05 8.266419e+05 7.268595e+05 9.939951e+05 7.647593e+05 4.571141e+05 1.093483e+06 3.740154e+05 1.303241e+06 7.228747e+05 8.098139e+05 5.431804e+05 1.844342e+06 9.528616e+05 3.540501e+05 6.665050e+05 7.530261e+05 5.048258e+05 1.157003e+06 6.668638e+05 5.553083e+05 5.170250e+06 7.138360e+05 9.862165e+05 6.637520e+05 5.763891e+05 5.952452e+05 8.651132e+05 5.064312e+05 1.025540e+06 5.209989e+05 8.726318e+05 1.287877e+06 1.184523e+06 2.221386e+05 1.075680e+05 9.110868e+05 7.890176e+05 8.452333e+05 7.593344e+05 1.018018e+05 7.031783e+05 1.000389e+06 7.703783e+05 1.053910e+06 7.053274e+05 1.584979e+06 1.384639e+06 2.733946e+06 1.073145e+06 1.421363e+06 6.016742e+05 9.406599e+05 1.055877e+06 1.194550e+06 1.038201e+06 8.320797e+05 1.273944e+06 2.622808e+06 1.093391e+06 4.477097e+05 4.628613e+05 1.746699e+05 1.042098e+06 7.830862e+05 GLYCINE 6.102114e+08 4.042339e+08 3.879812e+08 4.023909e+08 4.564235e+05 3.000630e+08 4.225689e+08 4.024932e+08 528713.72 3.938463e+08 3.935435e+08 4.272125e+08 376072.00 3.554792e+08 3.806563e+08 3.908738e+08 2.318993e+05 3.705558e+08 3.515551e+08 3.964828e+08 3.363191e+05 3.547153e+08 4.155270e+08 4.672986e+08 919688.656 3.342497e+08 3.957151e+08 3.913139e+08 4.357473e+06 3.627240e+08 3.993625e+08 3.823154e+08 485434.87 3.758633e+08 4.035938e+08 3.467879e+08 6.381426e+05 3.776994e+08 4.163787e+08 4.017512e+08 2.754548e+06 3.650543e+08 4.136250e+08 4.114690e+08 3.885114e+05 3.534927e+08 3.542400e+08 4.116065e+08 3.172141e+08 4.627976e+08 4.374558e+08 5.474134e+08 3.526999e+08 6.091496e+08 6.182912e+08 4.639345e+08 4.789957e+08 6.921054e+08 5.839283e+08 4.618078e+08 5.742235e+08 5.073522e+08 7.547926e+08 4.669935e+08 3.642610e+08 3.096790e+08 5.872400e+08 4.564834e+08 4.139721e+08 4.687174e+08 5.875430e+08 4.769985e+08 5.264335e+08 3.741137e+08 4.873737e+08 3.684511e+08 3.382753e+08 6.729577e+08 6.866786e+08 5.044414e+08 2.741175e+08 2.505270e+08 3.457566e+08 4.080931e+08 5.399545e+08 5.459304e+08 3.773471e+08 3.934122e+08 4.762977e+08 4.879998e+08 3.480813e+08 3.420374e+08 3.171394e+08 6.104531e+08 4.539802e+08 4.923966e+08 3.740431e+08 5.114651e+08 2.611618e+08 5.101248e+08 3.839572e+08 3.204766e+08 4.621675e+08 3.642221e+08 4.686526e+08 4.946678e+08 4.967959e+08 4.447121e+08 3.750785e+08 4.126937e+08 4.079035e+08 3.922761e+08 3.175056e+08 4.096896e+08 3.885940e+08 4.569182e+08 4.886520e+08 3.911898e+08 4.129995e+08 5.362374e+08 2.726212e+08 3.469565e+08 5.359853e+08 4.302383e+08 4.470193e+08 4.288273e+08 4.504376e+08 3.696469e+08 4.692693e+08 2.982911e+08 6.355340e+08 5.698694e+08 3.487219e+08 3.593878e+08 5.266040e+08 3.081440e+08 4.026634e+08 4.332168e+08 3.863228e+08 4.395020e+08 5.783982e+08 3.893558e+08 2.971351e+08 4.091191e+08 4.831595e+08 4.463970e+08 3.363629e+08 4.570798e+08 4.164020e+08 3.228427e+08 3.417945e+08 2.805157e+08 3.369169e+08 4.397537e+08 3.942848e+08 5.892186e+08 4.477249e+08 5.780082e+08 2.324994e+08 4.243183e+08 5.510125e+08 5.355585e+08 5.191525e+08 3.063937e+08 3.865443e+08 4.664067e+08 4.655762e+08 2.576387e+08 3.746863e+08 3.935219e+08 4.212608e+08 5.855472e+08 4.899568e+08 2.869800e+08 4.444371e+08 3.657197e+08 5.104160e+08 4.669927e+08 3.445854e+08 2.406969e+08 3.888549e+08 3.862551e+08 3.898857e+08 2.929316e+08 2.818623e+08 3.848714e+08 5.015801e+08 3.449992e+08 3.388400e+08 3.665849e+08 4.383857e+08 4.262499e+08 4.476155e+08 5.396307e+08 3.646487e+08 3.461844e+08 3.401028e+08 2.906544e+08 2.793328e+08 3.990070e+08 3.222988e+08 4.577160e+08 3.756409e+08 4.589560e+08 3.785561e+07 2.986471e+08 3.365354e+08 3.935689e+08 3.835002e+08 2.311615e+08 4.684180e+08 3.689214e+08 2.061931e+08 3.425366e+08 2.179741e+08 3.941467e+08 4.148970e+08 3.309468e+08 4.209193e+08 4.190069e+08 3.220331e+08 5.760974e+08 5.302761e+08 1.927139e+08 2.985987e+08 3.039963e+08 4.320859e+08 4.668521e+08 3.885927e+08 4.599560e+08 2.316472e+08 3.935580e+08 4.570893e+08 3.508953e+08 3.105872e+08 3.920755e+08 4.418798e+08 5.507122e+08 4.082852e+08 4.375515e+08 3.521322e+08 3.190065e+08 2.860238e+08 4.214800e+08 3.079144e+08 4.012391e+08 3.694393e+08 3.127776e+08 2.607384e+08 3.270614e+08 5.723686e+08 3.793204e+08 4.091924e+08 3.712694e+08 4.182037e+08 3.632806e+08 4.420652e+08 3.548135e+08 4.872397e+08 3.835307e+08 5.069554e+08 5.115804e+08 C3 H3 N9 P2_9.699 4.211466e+06 4.025916e+06 3.536649e+06 3.367765e+06 1.283028e+05 2.020094e+06 3.817979e+06 2.874179e+06 111956.70 3.114965e+06 4.218520e+06 2.863076e+06 90806.52 3.345075e+06 2.648323e+06 3.865419e+06 1.161521e+05 3.123607e+06 3.882927e+06 2.747194e+06 1.054100e+05 3.006142e+06 3.651245e+06 3.925972e+06 25716.340 3.252331e+06 2.862619e+06 3.359707e+06 1.754446e+04 3.096591e+06 3.787908e+06 3.046815e+06 132767.36 2.853707e+06 3.853855e+06 3.215471e+06 4.767817e+04 2.847339e+06 4.040025e+06 2.701609e+06 1.675888e+05 3.247851e+06 3.749657e+06 3.760999e+06 1.072248e+05 2.622067e+06 3.467931e+06 3.256431e+06 3.358118e+06 3.297913e+06 3.553353e+06 3.613052e+06 2.962793e+06 1.039795e+07 5.279823e+06 5.138906e+06 4.140945e+06 4.366240e+06 4.527325e+06 3.033042e+06 5.041809e+06 4.464646e+06 5.463998e+06 2.680604e+06 3.452947e+06 2.330097e+06 4.227130e+06 4.170096e+06 4.414245e+06 2.644719e+06 3.717397e+06 4.114042e+06 2.537891e+06 2.137218e+06 4.163623e+06 4.589220e+06 3.672727e+06 5.065062e+06 5.661647e+06 4.377240e+06 2.824499e+06 1.846452e+06 2.709579e+06 2.306223e+06 3.444193e+06 4.337060e+06 3.678488e+06 5.362481e+06 2.095661e+06 3.830306e+06 3.833001e+06 4.840173e+06 4.014994e+06 8.168954e+06 4.528641e+06 2.759842e+06 2.920129e+06 3.506932e+06 2.936484e+06 4.258181e+06 3.226240e+06 3.557116e+06 3.900321e+06 2.805431e+06 4.970761e+06 4.181101e+06 5.380565e+06 3.667740e+06 5.005748e+06 3.141531e+06 2.631288e+06 3.509361e+06 4.238961e+06 3.451413e+06 2.807095e+06 4.034662e+06 2.762264e+06 5.129177e+06 6.287776e+06 3.805885e+06 2.713964e+06 3.095150e+06 4.951026e+06 3.770698e+06 3.922139e+06 3.171785e+06 3.434196e+06 2.486051e+06 4.359129e+06 4.142243e+06 3.368855e+06 3.417014e+06 3.637097e+06 3.643733e+06 6.008407e+06 2.506004e+06 4.466194e+06 3.648678e+06 2.853026e+06 4.513031e+06 5.169519e+06 2.930508e+06 3.464068e+06 4.069928e+06 3.593532e+06 2.437869e+06 4.171647e+06 3.594587e+06 4.207663e+06 3.390802e+06 4.294999e+06 2.041501e+06 3.324442e+06 5.611121e+06 2.266848e+06 4.695984e+06 5.531935e+06 2.926429e+06 1.878931e+06 4.487119e+06 3.082943e+06 5.838623e+06 3.671038e+06 3.094589e+06 3.014817e+06 3.307035e+06 5.238038e+06 2.018271e+06 2.937982e+06 2.552652e+06 2.818587e+06 2.518376e+06 5.201166e+06 2.257396e+06 2.916413e+06 2.968902e+06 6.391553e+05 3.767006e+06 3.263392e+06 3.192509e+06 1.716679e+06 4.073270e+06 3.120251e+06 3.328383e+06 2.201461e+06 3.372903e+06 6.357176e+06 2.959556e+06 3.103583e+06 3.579307e+06 3.149238e+06 3.307481e+06 2.320143e+05 3.649762e+06 2.250297e+06 3.395941e+06 3.806270e+06 2.058311e+06 2.274252e+06 2.647880e+06 2.488935e+06 1.904547e+06 4.043020e+06 4.289895e+06 1.552991e+06 2.484889e+06 3.236426e+06 2.325746e+06 1.157282e+06 3.206741e+06 3.644825e+06 3.267359e+06 2.592586e+06 1.610006e+06 1.345049e+06 4.116451e+06 2.927188e+06 1.728747e+06 3.934859e+06 3.442315e+06 2.161389e+06 6.180381e+06 3.613444e+06 2.821588e+06 1.846530e+06 2.600891e+06 3.122271e+06 4.248053e+06 2.641118e+06 3.500670e+06 1.794726e+06 3.029183e+06 4.848219e+06 2.197087e+06 2.155678e+06 2.866414e+06 4.950998e+06 4.639720e+06 2.321319e+06 4.214015e+06 2.912414e+06 3.635375e+06 2.223254e+06 4.362675e+06 2.775685e+06 2.972675e+06 3.313068e+06 2.484350e+06 3.386408e+06 2.606772e+06 5.106955e+06 3.814212e+06 3.285211e+06 3.478339e+06 4.052594e+06 3.719621e+06 4.789149e+06 5.118925e+06 3.882986e+06 3.304828e+06 5.146403e+06 5.396535e+06 C5 H8 N10 O3 P2_9.709 1.624268e+06 1.072581e+06 9.709699e+05 1.003028e+06 1.464951e+05 7.154010e+05 8.747131e+05 1.082389e+06 89508.11 7.214520e+05 1.502944e+06 9.336215e+05 69648.46 8.939294e+05 7.972436e+05 9.975189e+05 1.035083e+05 8.537363e+05 8.951560e+05 1.030341e+06 4.384241e+04 8.223282e+05 1.075505e+06 1.256512e+06 16337.465 8.695198e+05 9.240856e+05 8.782182e+05 1.866091e+04 7.824094e+05 9.373729e+05 1.257282e+06 80275.77 9.396828e+05 9.537914e+05 8.703073e+05 5.403843e+04 8.815332e+05 1.023999e+06 1.054215e+06 8.198463e+04 8.000578e+05 1.043389e+06 1.087912e+06 7.535917e+04 8.639204e+05 8.542419e+05 1.042572e+06 5.896116e+05 8.287263e+05 1.229594e+06 1.669452e+06 1.169323e+06 1.551295e+06 1.073226e+06 2.719454e+06 1.615789e+06 3.491789e+06 1.786982e+06 7.828361e+05 1.437987e+06 1.974833e+06 2.019844e+06 1.148484e+06 8.765979e+05 3.041533e+05 1.121768e+06 1.262748e+06 1.566246e+06 8.082324e+05 7.686434e+05 1.295941e+06 4.700584e+05 4.671009e+05 1.956896e+06 1.709420e+06 1.026842e+06 2.306359e+06 3.226032e+06 2.192395e+06 4.329424e+05 3.006623e+05 8.246010e+05 6.497531e+05 8.492794e+05 1.171981e+06 1.199808e+06 1.452727e+06 1.256014e+06 1.636968e+06 9.386654e+05 1.058945e+06 4.568611e+05 1.815003e+06 1.709814e+06 1.351711e+06 7.904100e+05 1.410972e+06 4.031295e+05 9.538993e+05 8.169561e+05 1.163136e+06 1.147685e+06 1.000968e+06 1.057714e+06 1.509696e+06 8.735836e+05 1.437884e+06 6.646738e+05 6.477908e+05 6.924861e+05 9.047744e+05 5.398246e+05 1.057674e+06 5.668481e+05 2.195976e+06 7.983140e+05 1.763608e+06 2.038190e+06 1.840607e+06 6.607900e+05 9.129893e+05 1.686959e+06 1.746865e+06 1.485225e+06 8.868914e+05 6.216491e+05 4.661273e+05 9.934835e+05 6.300877e+05 1.392092e+06 2.097444e+06 1.137604e+06 1.029634e+06 1.629973e+06 2.301722e+05 1.482063e+06 8.406913e+05 6.942903e+05 1.656298e+06 1.067703e+06 1.477940e+06 8.122326e+05 1.723450e+06 1.073131e+06 5.455149e+05 1.376704e+06 1.234753e+06 1.238536e+06 5.628818e+05 9.897473e+05 2.468641e+05 8.930639e+05 6.374451e+05 8.290071e+05 1.377830e+06 1.372966e+06 1.064547e+06 1.334333e+05 8.271494e+05 2.138393e+06 3.133173e+06 9.196922e+05 6.995931e+05 6.975760e+05 5.772967e+05 8.941411e+05 4.493532e+05 6.537477e+05 1.089150e+06 4.987960e+05 6.684275e+05 2.044042e+06 4.909415e+05 7.229077e+05 4.795318e+05 1.580917e+06 1.089828e+06 6.568392e+05 5.289329e+05 1.180691e+05 8.388259e+05 6.844772e+05 3.757541e+05 2.690553e+05 1.393148e+06 1.696914e+06 6.931366e+05 5.879509e+05 1.612058e+06 7.082085e+05 7.701704e+05 2.785747e+05 1.548966e+06 2.328749e+05 3.656176e+05 1.321013e+06 4.202988e+05 1.399858e+06 6.902648e+05 7.909798e+05 3.952161e+05 5.725203e+05 1.070718e+06 3.250353e+05 4.906295e+05 5.171059e+05 4.614911e+05 1.252801e+05 6.774020e+05 9.766537e+05 9.353622e+05 8.564212e+05 2.290683e+05 2.618112e+05 1.223514e+06 6.960846e+05 2.641137e+05 7.841370e+05 1.167839e+06 5.476075e+05 1.834163e+06 1.923465e+06 4.980054e+05 3.229521e+05 3.180225e+05 1.272750e+06 1.447002e+06 4.658581e+05 1.381514e+06 1.571360e+05 9.826605e+05 1.358724e+06 5.934362e+05 5.338998e+05 5.985955e+05 1.741480e+06 2.235678e+06 3.469513e+05 1.059635e+06 7.036964e+05 4.172033e+05 3.000913e+05 1.011444e+06 6.615660e+05 7.565250e+05 1.414891e+06 3.343904e+05 8.316706e+05 6.394407e+05 1.209757e+06 1.153183e+06 6.771253e+05 9.528321e+05 9.710044e+05 4.421480e+05 1.148939e+06 1.442326e+06 1.228101e+06 1.109119e+06 1.987699e+06 1.893991e+06 C3 H6 N2 O_9.71 1.567481e+07 1.025251e+07 1.162382e+07 9.923318e+06 2.089194e+05 7.220366e+06 6.764130e+06 1.185494e+07 142276.64 9.437644e+06 1.018161e+07 1.013454e+07 120942.67 9.753136e+06 9.484049e+06 9.758127e+06 1.612528e+05 9.252776e+06 1.016459e+07 8.402451e+06 6.148829e+04 8.326421e+06 1.101513e+07 9.930078e+06 77262.468 1.030953e+07 9.200955e+06 9.204206e+06 8.790955e+04 1.001582e+07 9.578732e+06 1.107083e+07 93780.29 8.592505e+06 9.476609e+06 8.334550e+06 9.191666e+04 1.004053e+07 9.610593e+06 1.104205e+07 1.236141e+05 8.704999e+06 1.059456e+07 1.010058e+07 8.854017e+04 8.793090e+06 8.895083e+06 1.015171e+07 7.681356e+06 9.294600e+06 9.277397e+06 8.878718e+06 9.827453e+06 1.408651e+07 1.300091e+07 2.181627e+07 1.532779e+07 2.367508e+07 1.279096e+07 1.016053e+07 1.377853e+07 1.640920e+07 1.518932e+07 9.547657e+06 9.264200e+06 5.634658e+06 1.134046e+07 1.125931e+07 1.315928e+07 8.775477e+06 8.776975e+06 1.183060e+07 5.995159e+06 7.489094e+06 1.458645e+07 1.431579e+07 1.229380e+07 1.646682e+07 2.369783e+07 1.374421e+07 7.004056e+06 6.253120e+06 8.346303e+06 8.173150e+06 8.283048e+06 1.120116e+07 1.088594e+07 1.331415e+07 1.136341e+07 1.275551e+07 1.075077e+07 1.248500e+07 8.829985e+06 1.342585e+07 1.298007e+07 1.333010e+07 8.169679e+06 1.056809e+07 7.256466e+06 1.042296e+07 9.567616e+06 9.423675e+06 1.318647e+07 9.622122e+06 1.003556e+07 1.311792e+07 9.030156e+06 1.124867e+07 1.005257e+07 7.802032e+06 7.073751e+06 1.057836e+07 7.214339e+06 9.891241e+06 6.595576e+06 1.914772e+07 1.109312e+07 1.197023e+07 1.508350e+07 1.264162e+07 6.491125e+06 8.875995e+06 1.396485e+07 1.454350e+07 1.061109e+07 6.919147e+06 9.502971e+06 5.777347e+06 1.414297e+07 9.537730e+06 1.103718e+07 1.342905e+07 1.147164e+07 9.337381e+06 1.437567e+07 5.779322e+06 1.070941e+07 9.221367e+06 6.712227e+06 1.552940e+07 8.798423e+06 1.483811e+07 9.792376e+06 1.466925e+07 1.272038e+07 7.174982e+06 1.096060e+07 1.103146e+07 1.517981e+07 1.094933e+07 8.833793e+06 8.090903e+06 9.878887e+06 1.179313e+07 1.001731e+07 1.317836e+07 1.328371e+07 1.096451e+07 9.997449e+06 9.435780e+06 1.193246e+07 2.721608e+07 1.107100e+07 8.588565e+06 8.828452e+06 6.716207e+06 9.456630e+06 5.829540e+06 6.441101e+06 7.490465e+06 8.625667e+06 9.304702e+06 1.328136e+07 5.760886e+06 8.796651e+06 6.599829e+06 1.465909e+07 9.786272e+06 8.103343e+06 7.865180e+06 3.105275e+06 8.529005e+06 9.922647e+06 6.835191e+06 6.082276e+06 1.211961e+07 1.551954e+07 8.185877e+06 8.454092e+06 1.077973e+07 5.684460e+06 9.489878e+06 1.140745e+07 1.100726e+07 5.299449e+06 8.592888e+06 1.218180e+07 5.638304e+06 1.107234e+07 9.690339e+06 1.073012e+07 6.297180e+06 5.751664e+06 1.268324e+07 5.121399e+06 6.799403e+06 7.282695e+06 6.441150e+06 7.148747e+06 7.707601e+06 9.574851e+06 1.107777e+07 7.640730e+06 5.690753e+06 4.407867e+06 1.410689e+07 7.884485e+06 4.874539e+06 9.884420e+06 1.074175e+07 7.590767e+06 1.349978e+07 1.411243e+07 5.529441e+06 7.671897e+06 7.036748e+06 9.576345e+06 1.170626e+07 6.630594e+06 1.628818e+07 5.590728e+06 1.006888e+07 1.237714e+07 7.291899e+06 6.644920e+06 6.323465e+06 1.883211e+07 1.718950e+07 6.347188e+06 1.318228e+07 1.163231e+07 8.392650e+06 5.369943e+06 1.450963e+07 8.013288e+06 8.360360e+06 9.432734e+06 6.984920e+06 1.014485e+07 8.661520e+06 1.324335e+07 1.076948e+07 8.472468e+06 1.032293e+07 1.513632e+07 6.795681e+06 1.178522e+07 1.346652e+07 7.925776e+06 7.660027e+06 1.576580e+07 1.737991e+07 ASPARAGINE 3.141842e+08 2.441046e+08 2.577618e+08 2.834624e+08 5.428265e+05 1.824072e+08 3.258096e+08 2.771194e+08 426423.55 2.266486e+08 2.434503e+08 2.884684e+08 331719.63 2.383596e+08 2.312625e+08 2.803203e+08 4.795956e+05 2.454044e+08 2.484731e+08 2.464268e+08 1.788922e+05 2.191410e+08 2.737154e+08 3.307822e+08 64870.878 2.327339e+08 2.334063e+08 2.466036e+08 1.027742e+05 2.468770e+08 2.671761e+08 2.773719e+08 297973.74 2.364088e+08 2.493056e+08 2.472640e+08 1.947494e+05 2.530196e+08 2.542130e+08 2.702664e+08 3.703621e+05 2.436794e+08 2.720218e+08 2.767901e+08 2.985169e+05 2.288817e+08 2.367390e+08 2.698331e+08 2.443266e+08 2.800407e+08 2.657409e+08 3.104836e+08 3.104181e+08 4.111917e+08 3.227602e+08 4.717916e+08 3.514501e+08 5.045544e+08 4.200996e+08 2.579370e+08 3.349800e+08 3.915960e+08 3.623004e+08 2.896797e+08 2.729776e+08 1.563413e+08 3.089275e+08 2.895703e+08 3.224034e+08 2.292083e+08 2.612329e+08 2.987149e+08 1.985352e+08 1.827792e+08 3.292840e+08 3.265745e+08 2.837787e+08 3.949674e+08 6.217384e+08 3.914202e+08 1.925014e+08 1.764448e+08 2.194883e+08 2.051686e+08 2.273974e+08 2.908848e+08 2.906942e+08 3.476584e+08 2.760531e+08 3.296660e+08 2.756124e+08 2.945006e+08 2.283328e+08 4.049412e+08 3.835684e+08 3.166963e+08 2.273345e+08 3.179410e+08 1.944509e+08 2.559536e+08 2.524348e+08 2.838757e+08 2.795803e+08 2.668648e+08 2.881204e+08 2.945577e+08 2.745920e+08 2.972528e+08 2.580848e+08 2.181615e+08 1.817541e+08 2.438932e+08 2.125326e+08 3.030250e+08 1.976059e+08 4.192850e+08 2.750040e+08 3.643363e+08 3.870396e+08 3.928764e+08 1.893307e+08 2.353140e+08 3.515675e+08 3.536941e+08 3.598670e+08 2.673442e+08 2.240245e+08 1.693631e+08 3.712207e+08 2.654652e+08 2.860448e+08 3.719726e+08 3.238152e+08 2.554942e+08 3.868929e+08 1.396718e+08 3.243572e+08 2.326711e+08 1.996697e+08 3.511234e+08 2.444218e+08 3.094868e+08 2.768973e+08 3.558426e+08 2.648318e+08 1.868679e+08 2.841735e+08 3.083875e+08 3.582011e+08 2.758016e+08 2.461661e+08 2.307538e+08 2.291494e+08 3.091862e+08 2.362765e+08 3.104077e+08 3.554459e+08 1.936403e+08 1.975072e+08 2.541765e+08 3.388821e+08 6.696072e+08 2.532208e+08 2.012743e+08 2.696055e+08 2.269938e+08 2.767280e+08 1.769692e+08 2.123159e+08 2.772327e+08 2.305235e+08 2.346817e+08 4.430501e+08 1.893417e+08 2.154946e+08 1.773145e+08 3.763425e+08 2.690538e+08 2.341586e+08 2.265065e+08 1.123273e+08 2.589353e+08 2.165385e+08 1.914876e+08 1.516287e+08 3.217035e+08 3.806981e+08 2.275237e+08 2.279366e+08 2.873304e+08 2.162476e+08 2.211624e+08 3.197783e+08 3.191047e+08 1.539994e+08 2.548577e+08 3.458369e+08 1.723582e+08 3.096317e+08 2.509750e+08 2.523250e+08 1.570360e+08 2.195670e+08 3.405483e+08 1.355504e+08 2.002441e+08 1.802651e+08 1.818243e+08 1.890688e+08 1.717687e+08 2.616114e+08 2.744917e+08 1.797088e+08 1.475519e+08 1.142119e+08 3.323732e+08 2.116036e+08 1.620056e+08 2.749510e+08 3.422536e+08 2.074347e+08 4.023323e+08 3.447329e+08 2.292133e+08 2.000605e+08 2.037618e+08 2.627196e+08 3.172485e+08 1.936302e+08 3.102669e+08 1.324048e+08 2.644832e+08 3.055476e+08 1.997565e+08 1.986279e+08 2.116290e+08 4.425865e+08 4.747126e+08 1.599671e+08 3.131041e+08 2.533908e+08 1.835755e+08 1.586632e+08 3.205497e+08 2.397000e+08 2.543076e+08 2.478763e+08 1.775890e+08 1.903691e+08 2.099131e+08 3.202548e+08 2.917040e+08 2.106238e+08 3.030268e+08 3.247307e+08 2.076817e+08 2.706837e+08 3.608094e+08 2.904217e+08 2.358831e+08 4.044981e+08 3.788221e+08 C4 H5 N O3_9.712 3.119122e+08 2.412860e+08 2.556370e+08 2.817761e+08 3.882691e+05 1.803169e+08 3.216574e+08 2.747227e+08 310618.42 2.235748e+08 2.406319e+08 2.864756e+08 236603.72 2.365323e+08 2.286144e+08 2.777932e+08 3.555379e+05 2.428092e+08 2.459363e+08 2.437773e+08 1.272070e+05 2.169911e+08 2.710225e+08 3.277650e+08 46365.949 2.303964e+08 2.308996e+08 2.441019e+08 8.313758e+04 2.445748e+08 2.646168e+08 2.746044e+08 212063.62 2.338089e+08 2.469086e+08 2.443433e+08 1.386332e+05 2.505493e+08 2.524830e+08 2.672791e+08 2.739561e+05 2.413539e+08 2.692099e+08 2.741447e+08 2.129825e+05 2.262026e+08 2.346607e+08 2.671251e+08 2.426282e+08 2.782688e+08 2.637525e+08 3.030555e+08 3.089811e+08 4.082887e+08 3.206221e+08 4.671344e+08 3.484684e+08 5.000560e+08 4.163056e+08 2.547245e+08 3.323015e+08 3.886766e+08 3.589330e+08 2.877772e+08 2.698409e+08 1.546904e+08 3.056687e+08 2.872236e+08 3.195870e+08 2.267533e+08 2.581417e+08 2.962653e+08 1.971937e+08 1.818521e+08 3.266911e+08 3.226815e+08 2.797244e+08 3.915720e+08 6.183017e+08 3.880375e+08 1.911710e+08 1.750618e+08 2.176544e+08 2.030961e+08 2.252081e+08 2.873218e+08 2.883770e+08 3.446354e+08 2.734034e+08 3.268788e+08 2.736521e+08 2.886864e+08 2.267629e+08 4.017025e+08 3.806952e+08 3.120653e+08 2.225101e+08 3.163346e+08 1.932292e+08 2.534087e+08 2.502877e+08 2.801024e+08 2.763399e+08 2.634634e+08 2.850262e+08 2.926641e+08 2.728479e+08 2.949057e+08 2.562910e+08 2.163888e+08 1.797120e+08 2.420678e+08 2.110198e+08 2.990853e+08 1.937368e+08 4.152186e+08 2.730655e+08 3.601433e+08 3.840494e+08 3.901226e+08 1.866096e+08 2.337815e+08 3.482777e+08 3.502009e+08 3.570217e+08 2.651888e+08 2.225576e+08 1.673542e+08 3.678995e+08 2.634239e+08 2.843777e+08 3.705102e+08 3.210303e+08 2.527593e+08 3.834577e+08 1.388462e+08 3.208861e+08 2.293821e+08 1.977604e+08 3.472249e+08 2.413907e+08 3.063215e+08 2.744156e+08 3.518193e+08 2.616704e+08 1.844313e+08 2.808798e+08 3.052386e+08 3.542797e+08 2.742345e+08 2.441902e+08 2.300659e+08 2.268445e+08 3.076948e+08 2.319042e+08 3.080447e+08 3.532086e+08 1.910308e+08 1.965764e+08 2.523017e+08 3.365164e+08 6.658135e+08 2.507693e+08 1.996592e+08 2.679824e+08 2.251900e+08 2.755886e+08 1.755219e+08 2.105245e+08 2.740707e+08 2.290349e+08 2.321166e+08 4.398534e+08 1.878029e+08 2.134768e+08 1.737966e+08 3.738854e+08 2.667967e+08 2.330864e+08 2.238905e+08 1.104813e+08 2.571244e+08 2.146239e+08 1.898286e+08 1.499448e+08 3.184156e+08 3.779986e+08 2.258170e+08 2.270363e+08 2.855339e+08 2.155997e+08 2.185839e+08 3.177384e+08 3.162461e+08 1.524616e+08 2.531816e+08 3.440141e+08 1.704549e+08 3.072696e+08 2.490973e+08 2.498248e+08 1.551201e+08 2.183744e+08 3.379134e+08 1.346632e+08 1.976032e+08 1.790811e+08 1.801547e+08 1.881383e+08 1.701717e+08 2.597235e+08 2.718004e+08 1.782366e+08 1.465503e+08 1.128363e+08 3.292513e+08 2.097222e+08 1.611298e+08 2.714190e+08 3.396117e+08 2.061026e+08 3.977193e+08 3.416395e+08 2.282086e+08 1.988611e+08 2.034195e+08 2.618669e+08 3.151415e+08 1.913991e+08 3.072215e+08 1.312326e+08 2.626967e+08 3.032928e+08 1.978964e+08 1.968878e+08 2.099403e+08 4.404062e+08 4.705832e+08 1.588470e+08 3.107236e+08 2.511255e+08 1.818312e+08 1.563206e+08 3.183573e+08 2.375709e+08 2.510893e+08 2.460843e+08 1.770474e+08 1.885672e+08 2.077094e+08 3.189210e+08 2.894009e+08 2.085549e+08 3.009369e+08 3.229793e+08 2.048017e+08 2.681406e+08 3.582308e+08 2.884575e+08 2.332721e+08 4.017083e+08 3.754940e+08 C6 H12 N2 O_9.718 1.877174e+05 4.327951e+05 4.294826e+05 4.660216e+05 1.842427e+05 2.919853e+05 3.458485e+05 3.723013e+05 125211.59 4.840168e+05 5.162941e+05 4.449418e+05 95172.67 2.943127e+05 3.537905e+05 4.695876e+05 1.374516e+05 4.299160e+05 3.729424e+05 2.855777e+05 4.867560e+04 4.818230e+05 4.663596e+05 5.440662e+05 16774.633 2.451065e+05 3.492129e+05 3.533545e+05 1.514770e+04 4.779306e+05 4.523543e+05 5.547590e+05 66141.05 3.163849e+05 4.121488e+05 3.566338e+05 5.574380e+04 3.306862e+05 4.591109e+05 4.996992e+05 1.018571e+05 2.755367e+05 5.180329e+05 4.037352e+05 1.249110e+05 2.636943e+05 4.050958e+05 4.706886e+05 3.231934e+05 7.523751e+05 2.545686e+06 1.792647e+05 3.224682e+05 3.953214e+05 1.394975e+05 1.690990e+05 9.794722e+05 2.194018e+05 1.565630e+05 1.481519e+05 1.494230e+05 1.621226e+05 2.871704e+05 3.293864e+05 1.552893e+05 1.334114e+05 1.458578e+05 1.209465e+05 2.694230e+05 1.106066e+05 1.497995e+05 1.298366e+05 1.557685e+05 1.084283e+05 2.627980e+05 1.049544e+05 1.772755e+05 4.207955e+05 3.171270e+05 1.744902e+05 1.510662e+05 1.389761e+05 3.153836e+05 2.199454e+05 1.271095e+05 1.637837e+05 9.055578e+05 2.528082e+05 2.825780e+05 1.238486e+05 1.926421e+05 1.296800e+05 1.454142e+05 2.089980e+06 2.054821e+05 1.206883e+05 6.568413e+05 1.636724e+05 1.052680e+05 1.723825e+05 2.028392e+05 9.208972e+04 1.117012e+05 1.707823e+05 4.851869e+05 1.101130e+05 6.048010e+05 2.355965e+05 1.250347e+05 7.121213e+05 1.628307e+05 3.116050e+05 2.162463e+05 2.588240e+05 2.488131e+05 1.611997e+05 2.482471e+05 1.623674e+05 2.807510e+05 3.426835e+05 5.672644e+05 6.000024e+05 1.691979e+05 1.635598e+05 1.926943e+05 4.225277e+05 1.462919e+05 3.483887e+05 1.416448e+05 2.723915e+05 1.230500e+05 1.498718e+05 1.432230e+05 1.514465e+05 2.125627e+05 4.535298e+05 3.662219e+05 2.218969e+05 2.892096e+05 1.808256e+05 3.012353e+05 1.009791e+07 1.224566e+05 2.105127e+05 2.636833e+05 3.299682e+05 1.599804e+05 3.991904e+05 3.240480e+05 2.203483e+05 4.891076e+05 3.545053e+05 5.871893e+06 2.982140e+05 7.681887e+05 4.129751e+05 9.766310e+05 3.440680e+05 1.057262e+05 1.492447e+05 4.937611e+05 2.793159e+05 2.353419e+05 2.692939e+05 3.874546e+05 3.470229e+05 1.830062e+05 1.365416e+06 1.013288e+06 2.292425e+05 2.384972e+05 1.283237e+05 1.894594e+05 1.614300e+05 1.268931e+05 2.768574e+05 4.705573e+05 2.837238e+05 1.161873e+05 4.196736e+05 1.942225e+05 1.491982e+05 2.165495e+05 2.142397e+05 1.125626e+05 1.309030e+05 2.791287e+05 3.699495e+05 3.602086e+05 7.876958e+05 6.766062e+05 2.517268e+05 1.223229e+05 1.516157e+05 8.095894e+05 9.314538e+05 1.574189e+05 9.745204e+04 4.582731e+05 1.203315e+05 1.408961e+05 3.442268e+05 2.666286e+05 1.363357e+05 1.769606e+05 3.157276e+05 1.485209e+05 1.756286e+05 3.301237e+05 1.826764e+05 1.274124e+05 1.136913e+05 1.414600e+05 2.082684e+05 1.072250e+05 1.990875e+05 4.335904e+05 1.038370e+06 1.506862e+05 1.436305e+05 1.054684e+06 1.503881e+05 2.477927e+05 4.067121e+05 1.112521e+05 1.494247e+05 2.661171e+05 2.777129e+05 1.711110e+05 2.723001e+05 1.457143e+05 1.536726e+05 2.776552e+05 1.144292e+05 2.968260e+05 1.644982e+05 1.924671e+05 2.175638e+05 2.356630e+05 1.127653e+06 2.019124e+05 2.571437e+05 2.262185e+05 1.642035e+05 2.376590e+05 1.440057e+05 1.850089e+05 1.359680e+05 1.130994e+05 1.143494e+05 1.380879e+05 1.234914e+05 3.262950e+05 1.481564e+05 1.812785e+05 1.153540e+05 1.498138e+05 2.122463e+05 1.309516e+05 1.759171e+05 3.899702e+05 1.453315e+05 C2 H2 N8 O_9.744 2.065422e+06 2.140559e+06 1.853667e+06 2.242074e+06 7.976915e+04 1.549812e+06 2.146131e+06 2.205764e+06 72239.81 2.692750e+06 2.303832e+06 1.629676e+06 69656.48 1.592252e+06 2.085051e+06 2.084010e+06 1.312802e+05 1.936788e+06 2.080681e+06 2.218770e+06 5.065713e+04 1.840378e+06 2.208165e+06 2.269646e+06 18733.994 1.937043e+06 2.159018e+06 2.043574e+06 1.857675e+04 1.853188e+06 1.932456e+06 2.197064e+06 85738.40 2.226745e+06 2.290588e+06 1.930712e+06 5.912165e+04 1.767287e+06 2.034342e+06 1.892399e+06 8.701403e+04 1.879215e+06 2.401439e+06 2.202287e+06 8.464916e+04 2.337520e+06 1.712469e+06 2.044334e+06 2.684201e+06 1.513033e+06 1.609791e+06 3.364485e+06 1.712595e+06 1.922071e+06 1.689268e+06 4.187487e+06 2.029965e+06 3.375275e+06 1.679756e+06 2.610770e+06 2.181424e+06 2.255443e+06 2.816372e+06 1.590771e+06 2.857792e+06 1.307763e+06 2.578106e+06 1.958597e+06 2.274568e+06 1.985462e+06 2.763807e+06 2.281834e+06 1.412097e+06 1.727797e+06 2.293802e+06 3.467017e+06 2.074766e+06 2.523431e+06 2.706931e+06 2.850973e+06 1.307397e+06 1.603199e+06 1.532076e+06 1.772587e+06 1.721037e+06 1.844461e+06 1.835151e+06 2.586311e+06 2.039900e+06 2.026026e+06 1.523765e+06 4.016964e+06 1.071664e+06 3.048377e+06 2.230007e+06 4.100996e+06 2.528363e+06 2.493569e+06 2.899759e+06 1.826888e+06 1.711590e+06 3.271999e+06 2.471942e+06 3.177769e+06 2.256582e+06 2.513140e+06 1.592704e+06 1.793400e+06 1.265035e+06 1.641448e+06 1.776602e+06 1.682458e+06 1.073781e+06 3.441490e+06 3.496464e+06 3.717709e+06 1.282055e+06 3.873766e+06 2.399376e+06 2.317827e+06 1.538875e+06 1.655500e+06 3.083194e+06 2.891633e+06 2.224890e+06 1.377250e+06 1.568599e+06 1.823777e+06 2.957865e+06 1.820564e+06 2.352922e+06 2.442596e+06 2.267741e+06 2.371916e+06 2.799359e+06 9.921451e+05 3.038856e+06 1.993226e+06 1.658718e+06 3.796756e+06 2.783182e+06 2.524945e+06 2.194863e+06 3.237957e+06 2.606140e+06 2.183738e+06 2.905376e+06 3.046233e+06 3.349928e+06 1.166304e+06 1.709502e+06 1.978031e+05 1.797277e+06 1.028003e+06 1.886593e+06 2.303700e+06 1.734645e+06 2.285077e+06 2.467677e+05 1.617228e+06 1.930232e+06 1.835362e+06 1.861016e+06 1.666558e+06 1.236657e+06 1.516330e+06 1.544692e+06 1.158096e+06 1.488652e+06 2.291576e+06 1.443337e+06 2.007996e+06 2.684394e+06 1.126905e+06 1.651149e+06 2.434433e+06 1.839373e+06 2.296789e+06 1.103522e+06 2.661825e+06 1.774700e+06 1.367088e+06 1.416603e+06 1.473509e+06 1.367399e+06 2.878589e+06 2.665611e+06 1.333027e+06 1.506722e+06 1.567843e+06 1.378077e+06 2.144693e+06 1.879184e+05 2.504206e+06 1.566018e+06 1.578057e+06 1.450403e+06 1.279813e+06 1.541719e+06 1.437318e+06 2.131049e+06 1.539263e+06 8.989895e+05 2.219703e+06 8.143117e+05 2.220019e+06 1.281422e+06 1.206073e+06 4.370984e+05 1.383129e+06 1.652960e+06 2.086335e+06 1.089485e+06 7.244962e+05 8.874899e+05 2.445628e+06 1.538577e+06 6.650706e+05 3.047571e+06 1.834454e+06 1.487686e+06 4.185972e+06 2.490732e+06 5.893747e+05 6.713085e+05 5.285206e+05 1.699218e+06 1.568046e+06 2.006878e+06 2.654463e+06 8.237146e+05 1.334005e+06 1.823159e+06 1.534391e+06 1.341715e+06 1.313958e+06 2.358885e+06 3.496868e+06 1.170828e+06 2.277724e+06 1.683340e+06 1.502567e+06 1.476608e+06 2.329433e+06 1.802086e+06 2.315833e+06 1.776056e+06 9.045992e+05 1.442220e+06 2.533569e+06 2.631755e+06 1.814389e+06 1.987254e+06 2.210979e+06 1.934806e+06 2.433078e+06 2.263526e+06 3.308774e+06 1.770217e+06 2.374714e+06 2.065418e+06 2.753410e+06 C7 H12 N2 O4_9.752 6.301689e+05 9.070620e+05 8.334640e+05 8.942328e+05 1.023570e+05 5.436167e+05 8.348480e+05 1.029482e+06 81403.43 8.495224e+05 8.161265e+05 7.967439e+05 63451.65 7.658168e+05 8.742887e+05 8.835735e+05 1.010196e+05 7.773369e+05 6.921554e+05 9.019725e+05 4.370674e+04 7.454907e+05 9.004869e+05 1.033085e+06 26478.336 7.159658e+05 7.663546e+05 7.892449e+05 2.233139e+04 8.670601e+05 7.834914e+05 9.518574e+05 56331.42 8.207079e+05 8.119456e+05 7.385742e+05 3.813973e+04 8.100020e+05 8.431966e+05 9.060436e+05 9.483521e+04 7.735520e+05 8.462512e+05 8.833847e+05 5.420054e+04 8.219450e+05 7.232570e+05 8.909230e+05 7.737505e+04 1.674547e+05 2.043135e+05 2.440005e+05 9.371203e+04 4.200885e+06 3.870918e+06 1.509082e+05 1.735659e+05 1.262333e+05 1.662892e+05 9.731974e+04 1.186532e+05 7.316233e+06 1.430726e+05 1.060759e+05 9.214165e+04 7.875640e+04 1.740710e+06 1.087933e+05 1.654176e+05 8.759001e+04 1.477284e+05 9.641202e+04 9.680068e+04 2.439276e+05 3.587510e+06 1.678671e+06 1.987072e+05 7.697507e+05 2.991014e+06 1.562983e+06 8.142928e+04 8.171306e+04 1.215564e+05 1.098890e+05 3.271952e+05 9.276611e+05 8.470705e+04 2.120160e+06 2.487035e+05 9.321283e+04 9.470597e+04 8.980615e+06 1.486216e+05 5.159365e+06 1.419300e+05 4.205589e+06 2.966500e+06 1.372260e+05 8.445374e+05 1.162109e+05 4.975469e+06 2.073080e+06 2.129968e+06 2.682187e+06 2.798864e+06 4.360239e+06 5.689768e+05 6.794825e+06 1.237973e+05 8.753505e+05 1.169719e+05 2.018147e+05 3.044825e+06 9.239249e+05 4.573881e+05 5.105253e+06 8.943124e+05 3.039808e+06 1.891353e+05 1.763048e+05 4.817365e+05 4.177948e+05 1.915738e+06 1.629430e+05 1.175908e+05 1.430411e+05 8.295609e+05 1.504361e+05 1.537907e+06 1.097726e+05 9.904840e+04 1.087624e+05 2.039343e+05 1.083829e+06 2.300158e+06 2.717413e+05 4.919997e+05 6.071262e+05 1.451091e+05 2.231990e+06 3.514061e+06 5.912327e+05 1.558444e+06 4.498696e+05 7.180071e+06 1.204193e+05 1.143785e+05 5.915753e+05 7.076860e+05 9.589411e+04 1.381397e+05 1.922402e+05 6.971383e+05 2.276541e+06 1.070026e+06 1.577026e+05 1.101696e+05 1.378053e+05 2.121365e+05 1.050820e+06 1.798135e+05 2.658184e+05 1.025820e+06 5.841633e+05 1.939744e+05 1.707261e+06 1.494950e+05 4.580974e+05 9.916040e+05 2.665960e+05 2.416188e+05 2.429373e+05 2.684774e+05 8.825586e+04 6.152618e+05 8.465758e+04 1.356535e+06 1.142631e+06 5.453816e+05 8.192521e+04 8.693000e+04 9.368067e+04 1.622317e+05 8.237503e+05 3.489465e+05 9.767947e+04 1.212737e+05 4.162535e+05 8.449880e+04 2.052337e+05 4.980221e+05 6.599678e+05 9.595459e+04 3.745693e+06 8.315702e+04 1.204240e+06 1.658015e+06 8.437812e+04 8.807477e+04 2.641680e+05 1.423101e+05 1.925206e+06 1.545499e+05 1.335324e+06 4.465622e+05 7.856146e+04 2.083956e+05 8.470172e+04 1.239137e+05 9.384139e+04 1.471483e+06 8.613822e+04 2.285110e+05 7.115678e+05 7.030766e+04 1.031490e+06 1.435071e+06 1.228976e+05 6.620897e+05 1.384540e+05 2.754874e+05 9.243987e+05 1.477606e+06 9.323480e+04 1.653198e+05 1.471648e+05 1.495936e+05 1.555389e+06 1.921464e+05 1.439557e+06 5.295492e+05 1.247694e+05 3.248911e+06 2.016165e+05 7.654456e+06 9.493956e+04 7.688521e+05 3.093435e+05 2.264880e+05 9.728150e+04 7.329109e+05 1.140426e+05 8.178676e+04 9.640387e+05 8.258863e+05 3.528583e+05 4.187042e+05 9.457365e+04 5.750780e+06 8.175845e+04 1.554257e+05 1.005958e+05 1.616153e+06 9.853166e+04 3.419667e+06 8.520371e+04 1.340321e+05 9.085801e+04 8.352035e+05 2.756046e+05 1.132948e+06 2.257014e+05 SERINE 5.838644e+08 4.390171e+08 4.587289e+08 4.658633e+08 2.575125e+05 3.249098e+08 4.736666e+08 4.693520e+08 287633.91 4.178256e+08 4.470640e+08 4.758963e+08 220937.28 4.182372e+08 4.196181e+08 4.678032e+08 2.760496e+05 4.194473e+08 3.895429e+08 3.957571e+08 1.280701e+05 4.128486e+08 4.705865e+08 5.574236e+08 408290.779 3.791084e+08 4.376997e+08 4.172733e+08 1.061566e+06 4.194124e+08 4.290073e+08 4.864862e+08 680180.57 4.178494e+08 4.402842e+08 3.898732e+08 1.242199e+05 4.216072e+08 4.482509e+08 4.792736e+08 5.840924e+05 4.107996e+08 4.694420e+08 4.664886e+08 1.578770e+05 3.913870e+08 3.810439e+08 4.787570e+08 3.612072e+08 3.910885e+08 5.872557e+08 6.033990e+08 4.346891e+08 6.141065e+08 5.364369e+08 5.699937e+08 6.392300e+08 7.811988e+08 5.677329e+08 4.967812e+08 6.205012e+08 5.453345e+08 7.258134e+08 6.928614e+08 4.406606e+08 4.277979e+08 7.104450e+08 4.316868e+08 5.970028e+08 4.925326e+08 5.480814e+08 7.442762e+08 5.437650e+08 4.325680e+08 5.855661e+08 4.788821e+08 5.777375e+08 5.890294e+08 9.163125e+08 5.621213e+08 2.739667e+08 3.599620e+08 3.470998e+08 4.867055e+08 4.622510e+08 5.561779e+08 3.388692e+08 5.215350e+08 4.422543e+08 6.538286e+08 3.543662e+08 4.759336e+08 3.383796e+08 6.164782e+08 4.980201e+08 6.241453e+08 4.807710e+08 4.314857e+08 3.309532e+08 3.373509e+08 5.911309e+08 4.217750e+08 4.272006e+08 4.987420e+08 6.408332e+08 5.546777e+08 5.378456e+08 4.711941e+08 3.171349e+08 4.258968e+08 4.157948e+08 4.237698e+08 3.986928e+08 4.826022e+08 4.306708e+08 6.020741e+08 5.281077e+08 4.267062e+08 6.270154e+08 5.037591e+08 4.268046e+08 4.906701e+08 5.804972e+08 4.858420e+08 4.677667e+08 3.935578e+08 4.586004e+08 3.952268e+08 4.682551e+08 2.952498e+08 4.139749e+08 7.687536e+08 4.350950e+08 4.899684e+08 4.454967e+08 3.459396e+08 5.238424e+08 3.707059e+08 4.196210e+08 5.431049e+08 4.892215e+08 3.853701e+08 4.867065e+08 4.928174e+08 5.938911e+08 4.032878e+08 4.363331e+08 4.463541e+08 4.787210e+08 4.032818e+08 3.720958e+08 4.144799e+08 5.564397e+08 3.628147e+08 5.669690e+08 5.242020e+08 5.446800e+08 5.483288e+08 4.115691e+08 4.160404e+08 7.201720e+08 5.162697e+08 5.029629e+08 3.095971e+08 4.156406e+08 4.711490e+08 4.194839e+08 3.622474e+08 3.578590e+08 5.783695e+08 3.419163e+08 5.499301e+08 6.063871e+08 3.307048e+08 3.892692e+08 2.506823e+08 7.934806e+08 5.049240e+08 3.248325e+08 3.666057e+08 2.554666e+08 5.102956e+08 4.091231e+08 2.497756e+08 3.438164e+08 4.667532e+08 5.139093e+08 4.378053e+08 4.263190e+08 3.527431e+08 3.465323e+08 3.607422e+08 4.324521e+08 4.992444e+08 2.025225e+08 3.627089e+08 4.231895e+08 3.954811e+08 4.436905e+08 3.692586e+08 5.522759e+08 3.364608e+08 4.349177e+08 5.925202e+08 2.314447e+08 3.685938e+08 4.644612e+08 3.004344e+08 4.302495e+08 3.529203e+08 5.017479e+08 5.815465e+08 2.933199e+08 3.805433e+08 2.602486e+08 5.140810e+08 4.341555e+08 2.793405e+08 4.961938e+08 5.011207e+08 4.411645e+08 7.206618e+08 6.455391e+08 2.216498e+08 3.691870e+08 3.522077e+08 5.105110e+08 5.183322e+08 3.852037e+08 5.437922e+08 3.582173e+08 4.116487e+08 5.386914e+08 4.370564e+08 6.695703e+08 4.173474e+08 6.234276e+08 5.930911e+08 3.634964e+08 4.405401e+08 5.046042e+08 3.692320e+08 3.989619e+08 5.577798e+08 4.203165e+08 5.589116e+08 5.175834e+08 4.073933e+08 4.210411e+08 4.046789e+08 4.981123e+08 5.946079e+08 5.360242e+08 5.092315e+08 6.568144e+08 4.649245e+08 6.022648e+08 3.871442e+08 4.940123e+08 3.099327e+08 5.397877e+08 6.818445e+08 dehydroalanine_9.763 3.270641e+07 2.354104e+07 2.410840e+07 2.436983e+07 1.233315e+05 1.990149e+07 2.600558e+07 2.649459e+07 104489.31 2.214766e+07 2.405661e+07 2.624758e+07 93204.34 2.266661e+07 2.248107e+07 2.528498e+07 1.305882e+05 2.232265e+07 1.996989e+07 2.549704e+07 7.044702e+04 2.171998e+07 2.535756e+07 3.022180e+07 16456.920 2.061539e+07 2.297145e+07 2.300408e+07 2.064092e+04 2.207704e+07 2.380625e+07 2.714825e+07 74665.96 2.303351e+07 2.361670e+07 2.127344e+07 6.718590e+04 2.286819e+07 2.398702e+07 2.699181e+07 7.140351e+04 2.192592e+07 2.503826e+07 2.595704e+07 7.294636e+04 2.153799e+07 2.062025e+07 2.599180e+07 1.830117e+07 2.177485e+07 3.232862e+07 3.340255e+07 2.365156e+07 3.231169e+07 2.956564e+07 3.252948e+07 3.435545e+07 4.413609e+07 3.090804e+07 2.738385e+07 3.353719e+07 3.067680e+07 3.843515e+07 3.820411e+07 2.422904e+07 2.310607e+07 3.679803e+07 2.300513e+07 3.133386e+07 3.042563e+07 3.025738e+07 4.037000e+07 2.568752e+07 2.029242e+07 3.104818e+07 2.359379e+07 3.045553e+07 3.054373e+07 5.200625e+07 2.962474e+07 1.410357e+07 1.851169e+07 1.878939e+07 2.333871e+07 2.452995e+07 3.052287e+07 1.889385e+07 2.860939e+07 2.345281e+07 3.509351e+07 1.933887e+07 2.571708e+07 1.795268e+07 3.416311e+07 2.634244e+07 3.618939e+07 2.493223e+07 2.239834e+07 1.650818e+07 1.893523e+07 3.180671e+07 2.241138e+07 2.225204e+07 2.666982e+07 3.521182e+07 3.095240e+07 2.684640e+07 2.605335e+07 1.664175e+07 1.860918e+07 2.301130e+07 2.300796e+07 2.175466e+07 2.622118e+07 2.300109e+07 2.836587e+07 2.882641e+07 2.860146e+07 3.428561e+07 2.408128e+07 2.056439e+07 2.662314e+07 3.165492e+07 2.711041e+07 2.650142e+07 2.047895e+07 2.423582e+07 2.207628e+07 2.601080e+07 1.656073e+07 2.288400e+07 4.212215e+07 2.478752e+07 2.625491e+07 2.565924e+07 1.604659e+07 2.842675e+07 1.991298e+07 2.347138e+07 2.951885e+07 2.670276e+07 2.193422e+07 2.607857e+07 2.786380e+07 3.174883e+07 2.115864e+07 2.373260e+07 2.427739e+07 2.549876e+07 2.122452e+07 2.216644e+07 2.155756e+07 2.594458e+07 1.966658e+07 3.009806e+07 2.914137e+07 2.921290e+07 2.970031e+07 2.081999e+07 2.077887e+07 3.871284e+07 2.989002e+07 2.196472e+07 1.644113e+07 2.198209e+07 2.507275e+07 2.260226e+07 1.994516e+07 1.883878e+07 3.155621e+07 1.726640e+07 2.736912e+07 3.374800e+07 1.737913e+07 2.039182e+07 1.523897e+07 4.392951e+07 2.474348e+07 1.794623e+07 2.016262e+07 1.030998e+07 2.698261e+07 2.179286e+07 1.365821e+07 1.767740e+07 2.565556e+07 2.456663e+07 2.366201e+07 2.222690e+07 1.881883e+07 1.859328e+07 1.990786e+07 2.373748e+07 2.725855e+07 1.013957e+07 1.960493e+07 2.096579e+07 2.084519e+07 2.490966e+07 2.014346e+07 3.093596e+07 1.544982e+07 2.263542e+07 3.386011e+07 1.238754e+07 1.901127e+07 2.394939e+07 1.650562e+07 2.267576e+07 1.887928e+07 2.537653e+07 2.769692e+07 1.609978e+07 2.005849e+07 3.491798e+06 2.426878e+07 2.423850e+07 1.692421e+07 2.669312e+07 2.745144e+07 2.360763e+07 4.055540e+07 3.548591e+07 1.317193e+07 1.990774e+07 1.824813e+07 2.737415e+07 2.657346e+07 2.004979e+07 2.974687e+07 1.758475e+07 2.158649e+07 3.138177e+07 2.326793e+07 3.669669e+07 2.273549e+07 3.300061e+07 3.231396e+07 1.947908e+07 2.411733e+07 2.248639e+07 1.985108e+07 2.048663e+07 3.029363e+07 2.261443e+07 3.013691e+07 2.745812e+07 2.193207e+07 2.353584e+07 2.175253e+07 2.731854e+07 3.243584e+07 2.917945e+07 2.776706e+07 3.593557e+07 2.620014e+07 3.240150e+07 2.107930e+07 2.696151e+07 1.654692e+07 2.965680e+07 3.786120e+07 C6 H13 N O4_9.794 4.193694e+06 1.185904e+06 1.092227e+06 1.425537e+06 9.765794e+04 7.835071e+05 1.347777e+06 1.252670e+06 79194.98 1.148171e+06 1.223127e+06 1.271864e+06 59571.59 1.104940e+06 1.121376e+06 1.229456e+06 9.288452e+04 1.126379e+06 1.098834e+06 1.104703e+06 3.680432e+04 1.070595e+06 1.317547e+06 1.456500e+06 19058.968 1.065591e+06 1.137967e+06 1.195487e+06 1.315619e+04 1.078712e+06 1.078801e+06 1.316138e+06 59528.47 1.115545e+06 1.196002e+06 1.246292e+06 3.834723e+04 1.089607e+06 1.166056e+06 1.208630e+06 5.480446e+04 1.108720e+06 1.213356e+06 1.415796e+06 5.533390e+04 1.035425e+06 1.031191e+06 1.247405e+06 1.178860e+06 7.125250e+05 9.923001e+05 6.565861e+05 1.154081e+06 1.548006e+06 1.958100e+06 1.786254e+06 1.959469e+06 2.139475e+06 1.998689e+06 2.344624e+06 1.927100e+06 1.652038e+06 1.410581e+06 1.473358e+06 1.616934e+06 8.461391e+05 1.416026e+06 1.379650e+06 1.082396e+06 9.615502e+05 1.360325e+06 1.122079e+06 1.443140e+06 1.414200e+06 2.252216e+06 2.632967e+06 1.390886e+06 2.117333e+06 2.924264e+06 1.614063e+06 1.387519e+06 8.267373e+05 5.731712e+05 1.356728e+06 1.590422e+06 2.167115e+06 4.594860e+05 1.632756e+06 1.365274e+06 1.065195e+06 6.498476e+05 1.014164e+06 1.004455e+06 1.625445e+06 1.303306e+06 1.883432e+06 1.704859e+06 1.352186e+06 6.038708e+05 2.260516e+06 8.475543e+05 1.361302e+06 1.904107e+06 1.502956e+06 8.561878e+05 6.140335e+05 9.994294e+05 1.013811e+06 1.100264e+06 1.580955e+06 3.670963e+05 2.135399e+06 8.346113e+05 1.361690e+06 1.454800e+06 1.574258e+06 1.767881e+06 1.510591e+06 1.286864e+06 3.282914e+06 3.936581e+05 1.293319e+06 7.544625e+05 8.137039e+05 5.218116e+05 8.351819e+05 8.858524e+05 8.586152e+05 2.030769e+06 7.983052e+05 2.880380e+06 1.448672e+06 8.347078e+05 6.655571e+05 6.209290e+05 1.132378e+06 1.622581e+06 8.397995e+05 6.831029e+05 9.671956e+05 9.251211e+05 3.826569e+06 1.058467e+06 1.718628e+06 2.347563e+06 1.156179e+06 6.467868e+05 8.863380e+05 2.173032e+06 1.087716e+06 5.318122e+05 1.352355e+06 1.693033e+06 9.408623e+05 1.472789e+06 1.174687e+06 1.402026e+06 1.442136e+06 6.491515e+05 1.009027e+06 9.893789e+05 8.255779e+05 7.584027e+05 1.281061e+06 1.077377e+06 2.032098e+06 9.917757e+05 1.246981e+06 1.804748e+06 1.042991e+06 1.480599e+06 1.214005e+06 2.065882e+06 9.850804e+05 1.492515e+06 9.504463e+05 1.279046e+06 1.478873e+06 2.055707e+06 1.345228e+06 6.437586e+05 1.042798e+06 9.286944e+05 8.898241e+05 4.148323e+05 1.281565e+06 9.575713e+05 1.023884e+06 1.377277e+06 1.353650e+06 1.297491e+06 1.214519e+06 1.835625e+06 9.930457e+05 4.357970e+05 1.057306e+06 1.173212e+06 1.964675e+06 1.580406e+06 1.202509e+06 1.243836e+06 9.797485e+05 1.281099e+06 1.599212e+06 6.430888e+05 5.365389e+05 1.382002e+06 1.328754e+06 2.116542e+06 6.147663e+05 2.013766e+06 1.967253e+06 9.723735e+05 1.014339e+06 6.869221e+05 1.936691e+06 8.578877e+05 9.821315e+05 1.377872e+06 1.190255e+06 4.082797e+05 9.969080e+05 1.729265e+06 8.067654e+05 7.432679e+05 9.652614e+05 9.845464e+05 9.300209e+05 9.953576e+05 5.258190e+05 9.712079e+05 4.847316e+05 1.592415e+06 7.160482e+05 1.153540e+06 4.627153e+05 1.688313e+06 1.437484e+06 1.247687e+06 1.469667e+06 1.313458e+06 8.021619e+05 1.650338e+06 1.666940e+06 1.169388e+06 1.362635e+06 1.000273e+06 7.396800e+05 1.633339e+06 5.217704e+05 2.119469e+06 1.863821e+06 2.051353e+06 1.230664e+06 1.529874e+06 1.058249e+06 7.846735e+05 1.628841e+06 7.932544e+05 1.508060e+06 1.506228e+06 1.760628e+06 Phosphoric acid_9.906 1.541127e+06 1.422890e+06 2.733626e+06 1.908874e+06 5.752043e+06 1.170496e+06 2.208274e+06 2.486788e+06 481537.75 1.411978e+06 2.910728e+06 2.374559e+06 386069.29 1.061720e+06 2.028255e+06 1.665948e+06 7.257401e+05 1.127782e+06 2.452310e+06 1.617121e+06 3.662838e+06 1.113523e+06 3.005988e+06 3.154462e+06 5348763.997 9.551445e+05 2.041261e+06 2.368049e+06 8.537102e+04 1.119287e+06 2.277631e+06 1.842117e+06 483849.72 1.015434e+06 3.118667e+06 1.192030e+06 3.046968e+05 6.795037e+05 1.944329e+06 2.876756e+06 3.723315e+05 1.131277e+06 2.593716e+06 2.700743e+06 3.416950e+05 7.211151e+05 1.263261e+06 2.613813e+06 1.213976e+06 4.182461e+06 1.619382e+06 3.424395e+06 2.637280e+06 2.492232e+06 3.987894e+06 6.001547e+06 4.364654e+06 3.774383e+06 2.352931e+06 4.892962e+06 3.277799e+06 3.051441e+06 4.590385e+06 2.557773e+06 5.870186e+06 3.126791e+06 8.787041e+06 1.204480e+07 8.802311e+06 4.845056e+06 7.048033e+06 4.711884e+06 1.659580e+06 1.045601e+08 2.751450e+06 1.160790e+07 8.754131e+06 2.472986e+06 2.034931e+06 9.078851e+06 1.611565e+06 3.548512e+06 3.422769e+06 7.485800e+06 6.464087e+06 2.221247e+06 1.389002e+06 3.022802e+06 4.746934e+06 4.115253e+06 9.465559e+06 2.778473e+06 5.607130e+07 2.419808e+06 5.709661e+06 2.251475e+07 1.069331e+07 2.193049e+06 9.844516e+06 1.984563e+06 1.859873e+06 3.402633e+06 6.410461e+06 9.038484e+06 4.621332e+06 2.203341e+06 2.780635e+06 1.867764e+06 1.246325e+06 1.764485e+06 2.917086e+06 3.813564e+07 1.214165e+06 3.282272e+06 6.515915e+07 2.449173e+06 1.565881e+08 5.354470e+06 9.461413e+06 2.241626e+06 2.083804e+06 1.393320e+06 4.579002e+06 2.548967e+06 1.933647e+06 1.759367e+06 8.390809e+06 1.263300e+06 3.498630e+06 6.305865e+06 3.018997e+06 3.069930e+06 1.559317e+06 1.907712e+07 2.795125e+06 2.941130e+06 3.083668e+06 5.463696e+06 3.079122e+06 4.603313e+07 1.833564e+06 4.393004e+06 5.797748e+06 2.539869e+07 3.536267e+06 2.260140e+06 4.614951e+06 2.663071e+06 7.188752e+06 2.089204e+08 3.362640e+06 2.532336e+08 3.501839e+07 8.696806e+06 4.639044e+06 2.466124e+06 8.672563e+07 1.223439e+07 4.116982e+08 3.340810e+06 4.769878e+06 2.131824e+07 4.962763e+06 2.228908e+06 1.891302e+08 4.741466e+06 1.461488e+06 3.542436e+06 2.583092e+06 2.641929e+06 3.683592e+06 7.871466e+06 5.465072e+06 2.103071e+06 1.939151e+06 4.208721e+06 6.818876e+06 3.657966e+06 9.943413e+06 1.258828e+07 4.254851e+07 1.221024e+06 2.790941e+06 2.498988e+06 1.096798e+07 1.400574e+07 3.959573e+06 1.463805e+06 4.449249e+06 6.866657e+06 2.202195e+06 5.087602e+06 5.762614e+08 1.615321e+07 1.046366e+08 2.660663e+07 1.133923e+07 3.378456e+06 3.540129e+06 4.831244e+06 1.124810e+07 2.523271e+07 6.294925e+06 1.286665e+07 1.357951e+06 8.264555e+06 5.808698e+06 2.486085e+06 4.789595e+08 7.730564e+06 3.052389e+07 1.127984e+07 5.199617e+05 1.407093e+08 5.253011e+06 4.563725e+07 1.221673e+07 5.664887e+07 5.684769e+07 4.523079e+07 9.243248e+06 1.609625e+07 9.377530e+06 5.480919e+07 1.714662e+08 1.701922e+08 1.872896e+07 1.028809e+08 4.013772e+07 2.160524e+06 1.026085e+08 1.216822e+08 5.064092e+06 6.758069e+06 7.977017e+06 2.105875e+06 2.979239e+06 3.195852e+06 4.160332e+06 2.660865e+06 1.294836e+07 4.101959e+06 5.436495e+06 3.819884e+06 2.877737e+06 3.472913e+06 4.907626e+06 2.708060e+06 9.439887e+06 9.421650e+06 9.449820e+06 5.307825e+06 2.800306e+06 2.241117e+06 5.345387e+06 4.006195e+06 1.795839e+06 1.810517e+06 2.714848e+06 1.972113e+06 5.622844e+06 1.967680e+06 CITRULLINE 6.949932e+08 3.354601e+08 3.031917e+08 3.463073e+08 3.931609e+05 2.264107e+08 3.353317e+08 3.464222e+08 355723.42 2.950670e+08 3.200073e+08 3.444479e+08 344938.84 2.847029e+08 3.104313e+08 3.200522e+08 3.433003e+05 2.937074e+08 2.966772e+08 3.111643e+08 1.512915e+05 2.904140e+08 3.286763e+08 3.957446e+08 58450.479 2.700404e+08 3.111781e+08 3.046891e+08 2.088624e+05 2.844888e+08 3.109797e+08 3.609337e+08 261023.62 2.975462e+08 3.110664e+08 2.716230e+08 1.914655e+05 3.091443e+08 3.161259e+08 3.436026e+08 2.454959e+05 3.017770e+08 3.358778e+08 3.326937e+08 2.370892e+05 2.744852e+08 2.815771e+08 3.391653e+08 2.933838e+08 4.104709e+08 3.209152e+08 3.960692e+08 2.956868e+08 4.050819e+08 3.539798e+08 6.047623e+08 4.603533e+08 6.635271e+08 5.863000e+08 3.603502e+08 5.980989e+08 5.737031e+08 4.472415e+08 5.253159e+08 2.635579e+08 3.540059e+08 3.034716e+08 5.331568e+08 3.766884e+08 3.890937e+08 4.777758e+08 5.553700e+08 5.866767e+08 4.137029e+08 4.489375e+08 2.437546e+08 3.711352e+08 2.378125e+08 3.627871e+08 3.009263e+08 2.776268e+08 2.621037e+08 2.902336e+08 4.004901e+08 2.118555e+08 2.625188e+08 3.016127e+08 3.050873e+08 3.878593e+08 4.787080e+08 3.986878e+08 3.167167e+08 2.727000e+08 5.193057e+08 3.237409e+08 4.346330e+08 5.079077e+08 3.390660e+08 2.420709e+08 3.025446e+08 2.813631e+08 3.902090e+08 3.347893e+08 2.393242e+08 2.275894e+08 2.992465e+08 3.141460e+08 5.337544e+08 2.855829e+08 3.441648e+08 2.899630e+08 3.159112e+08 3.066943e+08 3.223148e+08 3.729186e+08 3.508834e+08 3.187931e+08 3.496362e+08 3.895402e+08 3.679270e+08 2.302749e+08 2.044121e+08 2.017014e+08 2.315393e+08 2.621602e+08 2.156154e+08 2.869362e+08 2.706084e+08 1.947704e+08 2.163110e+08 5.626176e+08 5.720571e+08 2.109880e+08 3.455208e+08 4.817448e+08 2.405863e+08 2.658773e+08 3.422039e+08 2.808833e+08 2.330618e+08 3.564368e+08 3.388674e+08 3.948438e+08 4.291693e+08 2.772238e+08 3.501858e+08 2.531742e+08 5.448199e+08 4.142496e+08 1.811815e+08 1.684012e+08 4.280989e+08 4.580046e+08 3.893187e+08 3.865026e+08 7.207464e+08 3.163664e+08 1.377905e+08 2.524466e+08 3.417121e+08 3.272761e+08 4.589311e+08 2.886937e+08 2.561225e+08 2.594593e+08 2.555080e+08 4.296571e+08 2.693035e+08 2.474662e+08 3.487888e+08 3.320226e+08 2.656224e+08 3.282269e+08 2.431053e+08 2.519024e+08 3.586888e+08 3.305639e+08 4.978219e+08 3.934152e+08 2.516995e+08 1.967699e+08 3.261526e+08 5.303126e+08 2.288859e+08 2.430398e+08 3.155621e+08 2.388779e+08 9.434417e+07 3.508468e+08 2.964100e+08 3.247847e+08 2.230193e+08 5.646806e+08 3.489088e+08 1.678982e+08 3.972075e+08 4.921281e+08 4.678540e+08 2.361486e+08 3.138507e+08 2.151945e+08 2.889295e+08 2.950388e+08 3.119470e+08 1.979074e+08 2.067674e+08 4.288117e+08 1.784856e+08 4.051225e+08 2.336527e+08 3.639079e+08 2.181877e+08 3.114878e+08 2.836835e+08 1.920239e+08 3.383422e+08 2.266288e+08 3.346843e+08 2.393159e+08 4.662069e+08 2.215363e+08 4.613514e+08 3.877997e+08 2.139227e+08 3.740582e+08 2.927095e+08 1.927839e+08 2.496985e+08 3.394448e+08 4.748932e+08 3.613508e+08 1.852761e+08 2.810572e+08 2.870384e+08 2.821366e+08 4.281815e+08 3.862840e+08 4.344471e+08 2.832727e+08 2.325129e+08 4.299378e+08 2.021282e+08 2.766525e+08 4.639708e+08 2.452190e+08 8.405131e+07 3.354115e+08 2.679414e+08 3.235373e+08 3.514863e+08 3.732243e+08 4.530285e+08 5.201517e+08 4.537561e+08 3.476917e+08 2.642858e+08 3.903881e+08 2.395758e+08 4.427096e+08 2.764465e+08 3.935577e+08 3.939210e+08 4-Methylene-L-glutamine_9.96 6.916838e+08 3.348870e+08 3.025589e+08 3.455630e+08 2.299439e+05 2.259851e+08 3.345373e+08 3.455717e+08 201531.69 2.944521e+08 3.190986e+08 3.439378e+08 225550.27 2.842366e+08 3.096795e+08 3.194009e+08 1.955293e+05 2.931846e+08 2.961481e+08 3.104633e+08 8.562191e+04 2.898541e+08 3.278096e+08 3.948480e+08 35968.261 2.695479e+08 3.105375e+08 3.040886e+08 1.761970e+05 2.839274e+08 3.103521e+08 3.601347e+08 147804.42 2.968595e+08 3.104062e+08 2.711373e+08 1.082940e+05 3.085110e+08 3.154621e+08 3.428579e+08 1.395199e+05 3.011223e+08 3.352222e+08 3.319753e+08 1.340917e+05 2.738733e+08 2.809669e+08 3.384902e+08 2.926977e+08 4.093795e+08 3.202883e+08 3.950421e+08 2.949983e+08 4.041982e+08 3.532421e+08 6.021654e+08 4.590852e+08 6.602592e+08 5.846314e+08 3.598045e+08 5.963494e+08 5.714873e+08 4.457571e+08 5.236477e+08 2.630088e+08 3.532694e+08 3.028811e+08 5.314039e+08 3.756727e+08 3.880232e+08 4.762295e+08 5.532604e+08 5.851667e+08 4.126099e+08 4.474899e+08 2.432624e+08 3.702477e+08 2.373965e+08 3.618065e+08 3.001276e+08 2.770289e+08 2.615954e+08 2.896465e+08 3.994096e+08 2.115365e+08 2.620912e+08 3.008571e+08 3.043460e+08 3.868722e+08 4.766860e+08 3.978171e+08 3.156555e+08 2.722717e+08 5.172011e+08 3.231536e+08 4.331243e+08 5.063591e+08 3.381614e+08 2.415905e+08 3.020100e+08 2.809348e+08 3.884300e+08 3.338103e+08 2.387364e+08 2.271007e+08 2.985245e+08 3.136703e+08 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2.426212e+08 3.149061e+08 2.384838e+08 9.404790e+07 3.499452e+08 2.957366e+08 3.240957e+08 2.225698e+08 5.640955e+08 3.481681e+08 1.676396e+08 3.961443e+08 4.907714e+08 4.664020e+08 2.357186e+08 3.132686e+08 2.147977e+08 2.884688e+08 2.946313e+08 3.110255e+08 1.975734e+08 2.064652e+08 4.275787e+08 1.782406e+08 4.042585e+08 2.334786e+08 3.630179e+08 2.179276e+08 3.106071e+08 2.830876e+08 1.916458e+08 3.376619e+08 2.262512e+08 3.341056e+08 2.389628e+08 4.643480e+08 2.212119e+08 4.592348e+08 3.868429e+08 2.135072e+08 3.733825e+08 2.922657e+08 1.924788e+08 2.493325e+08 3.388091e+08 4.731649e+08 3.606377e+08 1.849523e+08 2.805276e+08 2.865075e+08 2.817410e+08 4.269273e+08 3.854952e+08 4.331255e+08 2.826930e+08 2.320814e+08 4.289429e+08 2.017424e+08 2.760955e+08 4.635750e+08 2.447518e+08 8.383254e+07 3.347095e+08 2.676024e+08 3.228299e+08 3.506984e+08 3.720485e+08 4.520080e+08 5.179778e+08 4.519039e+08 3.474404e+08 2.637945e+08 3.892828e+08 2.391019e+08 4.413453e+08 2.758225e+08 3.924298e+08 3.927641e+08 C5 H8 N2 O_9.962 1.130522e+07 4.260334e+06 4.924719e+06 5.152853e+06 1.247959e+05 4.283174e+06 5.099869e+06 5.428946e+06 105039.40 4.605337e+06 4.918663e+06 5.032293e+06 65420.76 4.556382e+06 4.703856e+06 4.915060e+06 1.127635e+05 4.567409e+06 4.562325e+06 5.415977e+06 5.701346e+04 3.666364e+06 4.737206e+06 6.372725e+06 218190.226 4.395065e+06 4.821242e+06 4.576970e+06 3.766629e+04 4.410736e+06 5.082886e+06 5.602072e+06 69513.12 4.047025e+06 4.724190e+06 3.774894e+06 1.294910e+05 5.029174e+06 5.441054e+06 5.207219e+06 6.560310e+04 4.127930e+06 5.043332e+06 6.140267e+06 6.271998e+04 3.787098e+06 4.137359e+06 5.202782e+06 4.853741e+06 6.788540e+06 4.123667e+06 6.213416e+06 4.896401e+06 5.788775e+06 5.941869e+06 1.108808e+07 7.575867e+06 1.179962e+07 9.989208e+06 5.351971e+06 1.025745e+07 1.021854e+07 6.655112e+06 9.153154e+06 4.298176e+06 5.677194e+06 4.745421e+06 8.957419e+06 6.145052e+06 6.279365e+06 7.472863e+06 9.347998e+06 9.559863e+06 6.518519e+06 7.025677e+06 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7.392865e+06 6.320307e+06 2.749142e+06 5.017974e+06 4.143051e+06 4.124846e+06 7.317268e+06 5.725446e+06 7.596100e+06 4.423940e+06 3.924231e+06 6.720969e+06 2.626752e+06 4.143638e+06 6.475955e+06 3.671434e+06 7.570985e+05 4.949076e+06 3.899896e+06 5.671442e+06 5.307977e+06 5.169169e+06 7.414834e+06 7.730056e+06 6.573347e+06 4.901539e+06 4.213035e+06 5.979924e+06 3.817076e+06 7.052762e+06 3.828729e+06 6.025260e+06 6.505054e+06 C12 H23 P3_9.97 9.596113e+04 2.311824e+06 1.687425e+06 3.138281e+06 8.895787e+04 9.681803e+05 1.999274e+06 2.126526e+06 84367.04 2.115058e+06 2.119256e+06 1.873445e+06 63785.69 2.372704e+06 2.068866e+06 2.384551e+06 8.561681e+04 1.570496e+06 1.958939e+06 1.795500e+06 4.180414e+04 2.512155e+06 1.977846e+06 2.535907e+06 29341.707 1.820316e+06 1.489470e+06 1.775802e+06 1.503300e+04 2.633670e+06 1.599985e+06 2.459263e+06 54323.23 2.456877e+06 1.904654e+06 1.665658e+06 6.514946e+04 2.427746e+06 2.247266e+06 1.597200e+06 4.920071e+04 1.190484e+06 3.483667e+06 1.995597e+06 4.108103e+04 1.814687e+06 1.308268e+06 2.582745e+06 3.346293e+05 2.558791e+06 2.152112e+06 5.845610e+06 4.658952e+05 1.485247e+06 5.857749e+06 1.664919e+06 3.064155e+06 3.989768e+06 1.623266e+06 3.893991e+06 2.027346e+06 9.191283e+05 1.650556e+06 2.575866e+06 2.243816e+06 1.298110e+06 3.251637e+06 1.249532e+06 2.541797e+06 2.334887e+06 2.793490e+06 3.622417e+06 4.918278e+05 2.110608e+06 4.323883e+06 3.776653e+06 1.806609e+06 7.810096e+05 9.990764e+05 1.402302e+06 7.270168e+05 2.176423e+06 7.890675e+04 1.785688e+06 7.535119e+06 4.415937e+06 2.251073e+05 3.892509e+06 9.418991e+06 1.673710e+06 6.051279e+06 1.440942e+06 1.274377e+06 9.719756e+05 1.679585e+06 3.841167e+06 1.769591e+06 8.654615e+05 1.394606e+06 1.712214e+06 2.184691e+06 3.232343e+06 1.711589e+06 5.651475e+05 1.151020e+06 8.025845e+05 7.621631e+05 3.246359e+06 1.087329e+06 2.311110e+06 1.447058e+06 1.724866e+06 1.667736e+06 1.032471e+06 3.060181e+06 3.855230e+06 1.663966e+06 8.155487e+05 1.503612e+06 4.122093e+06 2.700679e+06 1.420348e+06 1.053812e+06 1.123329e+06 6.853523e+05 2.701653e+06 1.890820e+06 1.939971e+05 3.981179e+05 4.893021e+05 1.028782e+06 2.508537e+06 5.635626e+05 1.696984e+06 7.151696e+06 1.196861e+06 1.124396e+06 2.852469e+06 7.088211e+06 4.580454e+06 3.853507e+05 1.873981e+06 2.266817e+06 2.639630e+06 3.436662e+06 8.894638e+05 1.372544e+06 9.567283e+05 1.705241e+06 4.760744e+05 1.490448e+06 1.197790e+06 2.086364e+06 2.256207e+06 3.451504e+06 6.245183e+06 4.537471e+06 1.110590e+06 3.534868e+06 2.919427e+06 2.349088e+06 3.245299e+06 8.536844e+06 1.620003e+06 2.590574e+06 9.723952e+06 2.529205e+06 2.702553e+06 4.574971e+06 1.300236e+06 9.185531e+06 6.053257e+06 1.358646e+06 7.667053e+05 7.854721e+05 2.174637e+06 2.529592e+06 1.587377e+06 2.589337e+06 2.363838e+06 6.978373e+04 1.656773e+05 1.264292e+06 7.092582e+04 2.456009e+06 4.526431e+05 2.574150e+06 1.506283e+06 1.292044e+06 4.733655e+06 1.190163e+06 1.829599e+06 3.221487e+05 3.477717e+05 2.327025e+05 3.233371e+06 3.583312e+06 1.332325e+06 2.681300e+05 1.839068e+06 1.598369e+06 1.338460e+06 8.971703e+05 3.059360e+06 6.464911e+05 1.310225e+06 3.662536e+06 1.139024e+06 1.127840e+06 1.435010e+06 2.069566e+06 2.565107e+06 4.901862e+05 4.660121e+06 2.172167e+06 2.366573e+06 7.750736e+05 2.606210e+06 9.374620e+05 1.620453e+06 1.293650e+06 1.814064e+06 2.765888e+06 2.148601e+06 1.064676e+06 6.406422e+06 9.723075e+05 9.570095e+05 6.079969e+06 2.010901e+06 3.458529e+05 1.212822e+06 1.064808e+06 1.599371e+06 1.128068e+06 5.008011e+06 1.794392e+06 9.793216e+05 4.607559e+06 2.497383e+06 2.630507e+06 4.915496e+05 2.347571e+06 5.516893e+06 7.351676e+05 1.326326e+06 3.351962e+06 3.239827e+06 5.247415e+05 9.327093e+05 3.302123e+06 4.800593e+06 2.000637e+06 2.279040e+06 1.606115e+06 2.607316e+06 4.055128e+05 2.085061e+06 1.482742e+06 1.825001e+06 8.671329e+06 3.081530e+06 C7 H12 N2 O3_9.989 1.956712e+06 4.044529e+05 4.668585e+05 4.179544e+05 1.066634e+05 3.320678e+05 4.158561e+05 6.301507e+05 80145.82 3.989949e+05 4.384265e+05 4.774751e+05 71872.87 3.475005e+05 3.832716e+05 3.900198e+05 9.099446e+04 3.895717e+05 3.806861e+05 4.844761e+05 3.471243e+04 3.643379e+05 5.708025e+05 5.435184e+05 20051.556 3.121328e+05 4.395164e+05 3.645278e+05 1.574126e+04 4.292803e+05 3.849739e+05 4.938505e+05 69741.53 4.470630e+05 3.878905e+05 3.760569e+05 4.495542e+04 4.247962e+05 4.940966e+05 4.615822e+05 6.284136e+04 3.820729e+05 4.681767e+05 4.509114e+05 6.033684e+04 3.760033e+05 4.092778e+05 4.521617e+05 8.483786e+04 9.230806e+04 4.456906e+05 9.787358e+04 1.065191e+05 4.075174e+05 1.663265e+05 1.091976e+06 6.272070e+05 7.644285e+05 1.260912e+05 9.925155e+04 1.587188e+05 1.129351e+05 1.324112e+05 1.043623e+05 9.140026e+04 9.847148e+04 8.887987e+04 1.087787e+05 9.905622e+04 1.075202e+05 2.312594e+05 3.443473e+05 1.166246e+05 1.044818e+05 3.922022e+05 7.838800e+04 7.993299e+04 7.212138e+04 9.893422e+04 1.762520e+05 1.093034e+05 8.950364e+04 8.804725e+04 1.274015e+05 1.088095e+05 8.428121e+04 8.104191e+04 8.807917e+04 1.418496e+05 1.279748e+05 1.521107e+05 8.063210e+04 1.834371e+05 9.689285e+04 2.167942e+05 9.029527e+04 3.669890e+05 8.871900e+04 8.289236e+04 9.409102e+04 3.858617e+05 1.907740e+05 7.486047e+04 9.797056e+04 1.140254e+05 3.144489e+05 5.243210e+05 6.802224e+05 1.557995e+05 9.508591e+04 2.250577e+05 1.066564e+05 8.818505e+04 1.954188e+05 8.626601e+04 1.512329e+05 6.744212e+04 1.317362e+05 1.507703e+05 7.108048e+05 7.756820e+04 1.184656e+05 8.150513e+04 2.445182e+05 8.947527e+04 8.561119e+04 1.997260e+05 1.512186e+05 1.329017e+05 9.279387e+04 3.618919e+05 1.108619e+05 7.907859e+04 9.589261e+04 8.145629e+05 1.635416e+05 8.367221e+04 1.674345e+05 1.432507e+05 6.507488e+04 2.008128e+05 7.582183e+04 9.386669e+04 2.295711e+05 9.250257e+04 1.973913e+05 8.003901e+04 1.079541e+05 8.910172e+04 9.586414e+04 3.672426e+05 9.854641e+04 1.655601e+05 1.654396e+05 4.218139e+05 1.468571e+05 1.187028e+05 5.692478e+05 6.454834e+04 1.027186e+06 1.084084e+05 2.166934e+05 3.561442e+05 2.939805e+05 9.109834e+04 1.393564e+05 1.887935e+05 1.477581e+05 8.288629e+04 9.695047e+04 8.220969e+04 7.636874e+04 3.623430e+05 1.960969e+05 8.768120e+04 8.678114e+04 2.393662e+05 2.600229e+05 1.404340e+05 8.317860e+04 8.546447e+04 9.452211e+04 5.987994e+05 1.121025e+05 1.133552e+05 2.057467e+06 1.436252e+05 7.612930e+05 8.613901e+05 2.999204e+05 1.191606e+05 8.299278e+05 1.040219e+05 2.847858e+06 8.418323e+04 6.251168e+06 1.255407e+06 9.053361e+04 8.825447e+04 3.655552e+05 3.190470e+05 8.105483e+05 9.905400e+06 6.674117e+06 8.166464e+04 3.185147e+06 8.695614e+04 8.915062e+04 1.548588e+05 1.368833e+05 1.983002e+05 2.258184e+06 6.102567e+05 1.107724e+05 6.860851e+05 6.399235e+05 1.117789e+06 8.455251e+04 1.100330e+05 3.817839e+05 4.677726e+05 1.790228e+06 9.102830e+04 6.827179e+04 8.027813e+04 2.016274e+05 1.293712e+06 3.849399e+06 2.671831e+06 5.373761e+05 2.179416e+05 3.913739e+05 1.439209e+05 1.215490e+05 8.298942e+04 9.731747e+04 9.133408e+04 9.007849e+05 2.308116e+05 8.598345e+04 5.055960e+05 5.639407e+05 1.104116e+06 5.840194e+06 8.419383e+04 1.337101e+06 1.007484e+07 1.891992e+05 5.459523e+06 1.271812e+05 1.539317e+05 1.110893e+05 2.912298e+05 8.786207e+04 2.490853e+06 8.614918e+05 8.743912e+04 9.174433e+04 2.124199e+05 8.705077e+04 1.130923e+06 3.154512e+05 C6 H10 N2 O4_10.002 3.777409e+06 1.214405e+06 1.344044e+06 1.179627e+06 1.072238e+05 7.810153e+05 1.368497e+06 1.406737e+06 87244.63 1.166642e+06 1.203519e+06 1.410267e+06 70897.16 9.660231e+05 1.094368e+06 1.225623e+06 8.959184e+04 1.157544e+06 1.150741e+06 1.259603e+06 3.885410e+04 9.584410e+05 1.275272e+06 1.696828e+06 13167.421 9.779490e+05 1.132319e+06 1.168111e+06 1.506089e+04 1.066294e+06 1.211054e+06 1.415734e+06 64729.88 1.076597e+06 1.270883e+06 1.003635e+06 4.509501e+04 1.146040e+06 1.263235e+06 1.334137e+06 6.307377e+04 1.145601e+06 1.280280e+06 1.225235e+06 6.236150e+04 1.023597e+06 1.108398e+06 1.318941e+06 1.368164e+06 1.078572e+06 6.140840e+05 1.828562e+06 7.558509e+05 6.098413e+05 4.930546e+06 1.611938e+06 7.009261e+05 1.597182e+06 1.227595e+05 1.769379e+06 4.780403e+06 2.644116e+06 1.946490e+06 1.440249e+06 5.485130e+05 6.085269e+05 5.157084e+05 1.431982e+06 1.138017e+06 9.012960e+05 2.079960e+06 6.685915e+05 1.297399e+06 9.716474e+05 1.318169e+06 1.020205e+06 1.719661e+06 1.818642e+06 7.202769e+06 1.370885e+06 1.193660e+06 8.041140e+05 3.216528e+06 7.044962e+05 1.454486e+06 9.624742e+05 1.736327e+06 9.116791e+05 1.036098e+06 5.489457e+05 1.051859e+06 8.598871e+05 8.259951e+05 8.253685e+05 1.382647e+06 9.239361e+05 6.432276e+05 1.574440e+06 1.438722e+05 2.661064e+06 7.505102e+05 1.962591e+06 1.616193e+06 1.665081e+06 7.031067e+05 1.177803e+06 8.505104e+05 8.818255e+05 1.294925e+06 1.374908e+06 5.623109e+05 9.045485e+05 1.075394e+06 9.344136e+05 6.134448e+05 2.108997e+06 1.158382e+06 2.073588e+06 1.058845e+06 1.530235e+06 3.565471e+05 6.601584e+05 4.501475e+05 7.769968e+05 4.894530e+05 1.467538e+06 8.662568e+05 2.334136e+06 1.312737e+06 3.200736e+06 5.522352e+06 1.919397e+06 4.685553e+05 1.375468e+06 1.105237e+06 7.553131e+05 6.838153e+05 2.023389e+06 1.429661e+06 1.005733e+06 1.465512e+06 8.519465e+05 5.829193e+05 7.166089e+05 7.649789e+05 8.913077e+05 7.953502e+05 9.561485e+05 6.044905e+05 5.971923e+05 4.230636e+05 5.649242e+05 6.494973e+05 2.049157e+06 7.931316e+05 1.148733e+06 5.990563e+05 4.519161e+05 4.687089e+05 1.081112e+06 1.059698e+06 1.099442e+06 1.613254e+06 5.547747e+05 1.079715e+06 1.220858e+06 6.505197e+06 1.203300e+06 7.910329e+05 4.483953e+05 3.902653e+06 5.805668e+05 4.015374e+05 1.401037e+06 2.582053e+06 6.056094e+05 4.595089e+05 2.059319e+06 1.347902e+06 1.453307e+06 3.124407e+06 8.628380e+05 3.995251e+06 1.361666e+06 1.911030e+06 1.239304e+06 1.691010e+06 4.843180e+05 1.694908e+06 1.849464e+06 6.036515e+05 6.770300e+05 9.870652e+05 6.738825e+05 3.937385e+05 4.732579e+05 1.748686e+06 6.765875e+05 7.912470e+05 1.832325e+06 6.865053e+05 1.216494e+06 9.934138e+05 7.278757e+05 4.550653e+05 1.379505e+06 6.592337e+05 1.421202e+06 2.531184e+06 5.011601e+05 1.006690e+06 7.610395e+05 1.000504e+06 5.994327e+05 7.468749e+05 1.081078e+06 1.956899e+06 8.778947e+05 1.914099e+06 2.378291e+06 7.285369e+05 5.269034e+05 7.576445e+05 5.265910e+05 1.830601e+06 9.209199e+05 1.615562e+06 7.901695e+05 9.662261e+05 7.860152e+05 9.587519e+05 8.447450e+05 9.354440e+05 6.948890e+05 4.649728e+05 9.939032e+05 1.096394e+06 9.312531e+05 1.177715e+06 1.369089e+06 1.752385e+06 1.135501e+06 8.648531e+05 1.360168e+06 7.394470e+05 3.868623e+05 1.282611e+06 6.387090e+05 2.316566e+06 7.390442e+05 1.036888e+06 1.047163e+06 7.655312e+05 1.708826e+06 1.359670e+06 1.440506e+06 6.220535e+05 1.090554e+06 3.888550e+06 8.752133e+05 6.157555e+06 1.466563e+06 C6 H12 N2 O4_10.009 1.770314e+06 2.155113e+06 2.693436e+06 2.731629e+06 1.112805e+05 1.672491e+06 2.586626e+06 2.574912e+06 89055.82 2.082598e+06 2.513968e+06 2.914131e+06 68095.62 2.215484e+06 2.555714e+06 1.953879e+06 9.222592e+04 2.214194e+06 2.395576e+06 2.141206e+06 4.327142e+04 2.445605e+06 2.332219e+06 3.185903e+06 14818.056 2.117469e+06 2.201686e+06 2.365677e+06 1.609713e+04 2.349958e+06 2.236239e+06 2.775427e+06 68034.02 2.394464e+06 2.434486e+06 2.002718e+06 4.817098e+04 2.308620e+06 2.276951e+06 2.942314e+06 6.628292e+04 1.990999e+06 2.625416e+06 2.598252e+06 6.530960e+04 2.174649e+06 2.075749e+06 2.589158e+06 8.112570e+05 2.455515e+06 2.638088e+06 1.142857e+06 2.091706e+06 1.658405e+06 6.097941e+06 1.772354e+06 2.447862e+06 4.428993e+06 7.854798e+06 6.978213e+05 2.644036e+06 1.564004e+06 1.341813e+06 3.036365e+06 2.330785e+06 1.429805e+06 1.964532e+06 1.199501e+06 1.733714e+06 2.257056e+06 1.884471e+05 2.084162e+06 1.393452e+06 2.829243e+05 3.125360e+06 8.758996e+05 3.816791e+06 1.919315e+06 7.558586e+07 1.671927e+06 8.768592e+05 2.922128e+06 1.997051e+06 9.769839e+05 1.990735e+06 4.183102e+06 8.352309e+05 3.497293e+06 3.521335e+06 1.130659e+06 4.533260e+06 1.078278e+06 8.452163e+05 8.653383e+05 2.872427e+06 5.873214e+05 2.300536e+06 9.173787e+05 5.520161e+05 7.209283e+05 1.104532e+06 1.315563e+06 8.474870e+05 6.804025e+05 8.935831e+05 1.228064e+06 1.284369e+06 2.547906e+06 7.845077e+05 1.615717e+06 8.060247e+05 1.743235e+06 1.907089e+06 4.004285e+05 1.217359e+06 2.064203e+06 2.115430e+06 9.608267e+04 2.060589e+06 2.527167e+06 2.456983e+06 1.662359e+06 8.796530e+05 4.949046e+05 9.855677e+05 2.139808e+06 1.263487e+06 1.034148e+06 8.700525e+05 2.371499e+06 9.609971e+05 6.334211e+07 1.880893e+06 2.174432e+06 3.696954e+06 8.841963e+05 2.630202e+06 2.116553e+06 2.896331e+06 2.996894e+06 2.369317e+06 8.146714e+05 1.966217e+06 1.886096e+06 2.243662e+06 2.254595e+06 4.648171e+05 1.506525e+06 7.737440e+05 1.597726e+06 1.868556e+06 1.947216e+06 4.506864e+06 2.672121e+06 2.593372e+06 1.686023e+06 1.581343e+06 1.532932e+06 1.789615e+06 1.719840e+06 1.654958e+06 2.747889e+06 2.244253e+06 1.930178e+06 1.871679e+06 2.612266e+06 1.781056e+06 2.684432e+06 2.128618e+06 4.037346e+06 2.540727e+06 2.024150e+06 2.094432e+06 1.463341e+06 1.698159e+06 1.178621e+06 3.033016e+06 2.192127e+06 3.025283e+06 2.242670e+05 9.303099e+04 3.587231e+05 2.683696e+06 5.633867e+05 6.331892e+05 7.030068e+05 3.352613e+06 3.432064e+06 5.195478e+06 3.738148e+06 2.107093e+06 7.331155e+05 2.148690e+06 2.348415e+06 1.408531e+05 2.583668e+06 1.395056e+06 5.356199e+05 3.392343e+06 2.616704e+06 8.526070e+06 1.159648e+06 5.601476e+06 5.468313e+06 1.710436e+06 3.653631e+05 1.589040e+06 1.726244e+06 2.920829e+06 3.889110e+06 2.780136e+06 4.200205e+06 3.072395e+06 2.293815e+06 3.399111e+05 2.338151e+06 9.189024e+06 4.313401e+06 2.818425e+05 1.608813e+06 4.060756e+06 3.936303e+06 2.904501e+06 2.363807e+06 1.367217e+06 1.850611e+06 2.174924e+06 1.197896e+06 1.616034e+06 2.931315e+06 1.702501e+06 8.104016e+05 6.009332e+05 2.285350e+06 2.440633e+06 2.679233e+06 2.896351e+06 3.775849e+05 2.527065e+06 1.444856e+06 2.063204e+06 3.913197e+05 7.441945e+05 6.601662e+06 4.403407e+05 1.459400e+06 2.927920e+06 4.411826e+06 1.501851e+06 1.798411e+06 1.361248e+06 3.204572e+06 1.304678e+06 2.197736e+06 8.665271e+05 1.438620e+06 3.350680e+06 1.181469e+06 4.066291e+05 9.200568e+05 3.225998e+06 3.604667e+06 C12 H17 N P2_10.019 2.423861e+06 1.287192e+06 1.146632e+06 1.470792e+06 1.087594e+05 1.354233e+06 1.307049e+06 1.481527e+06 92678.06 1.256299e+06 1.409977e+06 1.449610e+06 71573.93 1.247657e+06 1.252064e+06 1.385899e+06 8.816364e+04 1.190229e+06 1.246332e+06 1.351786e+06 3.870122e+04 1.302203e+06 1.382807e+06 1.600093e+06 16830.551 1.266949e+06 1.318614e+06 1.284180e+06 2.171441e+04 1.248634e+06 1.255969e+06 1.484709e+06 67959.94 1.243830e+06 1.157151e+06 1.093045e+06 4.329415e+04 1.835792e+06 1.251706e+06 1.466210e+06 6.346070e+04 1.159568e+06 1.438175e+06 1.350311e+06 6.658454e+04 1.162383e+06 1.271627e+06 1.434204e+06 2.105598e+06 1.600309e+06 1.020594e+06 1.556006e+06 1.196749e+06 1.447241e+06 1.152943e+06 1.156252e+06 1.276577e+06 1.942559e+06 1.741200e+06 1.630861e+06 4.421453e+06 1.847454e+06 2.623290e+06 2.266489e+06 8.145072e+05 6.862937e+05 1.808204e+06 1.187539e+06 1.079548e+06 8.310034e+05 1.155264e+06 7.142432e+05 1.621411e+06 1.247616e+06 9.392467e+05 1.753036e+06 1.646088e+06 2.571197e+06 1.869658e+06 1.147817e+06 1.336485e+06 1.543335e+06 2.084055e+06 1.433202e+06 8.143435e+05 1.463097e+06 9.181480e+05 6.733533e+05 1.273746e+06 7.342370e+05 2.364274e+06 9.231926e+05 1.373677e+06 9.924962e+05 1.809200e+06 1.358380e+06 1.288581e+06 9.934983e+05 8.796987e+05 1.252170e+06 5.656539e+05 9.938189e+05 1.210035e+06 2.241453e+06 8.839683e+05 1.332957e+06 1.196930e+06 1.086334e+06 1.864801e+06 1.749479e+06 1.226942e+06 1.232740e+06 1.100609e+06 1.360768e+06 1.103681e+06 1.278713e+06 8.918233e+05 8.509968e+05 9.339638e+05 2.526753e+06 6.077691e+05 9.535469e+05 4.687315e+05 1.319295e+06 6.490779e+05 2.046329e+06 2.164673e+06 4.167490e+05 1.471271e+06 2.415570e+06 8.764185e+05 1.699397e+06 7.175708e+05 1.829327e+06 1.570455e+06 6.015304e+05 2.438419e+06 1.360745e+06 1.454639e+06 1.465492e+06 1.739779e+06 1.013419e+06 6.167581e+05 1.235146e+06 1.844843e+06 8.544469e+05 6.484684e+05 1.271824e+06 9.227953e+05 6.968872e+05 7.617253e+05 4.699330e+05 1.175658e+06 2.697804e+06 8.504935e+05 1.247765e+06 1.719256e+06 1.263526e+06 1.004937e+06 1.153912e+06 1.481743e+06 2.363889e+06 1.453201e+06 8.376348e+05 1.101381e+06 1.547884e+06 1.794838e+06 1.426024e+06 1.304791e+06 1.081216e+06 1.611220e+06 1.281028e+06 1.275610e+06 2.537418e+06 1.159126e+06 8.949780e+05 1.392114e+06 1.935049e+06 1.384599e+06 1.584652e+06 1.047594e+06 2.159502e+06 1.259320e+06 2.313059e+06 1.514524e+06 1.965520e+06 1.647417e+06 2.341793e+06 1.096203e+06 2.060273e+06 5.818607e+05 7.944423e+05 2.251783e+06 1.331370e+06 8.401381e+05 8.886136e+05 1.186639e+06 2.812851e+06 9.923022e+05 1.846348e+06 2.854032e+06 1.360767e+06 1.269481e+06 9.691410e+05 5.720868e+05 7.060794e+05 1.860934e+06 1.358120e+06 9.961090e+05 8.805663e+05 1.191226e+06 2.117277e+06 1.503898e+06 1.061414e+06 1.691083e+06 1.097789e+06 1.227174e+06 1.148897e+06 6.839025e+05 2.038917e+06 6.472676e+05 1.252824e+06 1.882341e+06 1.082703e+06 2.416823e+06 1.725502e+06 1.767167e+06 1.084417e+06 1.739148e+06 9.998772e+05 3.357112e+06 1.553990e+06 8.921767e+05 1.094628e+06 1.616000e+06 1.412255e+06 1.400322e+06 1.229553e+06 2.328340e+06 7.702569e+05 1.548394e+06 2.030568e+06 1.616955e+06 2.801756e+06 1.286720e+06 1.160465e+06 1.608977e+06 1.164938e+06 1.573914e+06 1.028825e+06 2.863242e+06 1.191685e+06 5.816133e+05 1.640640e+06 2.601693e+06 1.601929e+06 1.476517e+06 9.132008e+05 1.525384e+06 8.005738e+05 2.445193e+06 1.057861e+06 C7 H12 N2 O5_10.025 7.707220e+05 8.213110e+05 1.084962e+06 1.153894e+06 1.853697e+05 6.029138e+05 9.496812e+05 1.135718e+06 155746.03 1.014130e+06 9.717354e+05 1.115663e+06 128980.07 6.798498e+05 1.031220e+06 7.832972e+05 1.671201e+05 9.030137e+05 1.123431e+06 1.000045e+06 7.714198e+04 6.771863e+05 1.145861e+06 1.054314e+06 24615.169 7.276566e+05 1.048468e+06 9.534245e+05 2.553076e+04 9.677207e+05 9.760890e+05 1.150319e+06 113180.15 8.009196e+05 9.360652e+05 6.110653e+05 8.187313e+04 1.076351e+06 1.060937e+06 1.014986e+06 1.162757e+05 9.532504e+05 1.065692e+06 9.393021e+05 1.215958e+05 8.163858e+05 7.812848e+05 1.125844e+06 3.431393e+05 6.947014e+05 3.685721e+05 7.507038e+05 5.709071e+05 4.680477e+05 1.363588e+06 8.920492e+05 6.582700e+05 4.666901e+05 1.627979e+06 1.374584e+06 3.899260e+05 6.257301e+05 5.727567e+05 6.793014e+05 1.548196e+06 8.947646e+05 3.238180e+05 5.243165e+05 3.859623e+05 4.425963e+05 8.947462e+05 3.725401e+05 6.434258e+05 5.451254e+05 1.192762e+06 7.085601e+05 1.010582e+06 6.477561e+05 3.075718e+07 9.366292e+05 2.780967e+05 9.709345e+05 4.827499e+05 1.049526e+06 1.164697e+06 1.119284e+06 2.623572e+05 1.203764e+06 9.453535e+05 2.916688e+05 1.469557e+06 1.099609e+06 3.418956e+05 1.863934e+05 6.269770e+05 7.348204e+05 1.131541e+06 6.391251e+05 9.680874e+05 1.843667e+05 9.042844e+05 7.637667e+05 6.368718e+05 5.426302e+05 6.385592e+05 5.481235e+05 6.961491e+05 7.836088e+05 4.021449e+05 5.250539e+05 4.221363e+05 4.844688e+05 6.407726e+05 1.004071e+06 9.701738e+05 5.489934e+05 9.406885e+05 3.990992e+05 1.276504e+06 1.143917e+06 5.018190e+05 6.598183e+05 4.098461e+05 2.413921e+05 5.534655e+05 4.134075e+05 6.149947e+05 1.933094e+05 6.148714e+05 1.171022e+06 4.455431e+05 6.273260e+07 4.657051e+05 5.019111e+05 7.094102e+05 4.558497e+05 7.744810e+05 6.130246e+05 7.449983e+05 1.168201e+06 6.547553e+05 3.591589e+05 7.574621e+05 8.796681e+05 7.082610e+05 3.365121e+05 4.410842e+05 5.729960e+05 1.772586e+05 2.767350e+05 6.777882e+05 1.202103e+06 1.447723e+06 7.982151e+05 8.525365e+05 6.452835e+05 6.376799e+05 9.947868e+05 9.254734e+05 1.106792e+06 3.793367e+05 8.742124e+05 1.390642e+06 4.567863e+05 6.252316e+05 4.495927e+05 6.617253e+05 7.182928e+05 6.018024e+05 2.295473e+05 3.992310e+05 3.525501e+05 5.629893e+05 3.466962e+05 6.674047e+05 8.196865e+05 5.434198e+05 4.934775e+05 7.014695e+05 8.144638e+05 3.812046e+05 3.098264e+05 4.964805e+05 5.089773e+05 5.330830e+05 3.113977e+05 4.399264e+05 4.426409e+05 3.025949e+05 1.109233e+06 2.351340e+05 3.826773e+05 1.087994e+06 1.199196e+06 1.469512e+05 9.811561e+05 7.602723e+05 3.646470e+05 1.754238e+06 2.385696e+05 8.670032e+05 4.080655e+05 9.331602e+05 7.577070e+05 2.921227e+05 9.668825e+05 6.311683e+05 7.448461e+05 3.589994e+05 7.759647e+05 9.453115e+05 2.806556e+05 3.701130e+05 5.998482e+05 9.572132e+05 1.196723e+06 1.296273e+06 7.523884e+05 2.025675e+06 2.153881e+05 2.450680e+05 7.285654e+05 7.738257e+05 6.893850e+05 7.232669e+05 3.694908e+05 2.713667e+05 5.571503e+05 1.453299e+06 5.589350e+05 1.456677e+06 6.968863e+05 4.453982e+05 6.871814e+05 9.214194e+05 9.573210e+05 7.003941e+05 3.712249e+05 5.084179e+05 5.900003e+05 5.889656e+05 3.137086e+05 6.007287e+05 6.609395e+05 6.460453e+05 7.700135e+05 2.977685e+05 1.121355e+06 6.587605e+05 4.078887e+05 9.361604e+05 8.638244e+05 4.504816e+05 1.885113e+05 4.775209e+05 1.104978e+06 2.730326e+05 7.949523e+05 2.474868e+05 3.422705e+05 2.892945e+05 9.275864e+05 233.9491_10.047 7.817163e+05 8.323789e+05 1.185749e+06 1.136126e+06 2.925870e+05 7.347751e+05 1.174166e+06 1.047948e+06 242750.49 1.036287e+06 1.173062e+06 1.448353e+06 164270.50 8.449223e+05 9.924910e+05 1.041819e+06 2.434329e+05 4.491079e+05 1.238893e+06 9.978142e+05 7.134000e+05 5.472272e+05 2.061070e+06 1.020129e+06 38282.487 5.095461e+05 1.293414e+06 1.221004e+06 3.315985e+05 4.531211e+05 1.110565e+06 1.093467e+06 180001.69 2.337737e+05 1.320284e+06 9.400374e+05 1.370651e+05 2.475246e+05 9.392799e+05 1.306419e+06 1.983190e+05 4.939446e+05 1.507849e+06 1.196962e+06 1.379827e+06 5.253468e+05 1.089903e+06 1.130368e+06 7.740727e+05 1.078745e+06 8.034435e+05 1.011872e+06 8.674868e+05 1.386980e+06 1.037358e+06 1.517217e+06 8.348000e+05 5.764209e+05 4.439758e+05 8.983274e+05 8.172758e+05 6.846645e+05 8.758608e+05 8.690582e+05 1.712990e+06 1.032392e+06 2.172178e+06 1.430067e+06 2.812458e+06 1.200244e+06 1.162717e+06 9.171837e+05 6.752136e+05 1.770955e+07 9.381426e+05 3.037559e+06 2.111674e+06 1.103972e+06 9.662987e+05 2.288680e+06 1.100721e+06 1.290066e+06 1.143262e+06 1.332930e+06 1.467486e+06 1.198168e+06 8.814964e+05 1.388408e+06 1.220226e+06 1.516639e+06 1.638744e+06 1.069237e+06 8.659118e+06 1.328188e+06 1.546897e+06 3.896589e+06 2.914864e+06 1.328763e+06 1.818691e+06 8.825093e+05 8.300284e+05 8.995862e+05 1.923321e+06 1.527351e+06 1.417876e+06 9.249662e+05 9.029665e+05 6.750438e+05 1.121740e+06 1.023345e+06 1.035581e+06 8.234709e+06 9.044778e+05 1.095549e+06 8.504390e+06 1.362592e+06 2.037503e+07 1.976432e+06 1.882187e+06 9.130965e+05 1.187154e+06 7.346948e+05 1.497452e+06 1.046682e+06 1.105704e+06 1.063156e+06 1.757741e+06 7.664528e+05 1.565816e+06 1.267417e+06 1.095666e+06 1.425076e+06 1.137814e+06 3.903078e+06 1.003814e+06 1.019459e+06 1.186607e+06 9.562213e+05 1.140809e+06 1.000965e+07 1.081415e+06 1.256644e+06 1.849142e+06 5.290212e+06 1.161811e+06 8.730443e+05 1.463655e+06 7.491268e+05 1.504285e+06 5.528781e+07 9.926984e+05 5.850665e+07 8.088745e+06 2.448837e+06 1.218003e+06 1.109242e+06 1.694771e+07 2.963978e+06 5.504044e+07 1.132134e+06 6.698273e+05 4.882348e+06 1.173190e+06 9.986454e+05 2.107732e+07 1.131225e+06 1.478039e+06 1.719506e+06 9.307923e+05 1.285366e+06 1.450487e+06 1.639040e+06 1.589048e+06 1.213575e+06 8.141544e+05 1.104880e+06 1.363802e+06 1.136845e+06 2.227574e+06 2.727928e+06 1.060814e+07 7.629609e+05 1.408602e+06 8.857917e+05 2.334446e+06 3.335011e+06 1.403056e+06 7.498787e+05 1.157002e+06 2.349549e+06 1.069912e+06 1.154455e+06 1.984976e+07 2.997681e+06 1.833160e+07 4.518182e+06 2.782344e+06 9.434019e+05 1.312831e+06 1.505295e+06 2.841248e+06 6.666360e+06 1.772211e+06 2.569700e+06 9.392648e+05 1.488476e+06 1.936521e+06 1.125923e+06 4.173737e+07 2.118673e+06 4.870031e+06 2.744943e+06 5.916261e+05 1.411000e+07 1.313841e+06 7.755158e+06 3.623516e+06 8.803505e+06 1.118780e+07 1.062222e+07 2.286404e+06 3.640118e+06 2.117482e+06 1.105856e+07 4.382081e+07 6.266425e+07 3.154749e+06 1.505117e+07 8.560718e+06 1.115402e+06 1.716174e+07 1.355994e+07 1.312719e+06 1.828457e+06 1.600447e+06 7.278276e+05 1.470867e+06 9.803200e+05 1.052541e+06 1.375062e+06 4.073644e+06 1.275782e+06 1.659221e+06 1.344500e+06 9.665825e+05 1.191913e+06 1.336232e+06 1.201578e+06 1.878733e+06 1.810371e+06 1.894872e+06 1.523909e+06 1.147516e+06 1.085241e+06 2.471664e+06 1.037836e+06 1.241373e+06 8.654281e+05 8.630789e+05 1.017835e+06 1.226799e+06 8.111179e+05 C13 H23 N3 O S2_10.086 1.155248e+06 1.303241e+06 1.036891e+06 1.279407e+06 9.315989e+04 1.072105e+06 9.677365e+05 1.310628e+06 97613.73 8.650325e+05 1.899585e+06 1.173707e+06 60272.57 9.189249e+05 1.122564e+06 1.194691e+06 8.181617e+04 1.042179e+06 1.187502e+06 1.136879e+06 4.107787e+04 1.144333e+06 1.294531e+06 1.305021e+06 14096.779 8.832490e+05 1.438455e+06 1.182807e+06 1.665484e+04 1.040504e+06 1.195879e+06 1.279842e+06 69358.63 1.112538e+06 1.124312e+06 1.084576e+06 4.975047e+04 1.191114e+06 1.155841e+06 1.284246e+06 6.823451e+04 1.175421e+06 1.201942e+06 1.265228e+06 6.603551e+04 1.060028e+06 1.075611e+06 1.259433e+06 1.721985e+06 6.929823e+05 1.121584e+06 1.739587e+06 4.552147e+05 2.245888e+06 1.794427e+06 9.680654e+05 1.287331e+06 1.258076e+06 1.088515e+06 6.812311e+05 1.203168e+06 1.873280e+06 6.160932e+05 8.946845e+05 1.041222e+06 8.544431e+05 1.608929e+06 6.438202e+05 9.331543e+05 1.624259e+06 6.343761e+05 5.700031e+05 9.109850e+05 1.102311e+06 1.803953e+06 1.493751e+06 8.254255e+05 3.147949e+06 1.146194e+06 9.027316e+05 8.001262e+05 8.339930e+05 5.138199e+05 1.004275e+06 1.867261e+06 2.251441e+06 1.072410e+06 1.287631e+06 1.402464e+06 2.806958e+05 1.357890e+06 2.311936e+06 8.909869e+05 1.434374e+06 1.342849e+06 5.915937e+06 1.066352e+06 7.311995e+05 1.470403e+06 4.815367e+05 3.436072e+06 2.318126e+06 1.834246e+06 2.786165e+06 1.658311e+06 4.756885e+06 5.510456e+05 2.651511e+06 6.873668e+05 1.728755e+06 4.123217e+05 1.906751e+06 6.174122e+06 9.093667e+05 6.923899e+05 2.344747e+06 1.420494e+06 1.378320e+06 9.280652e+05 1.181744e+06 5.322630e+05 1.113150e+06 2.928127e+06 5.308177e+05 7.240911e+05 9.180810e+05 1.713854e+06 1.061391e+06 5.140450e+05 2.448000e+05 6.125111e+05 1.103341e+06 6.526051e+05 9.984251e+05 8.819770e+05 9.656618e+05 8.223497e+05 1.430725e+06 1.165096e+06 1.545163e+06 2.786780e+06 2.737271e+06 1.853701e+06 1.140767e+06 2.422482e+06 8.694673e+05 6.501413e+05 1.068343e+06 4.449487e+05 9.073832e+05 3.283306e+05 6.991395e+05 1.187407e+06 1.499546e+06 1.335117e+06 1.175691e+06 1.166371e+06 4.545438e+05 8.905522e+05 7.141037e+05 1.000075e+06 1.085396e+06 1.188409e+06 8.216194e+05 1.332588e+06 1.929748e+06 6.578879e+05 1.182195e+06 1.544932e+06 7.727924e+05 1.717270e+06 1.076615e+06 1.084558e+06 5.926262e+05 1.043759e+06 6.568438e+05 2.648817e+06 2.157828e+06 1.149216e+06 5.925071e+05 2.669684e+05 3.291284e+05 9.955966e+05 4.882550e+05 9.871937e+05 5.731041e+05 1.076678e+06 1.095870e+06 1.235141e+06 1.294229e+06 1.054811e+06 2.330306e+06 4.411777e+05 9.866799e+05 2.052786e+05 1.071398e+06 1.315399e+06 9.187037e+05 3.258139e+05 2.841853e+06 6.509877e+05 2.996949e+06 7.610574e+05 1.056599e+06 7.331162e+05 3.120455e+05 9.082147e+05 1.269453e+06 1.208864e+06 7.365155e+05 1.403676e+06 7.772805e+05 5.029009e+05 2.123165e+06 6.861219e+05 1.823502e+06 1.939086e+06 8.603459e+05 5.748604e+05 1.024432e+06 7.014435e+05 5.717593e+05 2.455256e+06 8.265698e+05 5.669313e+05 8.809819e+05 8.620956e+05 6.819616e+05 1.349696e+06 9.141913e+05 4.573400e+05 5.783516e+05 1.299342e+06 7.190811e+05 1.479202e+06 1.082982e+06 1.195745e+06 6.638084e+05 1.961300e+06 1.746664e+06 1.536616e+06 1.246838e+06 1.013442e+06 1.646050e+06 4.481929e+05 1.131733e+06 2.107733e+06 1.416238e+06 2.072523e+06 7.926181e+05 9.575028e+05 1.205414e+06 1.027642e+06 1.445438e+06 1.043134e+06 8.742090e+05 3.249667e+05 9.358151e+05 2.341071e+06 9.133579e+05 1.172016e+06 1.347811e+06 C6 H9 O4 P_10.141 1.127259e+06 2.671195e+06 2.535722e+06 2.389282e+06 5.729866e+04 1.980571e+06 2.467403e+06 1.397424e+06 56751.83 2.718485e+06 2.247540e+06 2.210490e+06 41785.42 2.509314e+06 1.949645e+06 3.577997e+06 4.293459e+04 1.763590e+06 2.567847e+06 2.977233e+06 2.600664e+04 2.444861e+06 1.729600e+06 1.217723e+05 10604.485 2.749155e+06 3.090960e+06 2.474673e+06 9.605981e+03 2.328295e+06 2.548185e+06 2.343420e+06 33437.92 1.912497e+06 2.741446e+06 3.059469e+06 2.504558e+04 1.675250e+06 2.360936e+06 2.257437e+06 4.233580e+04 2.256755e+06 2.093651e+06 2.365987e+06 5.411099e+04 2.280109e+06 3.368475e+06 1.597314e+06 1.713660e+06 1.142957e+06 1.437105e+06 1.481770e+05 1.481262e+06 4.554039e+06 1.714055e+05 7.877122e+04 8.603012e+04 5.397660e+04 6.823976e+04 8.693274e+04 4.605292e+04 9.555938e+04 6.758492e+04 1.203930e+05 1.117232e+06 1.344055e+06 1.065088e+06 1.084611e+06 1.865417e+06 1.719599e+06 8.344373e+04 1.139443e+05 8.033766e+04 1.900902e+06 1.810705e+06 3.036964e+06 1.260152e+06 1.150303e+06 2.138489e+06 2.309398e+06 2.075079e+06 1.752084e+06 1.279014e+06 1.595830e+06 2.828828e+06 2.627744e+06 2.402873e+06 1.342399e+06 2.039924e+06 1.498672e+06 1.339768e+06 2.962693e+06 9.625239e+05 2.181140e+06 1.284410e+06 1.630460e+06 2.819967e+06 1.909528e+06 2.103161e+06 1.598111e+06 2.312360e+06 1.561816e+06 2.309170e+06 2.056087e+06 1.339677e+06 1.493905e+06 1.541625e+06 1.400390e+06 5.185402e+06 1.916781e+06 1.565372e+06 1.718823e+06 2.346150e+06 2.404034e+06 2.482723e+06 1.403460e+06 4.787690e+05 1.684839e+06 1.850039e+06 1.320437e+06 1.555764e+06 1.206136e+06 1.591514e+06 9.740311e+05 1.938768e+06 2.361884e+06 1.112164e+06 1.667720e+06 1.486555e+06 1.414761e+06 1.042797e+06 4.769859e+06 2.272481e+06 3.122668e+06 2.441502e+06 1.533223e+06 3.016633e+06 2.406580e+06 2.315937e+06 1.852582e+06 2.346571e+06 5.285955e+05 1.431978e+06 3.493115e+06 2.216787e+06 2.056063e+06 1.311397e+06 2.112276e+06 3.716103e+05 9.147825e+05 1.675700e+06 5.991651e+05 1.852977e+06 2.692264e+06 8.305732e+05 1.900805e+06 1.487091e+06 1.526032e+06 4.886991e+05 1.755244e+06 8.972620e+05 1.355108e+06 2.276079e+06 2.887527e+06 1.076989e+06 1.874726e+06 4.270069e+06 1.612081e+06 1.481070e+06 8.599862e+05 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1.847008e+07 1.771165e+07 1.793323e+07 2.152472e+07 3.180637e+06 1.201020e+07 2.229529e+07 1.832045e+07 1.489805e+07 1.033346e+07 1.557495e+07 3.998953e+06 8.951428e+06 1.236571e+07 6.054782e+06 1.706200e+07 1.070967e+07 7.606784e+06 1.671236e+07 8.594954e+06 1.400987e+07 6.282405e+06 1.275473e+07 6.491613e+06 8.777437e+06 1.736084e+07 1.347058e+07 1.081825e+07 1.309264e+07 2.188093e+07 1.361639e+07 1.137445e+07 7.950354e+06 9.141314e+06 4.710661e+06 1.099325e+07 9.239804e+06 1.187270e+07 2.090530e+07 7.479435e+06 1.814120e+07 1.401513e+07 9.166949e+06 1.126953e+07 1.041417e+07 3.075916e+07 1.447580e+07 3.761030e+07 1.297886e+07 2.397361e+07 2.207079e+07 1.643295e+07 1.918411e+07 1.323298e+07 1.407303e+07 8.599293e+07 1.972197e+07 8.477820e+06 2.306678e+07 1.999965e+07 1.017564e+07 1.357024e+07 1.013236e+07 4.730082e+06 7.046669e+06 1.343077e+07 1.440210e+07 2.639473e+07 4.330997e+07 1.285438e+07 1.554026e+07 7.412459e+06 3.686059e+07 1.448579e+07 1.512644e+07 2.158113e+07 1.909673e+07 3.613317e+07 1.588787e+07 1.629612e+07 1.289670e+07 2.633766e+07 1.692013e+07 1.332798e+07 2.211008e+07 1.833874e+07 1.515892e+07 1.106398e+07 1.071771e+07 2.949115e+07 2.627629e+07 3.097170e+07 2.777870e+07 3.626325e+07 1.940758e+07 1.170448e+07 2.042599e+07 8.699668e+06 1.070559e+07 2.668401e+07 1.111162e+07 2.236818e+07 1.121401e+07 8.038669e+06 1.723757e+07 6.440773e+06 1.346894e+07 1.800025e+07 1.662526e+07 8.453926e+06 1.965364e+07 1.514134e+07 1.019482e+07 8.186538e+06 1.108391e+07 1.215597e+07 1.987759e+07 5.537411e+06 3.111152e+07 3.031407e+07 2.285627e+07 5.878711e+06 5.500944e+06 1.759694e+07 8.673547e+06 C5 H18 N6 O6 P2 S_10.145 1.253810e+06 2.900946e+06 2.719379e+06 2.717886e+06 5.580503e+04 2.181702e+06 3.245710e+06 1.484750e+06 55798.67 2.890935e+06 2.407512e+06 2.290997e+06 39804.15 2.639086e+06 2.702788e+06 3.708400e+06 4.091416e+04 2.287431e+06 2.865016e+06 3.010316e+06 2.592822e+04 2.673167e+06 1.989211e+06 1.248037e+05 10029.286 2.993773e+06 3.241742e+06 3.548071e+06 8.676176e+03 2.300520e+06 2.943362e+06 2.516145e+06 31950.88 1.918425e+06 3.058032e+06 3.300729e+06 2.267149e+04 1.932018e+06 2.963233e+06 2.507674e+06 3.944836e+04 2.400623e+06 2.302415e+06 2.392930e+06 4.717542e+04 2.371361e+06 4.449480e+06 1.484462e+06 1.516229e+06 1.388800e+06 1.295418e+06 1.484776e+05 1.746580e+06 4.908003e+06 1.792109e+05 6.211305e+04 8.574008e+04 5.345932e+04 6.922763e+04 8.791050e+04 4.338126e+04 8.170796e+04 6.375367e+04 1.357767e+05 1.184966e+06 1.297385e+06 1.091838e+06 1.144714e+06 1.857840e+06 1.851607e+06 8.005692e+04 1.212003e+05 6.221052e+04 2.203017e+06 1.756457e+06 3.074815e+06 1.573237e+06 1.389006e+06 2.368479e+06 2.598950e+06 2.319188e+06 1.884922e+06 1.287563e+06 2.021374e+06 3.319201e+06 2.773491e+06 2.483588e+06 1.518801e+06 2.457107e+06 1.712672e+06 1.447397e+06 3.224889e+06 1.008744e+06 2.333261e+06 1.404111e+06 1.697571e+06 2.757814e+06 2.172525e+06 2.288679e+06 1.998972e+06 2.413909e+06 1.665720e+06 2.386784e+06 2.090079e+06 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2.042441e+06 4.444396e+06 1.917430e+06 4.896294e+06 1.809779e+06 3.315271e+06 3.426247e+06 2.051833e+06 3.168513e+06 1.703577e+06 1.923371e+06 6.472600e+05 2.406760e+06 9.820765e+05 3.089167e+06 2.899057e+06 1.399330e+06 2.374659e+06 1.445125e+06 4.460362e+05 9.623261e+05 2.919356e+06 1.990215e+06 4.247654e+06 6.782348e+06 2.575500e+06 2.197211e+06 7.433764e+05 4.451818e+06 1.820258e+06 1.973317e+06 3.464754e+06 2.586804e+06 3.458073e+06 2.049032e+06 2.552797e+06 1.871694e+06 3.539661e+06 1.901557e+06 1.898141e+06 2.875467e+06 2.547673e+06 2.564512e+06 1.155231e+06 1.246331e+06 3.982730e+06 3.426387e+06 4.452241e+06 3.892563e+06 4.257041e+06 2.547771e+06 1.662720e+06 3.047038e+06 1.179481e+06 1.298533e+06 3.651146e+06 1.706965e+06 3.296216e+06 1.453652e+06 8.963851e+05 3.119494e+06 7.987949e+05 2.291273e+06 2.675444e+06 2.467793e+06 9.581574e+05 1.682949e+06 1.898873e+06 1.084557e+06 9.402080e+05 1.589421e+06 1.774321e+06 2.594993e+06 7.373886e+05 3.965909e+06 4.507823e+06 3.387634e+06 6.938217e+05 9.342086e+05 2.403493e+06 1.063013e+06 C5 H7 N O3_10.147 3.921138e+06 1.209672e+06 5.037569e+06 6.712209e+06 1.236286e+05 4.812391e+06 2.927027e+06 3.116548e+06 191948.19 1.886828e+06 6.716690e+06 6.058254e+06 118709.57 4.332603e+06 3.290385e+06 3.288910e+06 1.093882e+05 4.729495e+06 5.168837e+06 1.887660e+06 6.228696e+04 3.788500e+06 2.024542e+06 3.109990e+06 18033.979 6.518711e+06 1.712106e+06 1.304498e+06 1.699496e+04 4.870522e+06 3.237062e+06 4.585618e+06 72193.26 2.964352e+06 4.024227e+06 2.893021e+06 6.630503e+04 3.512118e+06 1.636407e+06 3.811415e+06 9.806806e+04 4.141733e+06 2.168241e+06 2.828737e+06 1.229418e+05 5.143724e+06 3.149933e+06 5.683694e+06 5.097931e+06 5.434642e+06 5.152590e+06 6.458226e+06 6.993877e+06 6.827061e+05 2.505449e+06 6.748012e+06 3.360298e+06 1.124247e+07 3.460084e+06 2.214456e+06 6.144254e+06 9.347012e+06 2.306820e+06 7.283639e+06 2.694087e+06 2.637735e+06 3.635288e+06 3.049465e+06 3.344905e+06 4.255276e+06 8.070143e+05 7.755810e+06 6.117196e+06 1.926648e+06 4.548869e+06 8.563640e+05 3.598750e+06 7.651550e+06 9.841873e+06 5.855869e+06 3.405973e+06 4.084341e+06 1.227774e+06 2.589436e+06 8.166379e+06 2.995677e+06 4.027723e+06 9.185943e+05 5.181465e+06 6.678880e+06 3.837014e+06 3.630543e+06 3.328728e+06 6.654888e+06 7.626263e+06 1.667953e+06 4.570335e+06 7.597078e+06 3.437845e+06 5.580665e+06 4.010769e+06 2.087247e+06 2.293783e+06 3.080198e+06 4.761011e+06 2.335784e+06 1.066315e+06 3.612294e+06 4.580107e+06 7.689261e+05 2.248996e+06 4.907430e+06 2.833791e+06 1.504364e+06 2.402250e+06 1.736682e+06 4.291253e+06 4.359001e+06 2.949122e+06 4.125961e+06 1.119522e+06 5.607336e+06 4.702452e+06 3.343398e+06 1.915883e+06 8.165733e+06 6.514297e+06 3.118684e+06 6.104923e+06 4.060798e+06 3.391593e+06 5.715794e+06 3.051289e+06 1.573686e+06 5.984905e+06 4.298150e+06 2.501381e+06 3.278911e+06 2.771709e+06 7.793657e+06 2.738601e+06 2.699879e+06 5.834577e+06 3.318044e+06 7.180160e+06 2.654887e+06 2.318849e+06 2.734736e+06 7.659161e+06 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3.088255e+05 6.879346e+05 8.612463e+05 7.553126e+05 7.832070e+05 8.149689e+05 1.033678e+06 6.172383e+05 8.419287e+05 6.973954e+05 3.461648e+05 5.633650e+05 8.593937e+05 6.694731e+05 8.412739e+05 5.913595e+05 8.623892e+05 6.852876e+05 6.686563e+05 6.971840e+05 7.593545e+05 9.380417e+05 7.802533e+05 6.747422e+05 1.232423e+06 1.037855e+06 8.671803e+05 8.982818e+05 8.699007e+05 4.212228e+05 7.518834e+05 7.136060e+05 6.771749e+05 6.075963e+05 7.692050e+05 9.835873e+05 8.147892e+05 5.891087e+05 1.048643e+06 7.614507e+05 9.091929e+05 8.134586e+05 8.003560e+05 7.232758e+05 7.199540e+05 1.100141e+06 8.199584e+05 6.379487e+05 6.068166e+05 1.034187e+06 6.324069e+05 8.047386e+05 8.790885e+05 8.014523e+05 8.305451e+05 7.479296e+05 5.658861e+05 9.639092e+05 7.765565e+05 8.677434e+05 9.360826e+05 7.316558e+05 8.072209e+05 8.536676e+05 1.012739e+06 6.089021e+05 8.226467e+05 7.933246e+05 C4 H10 N2 O6_10.196 7.141145e+04 2.055675e+05 2.400799e+05 1.764487e+05 5.956844e+04 1.176594e+05 9.147820e+04 1.207236e+05 69944.28 1.731777e+05 9.657457e+04 8.274202e+04 56484.93 2.506367e+05 1.721709e+05 1.032553e+05 7.495484e+04 1.964831e+05 2.372114e+05 1.468721e+05 3.385853e+04 2.565232e+05 1.053493e+05 1.007825e+05 9214.448 1.855130e+05 2.330440e+05 1.549515e+05 7.500098e+03 1.944237e+05 2.328208e+05 1.229728e+05 28893.26 1.754638e+05 2.207048e+05 1.671047e+05 2.001414e+04 2.431493e+05 1.495957e+05 1.641197e+05 3.394099e+04 2.162769e+05 1.604580e+05 1.375518e+05 4.223433e+04 2.549098e+05 2.134694e+05 1.525987e+05 4.587921e+04 6.770424e+04 4.618860e+04 6.495616e+04 2.680923e+04 6.493733e+04 1.045571e+05 9.986316e+04 1.511789e+05 1.319456e+05 8.272617e+04 1.320801e+05 6.689617e+04 9.013103e+04 1.724934e+05 6.827643e+04 4.564685e+04 4.342503e+04 1.092341e+05 3.396638e+04 7.042626e+04 4.777301e+04 1.106197e+05 1.358477e+05 9.493840e+04 7.386182e+04 4.048552e+04 4.056762e+04 6.803071e+04 8.386394e+04 9.739082e+04 3.497247e+04 7.813124e+04 6.850168e+04 2.737715e+04 8.318175e+04 5.232656e+04 4.349145e+04 4.271896e+04 4.983526e+04 5.655854e+04 4.876107e+04 2.936289e+04 6.791136e+04 4.655104e+04 7.040429e+04 5.126547e+04 9.484756e+04 3.675623e+04 4.359166e+04 6.653482e+04 7.927506e+04 6.252301e+04 2.491633e+04 3.398197e+04 4.158986e+04 2.762680e+04 2.969385e+04 3.827615e+04 3.046553e+04 4.911348e+04 2.893840e+04 2.632407e+04 4.556052e+04 3.468820e+04 3.631955e+04 9.210126e+04 6.190299e+04 1.099292e+05 3.188422e+04 3.988175e+04 3.369203e+04 3.651965e+04 3.831316e+04 3.745596e+04 3.487176e+04 3.529318e+04 2.762622e+04 1.024370e+05 4.789411e+04 8.176326e+04 9.180613e+04 4.943410e+04 2.851690e+04 4.100667e+04 2.866993e+04 6.930779e+04 7.339215e+04 4.205267e+04 5.818623e+04 3.218401e+04 5.641057e+04 3.694913e+04 5.102492e+04 8.504518e+04 3.212670e+04 8.033837e+04 3.086049e+04 3.827981e+04 3.462929e+04 1.001646e+05 2.798179e+04 6.594771e+04 4.091802e+04 5.413860e+04 4.185402e+04 8.503262e+04 8.689381e+04 3.854757e+04 8.734698e+04 7.416622e+04 7.487920e+04 3.062467e+04 4.224832e+04 8.630118e+04 4.482203e+04 3.548541e+04 8.981675e+04 3.912618e+04 4.579792e+04 3.800191e+04 3.736044e+04 1.000072e+05 1.035748e+05 3.787218e+04 4.350160e+04 6.131093e+04 5.815003e+04 5.130477e+04 4.253577e+04 7.510665e+04 9.871605e+04 4.712254e+05 7.836203e+04 6.731193e+05 4.496017e+05 7.551041e+05 3.745548e+05 5.831330e+05 1.677417e+06 6.882258e+05 1.622104e+06 8.932965e+05 3.648456e+05 2.583289e+04 3.078716e+05 6.544430e+05 1.828915e+06 1.355406e+06 5.045659e+05 1.707991e+06 5.005919e+05 5.593318e+05 1.125293e+06 4.003584e+04 4.483814e+05 9.397686e+05 1.982610e+05 9.249110e+05 6.608381e+05 4.348146e+05 5.838474e+05 4.974032e+05 4.337104e+05 1.242584e+06 1.044686e+06 2.823756e+06 9.623783e+05 9.178907e+05 5.391963e+05 1.567557e+05 5.723624e+05 1.011332e+06 1.019985e+06 5.628528e+05 7.488627e+05 2.060076e+05 3.349042e+05 6.454851e+05 1.882665e+06 7.085025e+05 9.762648e+05 7.583268e+05 6.821987e+05 1.182939e+06 8.159369e+05 9.694502e+05 5.456838e+05 9.842125e+05 1.009164e+06 6.313858e+05 6.328563e+04 8.153262e+04 4.188361e+04 5.120905e+04 8.834905e+04 4.864968e+04 4.249735e+04 5.256606e+04 3.389954e+04 4.800170e+04 9.437563e+04 9.022414e+04 3.167311e+04 5.828776e+04 7.648085e+04 9.097021e+04 4.966254e+04 4.588337e+04 3.498185e+04 9.297516e+04 3.574993e+04 3.075777e+04 9.449776e+04 1531.5033_10.198 1.556928e+06 1.421856e+06 1.321024e+06 1.382856e+06 3.166382e+04 1.035979e+06 1.330433e+06 1.369701e+06 30860.68 1.296455e+06 1.399217e+06 1.398497e+06 29087.65 1.257340e+06 1.201565e+06 1.389745e+06 3.434599e+04 1.284619e+06 1.254417e+06 1.286288e+06 1.753624e+04 1.173012e+06 1.450479e+06 1.615074e+06 6046.928 1.176961e+06 1.198022e+06 1.241290e+06 6.422711e+03 1.324455e+06 1.308951e+06 1.440532e+06 26198.09 1.286344e+06 1.337052e+06 1.232873e+06 1.873177e+04 1.284468e+06 1.246430e+06 1.424635e+06 2.646070e+04 1.279946e+06 1.397781e+06 1.404905e+06 2.666281e+04 1.182712e+06 1.119112e+06 1.469233e+06 1.075249e+06 1.423323e+06 1.170697e+06 2.148569e+06 1.476751e+06 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1.792726e+06 2.024980e+06 1.360180e+06 9.278242e+05 1.120563e+06 9.757818e+05 9.125486e+05 1.405394e+06 1.365555e+06 1.236946e+06 1.339632e+06 1.372295e+06 1.485665e+06 1.135854e+06 9.194758e+05 1.262982e+06 7.788263e+05 1.482963e+06 1.309897e+06 1.269538e+06 1.129212e+06 1.736952e+06 1.460690e+06 1.361260e+06 1.798788e+06 1.980245e+06 1.455538e+06 1.462514e+06 1.434563e+06 1.197388e+06 1.564742e+06 1.571892e+06 1.413698e+06 1.490505e+06 1.391342e+06 8.193301e+05 1.234997e+06 1.161930e+06 1.236427e+06 1.512869e+06 1.324771e+06 1.503375e+06 1.364293e+06 1.515383e+06 1.701194e+06 1.228415e+06 1.788509e+06 1.517086e+06 1.420727e+06 1.081847e+06 5.380668e+05 1.371433e+06 2.058267e+06 1.004155e+06 1.100002e+06 9.661963e+05 1.243529e+06 1.063302e+06 1.514791e+06 1.288232e+06 1.318590e+06 1.245928e+06 9.862839e+05 1.649574e+06 4.375269e+05 1.143235e+06 1.466740e+06 1.049071e+06 1.407732e+06 1.555477e+06 1.800372e+06 1.111541e+06 1.363872e+06 1.287875e+06 5.418285e+05 8.098554e+05 1.306154e+06 1.041265e+06 1.547879e+06 9.444200e+05 1.411679e+06 1.251314e+06 1.262057e+06 1.247476e+06 1.257803e+06 1.528200e+06 1.324341e+06 1.252650e+06 2.485340e+06 1.830799e+06 1.489115e+06 1.402520e+06 1.420532e+06 7.407770e+05 1.179776e+06 1.160258e+06 1.198337e+06 1.009869e+06 1.199465e+06 1.446016e+06 1.386040e+06 1.097198e+06 1.732157e+06 1.295188e+06 1.745518e+06 1.259819e+06 1.425864e+06 1.179710e+06 1.169146e+06 1.734790e+06 1.141849e+06 9.440796e+05 8.813052e+05 1.885827e+06 1.031119e+06 1.194987e+06 1.472956e+06 1.215305e+06 1.474444e+06 1.198333e+06 1.001694e+06 1.519739e+06 1.227135e+06 1.465139e+06 1.546666e+06 1.290191e+06 1.391673e+06 1.476702e+06 1.728471e+06 8.960101e+05 1.455701e+06 1.228861e+06 C3 H2 Cl O10 P3 S_10.199 7.971659e+05 6.549143e+05 6.129785e+05 6.245109e+05 3.322866e+04 4.851297e+05 5.841125e+05 7.407213e+05 30359.84 5.877493e+05 6.443102e+05 6.477036e+05 28733.93 5.379910e+05 5.739262e+05 6.443417e+05 3.329405e+04 5.687407e+05 5.985825e+05 6.055571e+05 1.610960e+04 5.433528e+05 6.374592e+05 7.664552e+05 5283.852 5.729467e+05 5.539724e+05 5.881407e+05 5.553386e+03 5.876627e+05 6.317314e+05 6.409981e+05 22381.14 6.086377e+05 6.150082e+05 5.457389e+05 1.537430e+04 6.059548e+05 6.266261e+05 6.712091e+05 2.186458e+04 5.329259e+05 6.519699e+05 6.681694e+05 2.335586e+04 5.628996e+05 5.408768e+05 6.529389e+05 4.961300e+05 8.100138e+05 6.584707e+05 1.202531e+06 7.500821e+05 8.431198e+05 1.027039e+06 8.298271e+05 6.664395e+05 1.298393e+06 1.328411e+06 1.149986e+06 9.349536e+05 8.617906e+05 9.528140e+05 9.386561e+05 1.672650e+05 7.513514e+05 4.360435e+05 4.170680e+05 1.172755e+06 5.494113e+05 3.023366e+05 5.972513e+05 4.604571e+05 6.774172e+05 6.214711e+05 6.757940e+05 8.503974e+05 9.023402e+05 1.483289e+06 9.496120e+05 4.668212e+05 6.774806e+05 9.104661e+05 9.139507e+05 7.308258e+05 6.366694e+05 8.505963e+05 7.425162e+05 7.767963e+05 5.106569e+05 6.369451e+05 6.171079e+05 7.836892e+05 7.568967e+05 1.156363e+06 6.315943e+05 8.558962e+05 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7.680462e+05 6.031727e+05 7.530533e+05 7.690579e+05 6.648667e+05 6.970355e+05 7.213136e+05 9.890455e+05 2.681927e+05 8.081180e+05 5.771363e+05 1687.54354_10.201 1.359718e+06 1.285492e+06 1.262111e+06 1.220908e+06 1.863940e+04 9.188796e+05 1.064624e+06 1.243740e+06 19535.89 1.187489e+06 1.259177e+06 1.277709e+06 19113.47 1.132664e+06 1.090004e+06 1.085844e+06 2.338677e+04 1.235132e+06 1.099492e+06 1.300768e+06 1.222983e+04 1.064505e+06 1.216769e+06 1.254678e+06 4351.651 1.099244e+06 1.170611e+06 1.149198e+06 4.832361e+03 1.272186e+06 1.210881e+06 1.575803e+06 23317.10 1.247852e+06 2.954509e+04 1.283954e+06 1.672858e+04 1.308617e+06 1.205875e+06 1.146402e+06 2.021441e+04 1.099880e+06 1.343476e+06 1.321542e+06 2.471493e+04 1.430419e+06 1.498986e+06 8.259661e+04 1.590594e+06 1.206931e+06 1.418734e+06 1.454710e+06 1.453966e+06 1.155262e+06 1.257306e+06 3.151321e+06 1.185803e+06 1.392744e+06 1.864488e+06 1.388596e+06 1.440505e+06 1.628056e+06 1.320156e+06 1.639174e+06 1.135769e+06 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1.261446e+06 9.519867e+05 1.055045e+06 1.379493e+06 1.151832e+06 1.394765e+06 1.408132e+06 1.408203e+06 1.134793e+06 1.183965e+06 1.154868e+06 7.372167e+04 1.459973e+06 1.277053e+06 1.546689e+06 1.257351e+06 1.037440e+06 1.152487e+06 3.990699e+04 1.358043e+06 1.271443e+06 1.518211e+06 1.403750e+06 1.020238e+06 1.210266e+06 1.185611e+06 7.270634e+04 1.491927e+06 1.245752e+06 1.197965e+06 1.342785e+06 1.141555e+06 1.978266e+06 1.079379e+06 1.290115e+06 1.153706e+06 1.107666e+06 1.177373e+06 1.079596e+06 1.658347e+06 1.127355e+06 1.178444e+06 8.986250e+05 1.361941e+06 1.258112e+06 1.995015e+06 1.098368e+06 9.621601e+05 1.307166e+06 1.109387e+06 1.468707e+06 1.349580e+06 8.345092e+05 1.090911e+06 1.170095e+06 1.241547e+06 6.127482e+04 1.225017e+06 1.129842e+06 1.387329e+05 1.250342e+06 1.131367e+06 6.763286e+05 1.091842e+06 1.213842e+06 1.175936e+06 7.952434e+04 1.212460e+06 1.595114e+06 1.008185e+06 8.424461e+05 1.188734e+06 2.016966e+06 1.191876e+06 1.313913e+06 1.041761e+06 1.320919e+06 1.103269e+06 1.145732e+06 1.336062e+05 1.148609e+06 6.498496e+05 1.128393e+06 1.289068e+06 1.213515e+06 5.119304e+04 1.248408e+06 1.404854e+06 1.095874e+06 1.177652e+06 1.583085e+06 1.127390e+06 1.157344e+06 1.495295e+06 1.242081e+06 1.402934e+06 1.131750e+06 1.381171e+06 1.149131e+06 1.129600e+06 1.109404e+06 1.309059e+06 1.120276e+06 1.822646e+06 1.423574e+06 1.464049e+06 1.151987e+06 1.265848e+06 1.205272e+06 1.205249e+06 1.148159e+06 1.219653e+06 1.221127e+06 1.139711e+06 1.187967e+06 1.188724e+06 1.212174e+06 1.322821e+06 1.150860e+06 1.150980e+06 C50 H110 N5 P3 S3_10.212 1.084287e+06 9.740168e+05 1.060656e+06 9.770270e+05 1.940246e+04 6.693507e+05 9.404428e+05 1.097919e+06 19313.19 8.716703e+05 9.095417e+05 1.087604e+06 17382.44 9.164161e+05 8.910796e+05 9.658450e+05 2.133646e+04 8.888176e+05 8.164356e+05 1.015128e+06 1.108217e+04 8.768647e+05 9.885614e+05 1.068475e+06 3775.706 8.971892e+05 9.357960e+05 9.090749e+05 4.005159e+03 9.515955e+05 8.323022e+05 1.054531e+06 17323.76 9.436789e+05 9.842708e+05 8.284896e+05 1.222029e+04 9.476540e+05 9.035688e+05 1.023065e+06 1.699982e+04 8.744676e+05 1.018922e+06 1.043201e+06 1.636392e+04 8.334818e+05 8.684374e+05 9.892667e+05 8.065863e+05 9.466154e+05 8.726799e+05 1.210723e+06 1.075040e+06 1.074464e+06 1.166383e+06 1.266347e+06 9.992076e+05 1.479055e+06 1.559449e+06 1.480915e+06 1.210455e+06 1.072754e+06 1.302460e+06 1.328152e+06 5.660468e+05 1.002443e+06 7.991601e+05 8.003452e+05 1.526681e+06 8.593027e+05 7.602906e+05 1.052100e+06 1.036332e+06 9.330729e+05 1.040987e+06 1.013877e+06 1.041561e+06 1.175477e+06 1.500434e+06 1.153106e+06 7.615763e+05 9.621091e+05 1.097553e+06 1.238204e+06 1.059688e+06 1.038402e+06 9.718135e+05 9.571063e+05 1.046445e+06 7.848098e+05 1.055251e+06 9.574712e+05 1.170244e+06 8.932716e+05 1.169350e+06 9.741639e+05 1.172195e+06 8.923028e+05 4.556960e+05 1.180869e+06 6.507068e+05 9.518373e+05 6.245756e+05 1.083986e+06 7.838022e+05 1.052931e+06 1.106887e+06 1.297429e+06 1.009408e+06 8.419584e+05 6.763608e+05 9.669160e+05 6.302349e+05 6.409993e+05 9.673915e+05 1.124280e+06 1.246257e+06 8.218351e+05 1.488327e+06 1.175663e+06 8.421080e+05 1.069266e+06 7.399450e+05 1.259971e+06 9.549071e+05 1.032298e+06 8.802755e+05 6.865165e+05 9.679586e+05 6.216298e+05 1.196036e+06 1.168274e+06 2.307846e+04 7.434966e+05 8.600906e+05 6.964286e+05 6.628062e+05 1.021538e+06 1.012379e+06 8.662454e+05 8.498271e+05 9.561252e+05 9.995609e+05 8.116123e+05 7.015154e+05 9.427122e+05 6.860445e+05 1.052668e+06 9.966302e+05 9.295016e+05 7.892967e+05 1.185371e+06 1.126769e+06 9.658932e+05 1.125215e+06 1.307352e+06 1.129808e+06 1.050137e+06 1.005734e+06 8.170644e+05 1.031763e+06 1.127643e+06 9.500968e+05 1.041565e+06 1.130286e+06 7.194991e+05 9.305807e+05 9.437596e+05 9.305487e+05 1.166247e+06 9.743362e+05 1.070317e+06 1.084557e+06 1.054530e+06 1.198568e+06 8.127164e+05 1.269178e+06 9.667070e+05 9.970820e+05 7.939724e+05 4.214623e+05 9.940968e+05 1.294662e+06 7.173876e+05 6.934741e+05 7.020786e+05 9.619519e+05 7.533306e+05 1.035515e+06 7.619056e+05 1.065294e+06 8.358166e+05 7.083110e+05 1.309370e+06 3.435632e+05 7.754848e+05 1.002162e+06 8.814511e+05 9.728423e+05 1.032448e+06 1.150243e+06 7.547816e+05 1.020743e+06 8.248277e+05 4.730916e+05 6.527657e+05 9.868928e+05 7.535257e+05 1.047754e+06 7.046485e+05 1.014581e+06 8.396210e+05 8.402901e+05 8.123685e+05 8.385802e+05 1.130126e+06 9.055562e+05 8.201920e+05 1.496547e+06 1.209274e+06 9.070516e+05 1.007200e+06 1.058730e+06 5.088568e+05 8.679987e+05 7.985059e+05 8.029210e+05 7.357114e+05 9.246423e+05 1.099569e+06 9.493640e+05 6.906618e+05 1.263413e+06 9.002950e+05 1.100781e+06 9.919563e+05 1.007855e+06 8.473312e+05 8.206864e+05 1.290445e+06 9.386330e+05 7.484410e+05 7.626639e+05 1.273883e+06 7.728662e+05 8.954200e+05 1.011431e+06 8.983474e+05 1.011918e+06 8.919881e+05 6.656983e+05 1.156764e+06 8.588551e+05 1.023950e+06 1.133100e+06 8.717696e+05 9.430114e+05 9.979673e+05 1.249567e+06 7.503885e+05 9.654475e+05 9.226677e+05 319.86088_10.212 1.106134e+06 1.085998e+06 1.053270e+06 9.777720e+05 2.603379e+04 9.143095e+05 1.129924e+06 9.907394e+05 34221.11 1.059375e+06 1.057801e+06 1.019794e+06 31137.05 8.141690e+05 8.892554e+05 1.380570e+06 3.559064e+04 1.038052e+06 1.011301e+06 9.259020e+05 1.944351e+04 9.885526e+05 9.205806e+05 1.202451e+06 7017.398 9.681394e+05 9.805266e+05 1.053277e+06 8.121351e+03 1.054961e+06 9.741798e+05 1.136599e+06 31090.72 9.163079e+05 1.083967e+06 9.095998e+05 2.168376e+04 1.013038e+06 1.043445e+06 1.034833e+06 3.063417e+04 1.037886e+06 1.070190e+06 1.050840e+06 3.250950e+04 9.231309e+05 1.162096e+06 9.208063e+05 1.055723e+06 1.051020e+06 1.228700e+06 1.102268e+06 1.138028e+06 2.622027e+06 1.113245e+06 1.098010e+06 1.065746e+06 1.009976e+06 1.216087e+05 2.051640e+05 1.130584e+06 1.048860e+05 1.316176e+06 1.860608e+05 8.992570e+05 1.134029e+06 1.149553e+06 1.040317e+06 9.733222e+05 1.100970e+06 9.495435e+05 1.028186e+06 1.284132e+06 9.207076e+05 9.860439e+05 1.083090e+06 1.106589e+06 9.792175e+05 1.034258e+06 1.128332e+06 1.058320e+06 1.083236e+06 1.231328e+06 1.242200e+06 1.080949e+06 1.010542e+06 1.038054e+06 1.085691e+06 1.071125e+06 8.316165e+05 1.007758e+06 1.078901e+06 1.342807e+06 1.099140e+06 1.048778e+06 1.020272e+06 1.016579e+06 1.076278e+06 9.139160e+05 9.985299e+05 1.162734e+06 9.654385e+05 9.720813e+05 1.047064e+06 1.059026e+06 8.527225e+05 1.534047e+06 1.124667e+06 1.934854e+06 1.018507e+06 1.047316e+06 1.072765e+06 1.397958e+06 1.047563e+06 1.077191e+06 1.009347e+06 9.997120e+05 9.478320e+05 1.464777e+06 9.338433e+05 1.026918e+06 1.128603e+06 1.016706e+06 1.121124e+06 1.008297e+06 1.030736e+06 1.011212e+06 1.128201e+06 1.146802e+06 1.104203e+06 1.099953e+06 1.109884e+06 9.310413e+05 8.584792e+05 1.023688e+06 1.387684e+06 9.801039e+05 1.118454e+06 1.016429e+06 8.667505e+05 1.165726e+06 1.037401e+06 1.014928e+06 1.039695e+06 9.327292e+05 9.942066e+05 9.466222e+05 1.110705e+06 1.290558e+06 9.906620e+05 1.111164e+06 1.032544e+06 9.181025e+05 1.937777e+06 1.111182e+06 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1.196645e+06 1.078135e+06 1.078913e+06 1.009491e+06 1.041628e+06 9.036987e+05 1.001239e+06 1.053159e+06 1.178657e+06 9.524434e+05 1.008790e+06 1.230499e+06 1.027684e+06 1.135895e+06 1.002470e+06 1.119111e+06 1.041180e+06 9.306637e+05 9.846762e+05 1.248348e+06 9.852316e+05 9.727023e+05 1.315379e+06 1.099615e+06 1.161034e+06 8.386182e+05 1.007362e+06 1.006840e+06 1.152158e+06 1.128499e+06 C3 H2 Cl N6 O5 P3 S3_10.213 1.326932e+06 1.161573e+06 1.093282e+06 1.079874e+06 3.153041e+04 8.163865e+05 1.084672e+06 1.170659e+06 33918.32 1.065616e+06 1.053328e+06 1.082003e+06 27806.17 1.017092e+06 1.081879e+06 1.045488e+06 3.206784e+04 1.055085e+06 1.034607e+06 1.029223e+06 1.574582e+04 9.967979e+05 1.123997e+06 1.259657e+06 5286.584 1.033647e+06 9.302942e+05 9.911004e+05 6.087082e+03 1.092968e+06 1.018128e+06 1.261751e+06 22331.60 1.019687e+06 1.051195e+06 9.112089e+05 1.580172e+04 1.101446e+06 1.086997e+06 1.092397e+06 2.263632e+04 9.959040e+05 1.152114e+06 1.163874e+06 2.350069e+04 9.739944e+05 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1.001880e+06 1.335216e+06 8.965027e+05 1.326008e+06 1.215858e+06 1.141829e+06 1.325596e+06 1.269263e+06 1.359533e+06 1.179730e+06 1.179429e+06 2.290354e+06 1.829901e+06 1.322551e+06 1.405211e+06 1.363700e+06 7.275681e+05 1.109955e+06 1.162167e+06 1.088524e+06 1.024238e+06 1.227329e+06 1.372237e+06 1.186700e+06 1.077466e+06 1.675585e+06 1.218816e+06 1.593936e+06 1.311890e+06 1.269484e+06 1.095141e+06 1.071467e+06 1.506532e+06 1.222813e+06 8.229477e+05 8.365665e+05 1.726020e+06 1.075459e+06 1.162889e+06 1.419418e+06 1.217743e+06 1.336276e+06 1.165105e+06 1.008637e+06 1.420227e+06 1.255226e+06 1.398080e+06 1.496031e+06 1.287542e+06 1.331001e+06 1.394572e+06 1.654708e+06 8.731696e+05 1.365172e+06 1.233521e+06 C11 H4 N2 O11 P2 S5_10.218 1.721310e+06 1.394962e+06 1.435047e+06 1.504298e+06 3.177298e+04 1.105470e+06 1.357168e+06 6.764670e+04 34285.65 1.429517e+06 1.413996e+06 1.499574e+06 27714.87 1.345529e+06 1.251709e+06 1.516613e+06 3.206140e+04 1.265377e+06 1.238758e+06 1.502511e+06 1.566051e+04 1.238365e+06 1.414736e+06 1.617726e+06 5238.189 1.358269e+06 1.265868e+06 1.286293e+06 6.205063e+03 1.322593e+06 1.429889e+06 1.500419e+06 23390.10 1.362545e+06 1.411017e+06 1.186372e+06 1.650328e+04 1.382354e+06 1.337364e+06 1.490185e+06 2.266386e+04 1.268742e+06 1.443200e+06 1.539813e+06 2.237255e+04 1.355269e+06 1.171795e+06 1.449922e+06 1.129997e+06 1.592614e+06 1.339043e+06 2.450047e+06 1.588397e+06 1.773376e+06 1.809893e+06 1.777158e+06 1.352758e+06 2.399575e+06 2.773809e+06 2.287023e+06 2.081698e+06 1.565624e+06 2.026654e+06 2.195025e+06 4.603782e+05 1.589308e+06 9.508520e+05 9.639559e+05 2.473195e+06 1.179790e+06 9.960554e+05 1.376572e+06 1.242598e+06 1.427862e+06 1.324762e+06 1.409765e+06 1.736517e+06 1.872472e+06 2.675512e+06 2.024009e+06 1.103195e+06 1.429985e+06 1.836659e+06 1.842549e+06 1.571781e+06 1.376780e+06 1.693202e+06 1.495125e+06 1.639548e+06 1.149760e+06 1.463535e+06 1.527251e+06 1.654064e+06 1.457494e+06 2.105204e+06 1.333327e+06 1.627221e+06 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1.730106e+06 1.476158e+06 1.599939e+06 1.577216e+06 1.451249e+06 1.517409e+06 1.761871e+06 1.816024e+06 7.853016e+05 1.548782e+06 1.314456e+06 1551.56897_10.218 1.662929e+06 3.441141e+05 1.304752e+06 1.263782e+06 1.738911e+04 9.467056e+05 1.110063e+06 1.049135e+06 17215.72 9.880827e+05 1.004374e+06 1.154783e+06 14608.64 9.676534e+05 7.928853e+05 9.524424e+05 1.818656e+04 1.051247e+06 9.878266e+05 1.085222e+06 9.365757e+03 9.281122e+05 9.624958e+05 1.153839e+06 3378.133 9.705467e+05 9.976645e+05 1.109466e+06 4.586511e+03 1.158964e+06 2.380371e+05 1.208551e+06 17802.89 1.240351e+06 9.779000e+05 9.080741e+05 1.148698e+04 9.796463e+05 1.010028e+06 9.760551e+05 1.608717e+04 1.069135e+06 1.123396e+06 1.119696e+06 1.903734e+04 1.075768e+06 2.832838e+05 1.402439e+06 1.306418e+06 9.870530e+05 1.124641e+06 1.178987e+06 1.118647e+06 8.709857e+04 1.125555e+06 1.781914e+06 1.058075e+06 1.297729e+06 1.209436e+06 1.100810e+06 1.337627e+06 1.467098e+06 1.168335e+06 1.103551e+06 7.703362e+05 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1.081066e+06 3.840419e+05 9.486429e+05 1.337227e+05 5.808025e+05 9.927462e+05 9.562681e+05 1.107275e+06 1.296833e+05 9.970826e+05 1.218805e+06 1.004876e+06 1.135623e+06 1.140489e+06 9.742400e+05 8.640248e+04 1.045000e+06 1.031915e+06 2.540053e+05 9.940409e+05 1.289871e+06 9.888730e+05 1.086493e+06 1.021551e+06 1.161192e+06 8.685007e+05 1.265805e+06 1.285156e+06 1.124403e+06 1.049151e+06 1.265816e+06 1.004767e+06 1.346882e+06 1.058402e+06 1.046632e+06 1.190607e+06 1.017333e+06 1.089170e+06 1.211621e+04 1.078222e+06 8.786975e+05 1.170075e+06 1.087017e+06 C7 H9 N2 O16 P3 S5_10.218 1.654123e+06 1.530893e+06 1.367599e+06 1.484751e+06 2.943676e+04 1.136598e+06 1.346096e+06 1.572192e+06 31364.86 1.322007e+06 1.461063e+06 1.515511e+06 25799.68 1.354788e+06 1.389007e+06 1.446920e+06 3.147667e+04 1.268354e+06 1.288266e+06 1.528782e+06 1.606792e+04 1.272673e+06 1.405104e+06 1.712661e+06 5237.212 1.246835e+06 1.317283e+06 1.387909e+06 6.122280e+03 1.363652e+06 1.422776e+06 1.575815e+06 22999.03 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1.686345e+04 1.709119e+05 1.845870e+04 6.392200e+04 2.985790e+05 1.742011e+05 3.799519e+04 2.360916e+05 2.891023e+05 4.101307e+04 2.278773e+05 5.357217e+04 2.090988e+05 1.769108e+04 3.848776e+05 3.070838e+05 2.720702e+04 2.175000e+05 1.867946e+05 2.868758e+05 1.945174e+05 3.136518e+05 2.186500e+05 2.741702e+05 5.241260e+04 1.344287e+05 2.691254e+05 1.052371e+05 2.697053e+05 3.921841e+04 2.774145e+05 3.538916e+05 2.833593e+05 3.829129e+05 2.239614e+05 6.236266e+05 3.601554e+05 8.267629e+04 1.874709e+05 4.076164e+05 2.188685e+05 2.116278e+05 2.076269e+05 2.526133e+05 2.933243e+05 3.297814e+05 2.396528e+05 2.055769e+05 2.509681e+05 1.932020e+05 2.008647e+05 4.039336e+05 3.657248e+05 2.834927e+04 3.525095e+04 3.018989e+05 1.585842e+05 2.312221e+05 3.079239e+05 1.487597e+05 1.731469e+05 7.441907e+04 4.795713e+04 1.911464e+04 1.641111e+05 4.518541e+04 2.058875e+05 3.535417e+05 1.606220e+05 3.932177e+04 1.841323e+05 2.671863e+04 3.907729e+04 2.703565e+04 2.487886e+05 2.409280e+05 4.975091e+04 2.241967e+05 2.373849e+05 3.097383e+04 2.649623e+05 2.786233e+05 3.128869e+04 2.398763e+05 3.607187e+05 3.194702e+05 3.411157e+05 2.524791e+04 2.527625e+05 2.536232e+05 1.073927e+04 4.553169e+04 3.897477e+04 3.155340e+05 2.676517e+05 C2 H N3 O5 P2_10.219 1.174469e+05 4.833796e+05 1.833137e+05 4.423399e+05 1.604902e+04 5.368855e+05 8.604107e+04 1.100496e+05 26294.71 5.209742e+04 1.468772e+05 2.865152e+04 16286.03 5.943437e+05 3.580630e+05 5.631031e+05 1.568754e+04 3.122645e+05 3.744200e+05 5.076480e+04 9.369318e+03 3.497898e+05 3.598755e+05 7.422485e+04 3631.122 6.490340e+05 3.069289e+05 4.074621e+05 3.628121e+03 3.722514e+05 3.595759e+05 3.937958e+05 11797.28 4.469304e+05 3.839613e+05 3.437902e+05 8.454136e+03 3.432375e+05 4.042075e+05 3.984824e+05 1.263524e+04 3.090184e+05 4.306011e+04 4.683911e+05 1.288551e+04 3.465757e+05 3.704783e+05 3.629339e+05 3.608430e+05 2.318389e+04 4.953892e+05 5.391230e+04 4.276548e+05 1.020296e+06 1.122832e+05 1.042940e+05 5.045601e+04 1.390256e+05 3.723263e+04 5.231919e+04 1.052010e+05 5.544180e+04 4.590097e+05 5.376791e+04 4.978660e+05 5.675087e+05 8.332922e+04 3.738385e+05 2.060920e+04 4.858830e+05 2.303907e+05 3.664942e+04 5.289994e+05 4.968907e+05 4.945124e+05 2.891837e+04 2.940432e+04 7.487962e+04 4.749797e+05 4.600222e+05 4.290606e+04 4.718739e+05 4.568920e+05 1.643255e+05 4.703588e+05 3.492967e+05 3.223477e+05 3.952570e+05 5.784488e+05 2.385634e+04 4.590445e+05 1.748595e+05 1.532348e+05 9.218481e+04 1.951821e+04 4.700372e+05 3.265936e+05 3.838687e+05 1.313150e+05 6.059605e+04 6.076405e+05 3.319862e+05 6.593553e+05 1.036096e+05 3.473035e+05 3.688366e+05 4.662407e+05 5.852445e+05 1.046573e+06 3.421577e+05 4.550306e+05 5.030177e+05 5.864785e+05 4.446156e+05 5.388767e+05 6.927570e+04 4.055244e+04 3.895843e+05 3.918543e+05 4.981811e+04 3.911071e+05 3.661412e+05 3.346446e+05 4.559977e+05 3.558966e+05 3.571682e+05 1.233693e+05 3.940884e+05 1.043272e+05 7.376166e+04 1.939867e+05 4.871239e+05 3.246087e+05 4.248538e+05 2.272486e+04 6.990288e+05 3.525550e+05 1.675173e+05 5.103170e+05 1.437317e+05 4.086160e+05 5.281184e+05 6.409414e+05 4.286645e+05 3.830623e+04 3.961512e+05 4.286197e+05 1.865574e+04 9.427777e+04 2.619324e+05 7.645461e+04 3.414871e+05 5.048887e+05 6.379987e+05 5.650394e+04 1.460879e+05 1.755893e+05 9.684734e+04 6.220467e+05 6.469463e+05 3.545410e+05 2.656199e+04 4.206015e+04 3.422496e+05 4.143618e+05 1.076625e+05 6.433558e+05 2.062518e+04 3.591644e+05 4.786574e+04 2.077544e+05 7.023564e+04 4.487349e+05 5.723109e+05 2.061951e+04 1.623596e+05 2.503771e+05 4.598931e+04 2.133570e+04 4.899142e+05 7.424414e+04 4.140747e+05 2.882361e+05 9.721953e+05 5.046046e+05 4.080643e+05 3.143012e+04 3.627633e+05 8.834593e+05 3.438815e+05 3.907396e+05 7.623126e+04 3.584405e+05 3.492746e+05 3.707165e+05 9.961143e+05 5.981256e+05 4.905728e+05 4.740323e+05 4.057296e+05 1.257202e+05 5.087649e+05 9.213616e+05 7.948603e+05 4.631323e+05 4.173746e+05 7.415664e+05 9.349946e+05 5.329399e+05 6.217176e+05 3.501486e+05 6.064336e+05 3.803507e+05 3.753727e+05 1.871332e+05 4.354195e+05 3.515276e+05 2.509633e+05 6.329548e+04 1.763158e+05 7.278487e+05 7.660931e+05 3.622490e+05 2.520443e+05 5.889619e+05 7.541026e+05 3.414912e+05 3.540824e+05 6.794918e+05 2.669146e+05 1.018388e+05 3.679787e+05 3.491236e+05 4.641879e+05 4.780182e+05 2.965404e+05 5.984201e+04 4.023995e+05 7.562372e+05 6.758765e+04 3.112335e+04 7.002595e+05 3.271403e+04 1.066865e+05 5.253770e+05 5.866297e+05 7.601719e+04 6.112217e+05 4.844731e+05 5.159268e+04 4.487510e+04 4.537928e+05 6.296522e+05 2.050942e+05 4.786050e+04 3.642510e+05 5.906703e+05 4.585533e+05 2.242316e+04 2.137795e+04 3.751198e+05 4.739804e+04 341.8532_10.219 5.457167e+06 5.011919e+06 4.687096e+06 4.618193e+06 3.190835e+04 3.826644e+06 4.853411e+06 4.806730e+06 35077.28 4.438149e+06 4.959720e+06 4.990789e+06 29189.58 4.306809e+06 4.369345e+06 4.691521e+06 3.925375e+04 4.554948e+06 4.494140e+06 4.686123e+06 1.735936e+04 4.299768e+06 4.693997e+06 5.518566e+06 6766.856 4.334982e+06 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2.081513e+06 5.364978e+06 6.821611e+06 3.500277e+06 3.739981e+06 3.547434e+06 4.719966e+06 3.986907e+06 5.369339e+06 4.820143e+06 5.034395e+06 4.461172e+06 3.632389e+06 5.785901e+06 2.006415e+06 4.372387e+06 5.350501e+06 4.223929e+06 5.499853e+06 5.559573e+06 6.674910e+06 3.977149e+06 5.735006e+06 4.717592e+06 2.094477e+06 3.053175e+06 4.611822e+06 3.774147e+06 5.104205e+06 3.695250e+06 5.144194e+06 4.507813e+06 4.521984e+06 4.541838e+06 4.839466e+06 5.397778e+06 4.496723e+06 4.466701e+06 9.025821e+06 6.969398e+06 4.811116e+06 5.414857e+06 5.326541e+06 2.692475e+06 4.335728e+06 4.253601e+06 3.918711e+06 3.618541e+06 4.521704e+06 5.065151e+06 4.708705e+06 3.997081e+06 5.995549e+06 4.460114e+06 6.468107e+06 4.623025e+06 5.290985e+06 4.316180e+06 4.070362e+06 6.037582e+06 4.705560e+06 3.428725e+06 3.384376e+06 6.577928e+06 4.059824e+06 4.417132e+06 5.209991e+06 4.343118e+06 5.229755e+06 4.176165e+06 3.843379e+06 5.769618e+06 4.600914e+06 5.399423e+06 5.388825e+06 4.749087e+06 4.799937e+06 5.327838e+06 6.095404e+06 3.051725e+06 5.372735e+06 4.426079e+06 C11 H20 N2 O3_10.22 8.305025e+04 2.102431e+05 1.899006e+05 1.783736e+05 3.900840e+04 1.175162e+05 1.875506e+05 1.732461e+05 43437.83 1.704051e+05 1.982272e+05 1.921819e+05 36089.93 1.658064e+05 1.867198e+05 1.881237e+05 4.425948e+04 1.513521e+05 1.514184e+05 1.636227e+05 2.246694e+04 1.967097e+05 2.062123e+05 2.317204e+05 7925.517 1.234194e+05 1.618072e+05 1.697161e+05 9.878698e+03 1.642779e+05 1.844469e+05 2.303707e+05 33583.26 1.803038e+05 1.422370e+05 1.421624e+05 2.361364e+04 1.919870e+05 1.846170e+05 1.752728e+05 3.186726e+04 1.834627e+05 1.943776e+05 1.933417e+05 3.257029e+04 1.543678e+05 1.610065e+05 1.895163e+05 5.377238e+04 6.282129e+04 5.242931e+04 7.727529e+04 6.205513e+04 5.492944e+04 8.336096e+04 7.270346e+04 1.110232e+05 9.790556e+04 1.056729e+05 9.310045e+04 8.544533e+04 7.658629e+04 1.071439e+05 8.724237e+04 6.968492e+04 5.531513e+04 8.436053e+04 6.753361e+04 6.916755e+04 7.188360e+04 9.287222e+04 9.248127e+04 7.846253e+04 7.470768e+04 7.281582e+04 7.691368e+04 7.115712e+04 7.442951e+04 8.080348e+04 5.747964e+04 7.436144e+04 6.368977e+04 5.848985e+04 7.700426e+04 6.488467e+04 5.823584e+04 4.537381e+04 3.138049e+04 6.999870e+04 6.505910e+04 6.610771e+04 6.711197e+04 7.052564e+04 6.655679e+04 6.099420e+04 7.876495e+04 6.436801e+04 6.373146e+04 9.221305e+04 6.686448e+04 5.460780e+04 5.826210e+04 6.148403e+04 6.934772e+04 5.761081e+04 5.816390e+04 3.267431e+04 5.950769e+04 5.665345e+04 3.917384e+04 5.693174e+04 7.128189e+04 5.875800e+04 5.858150e+04 1.289913e+05 7.465884e+04 9.674470e+04 6.223591e+04 6.901894e+04 7.196351e+04 3.734322e+04 5.428267e+04 5.399531e+04 7.136322e+04 5.789242e+04 5.853740e+04 8.079113e+04 4.159793e+04 7.011838e+04 7.192795e+04 1.130221e+05 5.349196e+04 4.560016e+04 4.717741e+04 6.532368e+04 4.999271e+04 4.547481e+04 7.266383e+04 6.422725e+04 6.269768e+04 5.593151e+04 8.420532e+04 7.576124e+04 5.965470e+04 9.916514e+04 1.116542e+05 3.140318e+05 1.182624e+05 8.000736e+04 6.052643e+04 7.022638e+04 7.441674e+04 6.110171e+04 1.540063e+05 2.580718e+05 1.541033e+05 1.050703e+05 8.169185e+04 2.063892e+05 2.467523e+05 7.079345e+04 1.668924e+05 7.717753e+04 5.083172e+04 7.284428e+04 7.556615e+04 6.089946e+04 6.185594e+04 4.971136e+04 6.855474e+04 7.339261e+04 7.637116e+04 6.253115e+04 7.022105e+04 6.573320e+04 1.047763e+05 7.408951e+04 6.894183e+04 6.823556e+04 7.757005e+04 7.296335e+04 1.261457e+05 6.686591e+04 7.205243e+04 4.395884e+06 1.160368e+06 1.252589e+05 2.268895e+05 7.159165e+04 1.449507e+05 4.721349e+04 1.818833e+06 4.371780e+05 5.283156e+05 6.035191e+04 3.658632e+05 5.515049e+04 6.657158e+04 1.369955e+05 6.517022e+04 7.683837e+04 7.125861e+04 5.175506e+04 4.166250e+05 4.064282e+05 1.750392e+06 9.330492e+05 1.461326e+05 1.095980e+05 6.692549e+05 4.505939e+05 1.795432e+05 3.568148e+04 3.207900e+05 1.718691e+06 3.864117e+05 4.951330e+04 6.165440e+04 2.088044e+06 9.966603e+05 1.196481e+05 5.759105e+05 2.513111e+05 1.043716e+05 9.225693e+05 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1.440807e+07 1.218983e+07 1.287244e+07 1.314552e+07 1.157825e+07 1.510865e+07 7.068663e+06 1.255497e+07 1.389606e+07 1.224891e+07 1.402306e+07 1.470377e+07 1.623912e+07 1.173319e+07 1.442195e+07 1.275635e+07 7.006519e+06 9.973648e+06 1.264013e+07 1.117840e+07 1.361722e+07 1.096414e+07 1.362989e+07 1.283995e+07 1.100279e+07 1.205892e+07 1.295971e+07 1.431749e+07 1.211488e+07 1.245742e+07 2.062478e+07 1.682956e+07 1.323845e+07 1.370894e+07 1.417467e+07 6.494687e+06 1.283592e+07 1.243716e+07 1.150450e+07 1.052916e+07 1.284490e+07 1.352407e+07 1.350485e+07 1.080778e+07 1.528278e+07 1.271364e+07 1.570185e+07 1.241827e+07 1.355730e+07 1.228278e+07 1.180949e+07 1.605588e+07 1.345038e+07 1.023350e+07 1.050964e+07 1.536665e+07 1.141406e+07 1.217380e+07 1.392625e+07 1.218678e+07 1.414743e+07 1.232504e+07 1.199685e+07 1.501602e+07 1.314832e+07 1.409221e+07 1.485125e+07 1.291590e+07 1.288515e+07 1.390470e+07 1.604509e+07 9.846143e+06 1.424241e+07 1.348826e+07 C8 H8 N2 O12 P2 S5_10.222 5.461487e+06 4.757999e+06 4.821915e+06 4.752199e+06 3.132476e+04 3.947099e+06 4.507078e+06 5.184367e+06 34337.60 4.517979e+06 4.980867e+06 4.802729e+06 29464.15 4.303948e+06 4.484430e+06 4.941475e+06 3.587405e+04 4.385662e+06 4.325904e+06 4.904945e+06 1.814612e+04 4.065709e+06 4.755647e+06 5.588611e+06 5870.493 4.527249e+06 4.317926e+06 4.457007e+06 7.532818e+03 4.488854e+06 4.528646e+06 5.180028e+06 26599.50 4.708909e+06 4.648797e+06 4.000940e+06 1.896595e+04 4.594202e+06 4.856095e+06 4.741996e+06 2.704979e+04 4.598328e+06 4.777500e+06 4.939500e+06 2.762094e+04 4.463137e+06 4.149932e+06 4.928885e+06 4.198536e+06 5.103396e+06 4.440122e+06 6.923995e+06 4.795787e+06 5.029611e+06 5.828908e+06 5.846686e+06 4.739404e+06 7.091300e+06 7.464726e+06 6.817094e+06 6.346725e+06 5.929487e+06 6.336161e+06 6.377528e+06 2.837187e+06 5.006436e+06 4.068506e+06 3.989678e+06 6.623510e+06 4.363059e+06 3.887815e+06 5.079082e+06 4.596387e+06 4.719664e+06 4.671710e+06 4.791983e+06 5.530408e+06 6.056411e+06 7.453181e+06 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4.528384e+06 5.530039e+06 4.483493e+06 5.053948e+06 4.181149e+06 4.235007e+06 5.722473e+06 5.055314e+06 3.655292e+06 3.350648e+06 5.919870e+06 4.082265e+06 4.543544e+06 5.134825e+06 4.397826e+06 5.341185e+06 4.340678e+06 3.900172e+06 5.321625e+06 4.666677e+06 5.169131e+06 5.338622e+06 5.157964e+06 4.576399e+06 4.735861e+06 5.708797e+06 3.366145e+06 4.862920e+06 4.710960e+06 C10 H4 N6 O3_10.222 4.314883e+06 4.027534e+06 4.409760e+06 4.613264e+06 3.149441e+04 3.991218e+06 4.611288e+06 4.113172e+06 42178.39 4.318915e+06 4.302790e+06 4.833661e+06 34998.77 3.832750e+06 4.350755e+06 4.344561e+06 4.489536e+04 4.242005e+06 4.270884e+06 4.523632e+06 2.568934e+04 3.863763e+06 4.440915e+06 4.867131e+06 20360.609 3.716838e+06 4.503723e+06 4.382057e+06 1.292029e+04 3.651133e+06 4.765655e+06 5.046174e+06 47936.34 3.591687e+06 4.558269e+06 3.991054e+06 3.669862e+04 4.086054e+06 4.549988e+06 4.445045e+06 5.568819e+04 3.815743e+06 4.681660e+06 4.635543e+06 5.820518e+04 3.973137e+06 4.029977e+06 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4.076207e+06 4.701378e+06 3.758447e+06 3.012709e+06 3.693896e+06 4.788894e+06 4.304912e+06 4.955516e+06 4.059285e+06 5.074971e+06 4.718218e+06 4.109865e+06 4.790782e+06 4.488021e+06 4.856970e+06 3.686332e+06 4.583275e+06 5.125783e+06 5.377046e+06 4.381757e+06 4.407799e+06 4.797676e+06 3.419249e+06 4.584737e+06 3.970793e+06 4.631466e+06 4.069877e+06 4.169256e+06 4.840769e+06 4.667199e+06 4.106784e+06 5.231560e+06 4.386097e+06 5.342429e+06 4.430427e+06 4.793318e+06 4.171204e+06 3.708721e+06 5.218717e+06 5.060892e+06 4.104961e+06 4.102589e+06 5.255064e+06 3.921451e+06 4.491539e+06 4.729809e+06 3.877297e+06 4.596633e+06 3.468612e+06 4.313963e+06 4.829255e+06 4.359534e+06 4.664530e+06 4.952083e+06 4.333216e+06 3.818548e+06 4.969538e+06 5.259991e+06 4.135510e+06 4.929707e+06 4.552366e+06 C14 H2 Cl N2 O16 P3 S_10.223 4.805473e+06 4.038704e+06 4.208532e+06 4.242698e+06 3.035944e+04 3.446830e+06 4.076328e+06 4.213882e+06 33522.63 3.966324e+06 4.196023e+06 4.371103e+06 28307.53 3.852930e+06 3.975557e+06 4.212165e+06 3.451733e+04 3.789398e+06 3.589448e+06 4.139789e+06 1.748680e+04 3.855831e+06 4.263248e+06 4.812064e+06 5756.829 3.766817e+06 3.749364e+06 3.820925e+06 7.487082e+03 4.032892e+06 4.201703e+06 4.300310e+06 27229.78 3.950328e+06 4.182732e+06 3.500412e+06 1.975008e+04 4.109676e+06 3.808889e+06 4.307010e+06 2.780355e+04 4.007326e+06 4.284949e+06 4.291476e+06 2.792478e+04 3.808730e+06 3.708457e+06 4.217720e+06 3.574798e+06 3.951135e+06 3.738096e+06 5.965481e+06 4.620933e+06 4.536797e+06 4.894387e+06 5.243584e+06 3.917852e+06 6.202016e+06 6.633869e+06 5.505674e+06 5.475577e+06 4.867061e+06 5.340356e+06 5.641722e+06 2.644394e+06 4.359347e+06 3.497712e+06 3.483550e+06 5.495341e+06 3.636035e+06 3.515196e+06 4.203342e+06 4.207261e+06 3.911712e+06 4.088504e+06 4.330833e+06 4.441677e+06 4.680037e+06 6.310438e+06 5.052041e+06 3.168469e+06 4.118074e+06 4.575327e+06 4.790671e+06 4.368535e+06 4.373359e+06 4.117868e+06 3.928790e+06 4.344896e+06 3.390049e+06 4.095596e+06 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3.814236e+06 4.655074e+06 3.853892e+06 4.525554e+06 3.718930e+06 3.132410e+06 4.485536e+06 4.143518e+06 4.430106e+06 4.608927e+06 4.116465e+06 4.154574e+06 4.362077e+06 4.865881e+06 3.234909e+06 4.312095e+06 4.075534e+06 257.89206_10.223 4.777889e+07 4.183877e+07 4.164250e+07 4.182510e+07 3.628309e+04 3.446064e+07 4.159842e+07 4.289300e+07 40405.87 3.902659e+07 4.182173e+07 4.340286e+07 33962.88 3.783374e+07 4.037879e+07 4.209399e+07 4.070974e+04 3.844786e+07 3.931302e+07 4.129210e+07 2.102510e+04 3.734649e+07 4.156631e+07 4.728285e+07 8294.876 3.778641e+07 3.985297e+07 3.833341e+07 1.073492e+04 4.057060e+07 4.004104e+07 4.355429e+07 32491.16 4.064246e+07 4.108232e+07 3.540631e+07 2.303826e+04 4.061785e+07 4.118144e+07 4.235328e+07 3.271951e+04 3.977951e+07 4.392867e+07 4.098662e+07 3.362328e+04 3.849719e+07 3.670739e+07 4.328710e+07 3.766068e+07 4.212835e+07 3.982853e+07 5.830365e+07 4.336766e+07 4.474697e+07 4.937034e+07 5.176043e+07 4.319122e+07 5.947846e+07 6.000891e+07 5.306579e+07 5.394651e+07 5.069155e+07 5.079212e+07 5.303273e+07 2.936673e+07 4.429830e+07 3.722673e+07 3.592953e+07 5.248862e+07 3.927769e+07 3.847378e+07 4.336856e+07 4.196340e+07 4.224885e+07 4.093993e+07 4.113853e+07 4.532220e+07 4.843513e+07 5.550040e+07 4.868779e+07 3.682255e+07 4.177946e+07 4.386769e+07 4.658573e+07 4.304925e+07 4.190588e+07 4.271706e+07 3.852998e+07 4.298278e+07 3.560602e+07 4.175187e+07 3.987789e+07 4.597198e+07 4.070880e+07 5.214836e+07 4.245220e+07 4.321497e+07 3.785206e+07 2.640437e+07 4.516543e+07 3.212357e+07 3.627238e+07 3.066415e+07 4.774853e+07 3.567346e+07 4.308105e+07 4.300193e+07 5.058054e+07 4.271525e+07 3.570463e+07 3.432273e+07 3.951053e+07 3.139343e+07 3.417415e+07 4.204119e+07 4.691784e+07 4.589305e+07 3.565291e+07 5.654439e+07 4.602913e+07 3.676901e+07 4.474927e+07 3.649084e+07 4.462907e+07 4.135153e+07 4.341909e+07 4.143326e+07 3.500400e+07 4.342070e+07 3.331917e+07 4.878433e+07 4.996832e+07 3.985753e+07 3.405621e+07 3.672401e+07 3.256706e+07 3.604469e+07 4.315447e+07 4.211285e+07 4.001725e+07 3.923584e+07 4.257142e+07 4.240310e+07 3.673624e+07 3.656199e+07 4.015469e+07 3.291942e+07 4.375991e+07 4.440036e+07 4.184739e+07 3.724776e+07 4.666084e+07 4.383553e+07 4.301949e+07 4.821322e+07 5.268169e+07 4.426180e+07 4.297547e+07 4.255777e+07 3.748552e+07 4.560848e+07 4.717006e+07 4.206418e+07 4.440287e+07 4.279377e+07 3.382396e+07 3.940066e+07 4.000725e+07 3.856045e+07 4.508853e+07 4.319452e+07 4.562993e+07 4.217928e+07 4.180443e+07 4.803424e+07 3.825157e+07 5.166559e+07 4.425837e+07 4.392894e+07 3.841919e+07 2.677747e+07 4.302052e+07 4.940371e+07 3.467610e+07 3.482156e+07 3.510310e+07 4.055902e+07 3.763742e+07 4.385349e+07 3.872044e+07 4.078180e+07 3.992104e+07 3.568547e+07 4.565472e+07 2.498931e+07 3.708410e+07 4.348043e+07 3.872826e+07 4.200249e+07 4.458891e+07 5.021191e+07 3.724816e+07 4.250916e+07 4.014233e+07 2.296753e+07 3.213500e+07 3.962624e+07 3.662806e+07 4.222552e+07 3.473193e+07 4.162208e+07 4.027230e+07 3.551061e+07 3.910299e+07 4.017527e+07 4.469578e+07 3.901421e+07 3.936826e+07 5.985725e+07 5.005839e+07 4.116814e+07 4.298759e+07 4.292867e+07 2.575366e+07 4.059764e+07 3.880933e+07 3.660453e+07 3.464600e+07 4.056616e+07 4.361818e+07 4.188202e+07 3.612508e+07 4.785842e+07 3.929887e+07 4.665550e+07 3.998510e+07 4.342396e+07 3.850378e+07 3.708829e+07 4.891212e+07 4.329963e+07 3.402572e+07 3.387349e+07 4.991731e+07 3.623489e+07 3.935411e+07 4.475006e+07 3.885936e+07 4.405209e+07 3.856308e+07 3.795803e+07 4.626038e+07 4.032387e+07 4.407212e+07 4.654435e+07 4.038047e+07 4.187399e+07 4.170605e+07 4.736190e+07 3.241712e+07 4.511852e+07 4.273589e+07 C17 H2 N2 O18 S5_10.223 3.816862e+06 3.703914e+06 3.612344e+06 3.624874e+06 2.917495e+04 2.956275e+06 3.616888e+06 3.831802e+06 32698.83 3.538652e+06 3.543563e+06 3.666452e+06 28080.03 3.421556e+06 3.428361e+06 3.639887e+06 3.392743e+04 3.502098e+06 3.341517e+06 3.616898e+06 1.741822e+04 3.293354e+06 3.558522e+06 4.263888e+06 5768.134 3.307728e+06 3.365352e+06 3.302536e+06 7.441603e+03 3.575723e+06 3.695759e+06 3.792875e+06 26956.99 3.365136e+06 3.666349e+06 3.132148e+06 1.931938e+04 3.509121e+06 3.447646e+06 3.806721e+06 2.721738e+04 3.516685e+06 3.688413e+06 3.617621e+06 2.766136e+04 3.489773e+06 3.230399e+06 3.704570e+06 3.461703e+06 3.575753e+06 3.752318e+06 4.881769e+06 4.167071e+06 3.878700e+06 4.425044e+06 4.602945e+06 3.579460e+06 5.468963e+06 5.633997e+06 4.910508e+06 4.940419e+06 4.470209e+06 4.798243e+06 5.051671e+06 2.469567e+06 3.910644e+06 3.353847e+06 3.005707e+06 4.954272e+06 3.329148e+06 3.150596e+06 4.229171e+06 3.683254e+06 3.552428e+06 3.765935e+06 3.547581e+06 3.937953e+06 4.154890e+06 5.026755e+06 4.056546e+06 3.079206e+06 3.769943e+06 4.013247e+06 4.218037e+06 3.651724e+06 3.735756e+06 3.549811e+06 3.391730e+06 3.921678e+06 3.115518e+06 3.872902e+06 3.374447e+06 2.884329e+06 3.494280e+06 4.220339e+06 3.779471e+06 4.198766e+06 3.401897e+06 2.067701e+06 4.055709e+06 2.346261e+06 3.286617e+06 2.710855e+06 4.245611e+06 3.216112e+06 3.638285e+06 4.107674e+06 4.646146e+06 3.873279e+06 3.164873e+06 2.642294e+06 3.397227e+06 2.685533e+06 2.931986e+06 4.036633e+06 4.297725e+06 4.334222e+06 2.898526e+06 5.003552e+06 3.844547e+06 3.110450e+06 3.926928e+06 3.119254e+06 4.227220e+06 3.611832e+06 3.959444e+06 3.723260e+06 2.909093e+06 3.987552e+06 2.878936e+06 4.428413e+06 4.484751e+06 3.691278e+06 2.817133e+06 3.211869e+06 2.787929e+06 2.804382e+06 3.625668e+06 3.705618e+06 3.340593e+06 3.390749e+06 3.828620e+06 3.841271e+06 3.160753e+06 3.143886e+06 3.534983e+06 2.746569e+06 3.970485e+06 3.880112e+06 3.491669e+06 3.432431e+06 4.254978e+06 4.000224e+06 3.654957e+06 4.365026e+06 4.572175e+06 3.970765e+06 3.843284e+06 3.701327e+06 3.119947e+06 4.050288e+06 4.131382e+06 3.992144e+06 4.135784e+06 3.828993e+06 2.739349e+06 3.434311e+06 3.388238e+06 3.419708e+06 4.052385e+06 3.897908e+06 3.916608e+06 3.854435e+06 3.620720e+06 4.183292e+06 3.339037e+06 4.527415e+06 3.919795e+06 3.885299e+06 3.228334e+06 2.176960e+06 3.780656e+06 4.412789e+06 3.026104e+06 2.953481e+06 2.976594e+06 3.667935e+06 3.180985e+06 3.822143e+06 3.368294e+06 3.359496e+06 3.314515e+06 3.016623e+06 4.454813e+06 1.815155e+06 3.282984e+06 3.860970e+06 3.242266e+06 3.633935e+06 3.870428e+06 4.460765e+06 3.118730e+06 3.858445e+06 3.402161e+06 1.807273e+06 2.639185e+06 3.550920e+06 3.186498e+06 3.847215e+06 3.101951e+06 3.824288e+06 3.435196e+06 3.267956e+06 3.630863e+06 3.523591e+06 4.207447e+06 3.094357e+06 3.255907e+06 5.362798e+06 4.488430e+06 3.646923e+06 3.996911e+06 3.842191e+06 2.107815e+06 3.393838e+06 3.420497e+06 3.268925e+06 2.970678e+06 3.492467e+06 4.082566e+06 3.653048e+06 3.150602e+06 4.334506e+06 3.589620e+06 4.209565e+06 3.584522e+06 4.008746e+06 3.508845e+06 3.266463e+06 4.399877e+06 3.703157e+06 2.969890e+06 2.875469e+06 4.574417e+06 3.160759e+06 3.531868e+06 3.799083e+06 3.607772e+06 3.862712e+06 3.531727e+06 3.141714e+06 4.074659e+06 3.648879e+06 3.817081e+06 4.460498e+06 3.571258e+06 3.703002e+06 3.787987e+06 4.370532e+06 3.002510e+06 3.605838e+06 3.650828e+06 78.98236_10.224 5.265037e+06 4.702997e+06 4.850820e+06 3.969687e+06 3.477939e+04 3.788897e+06 4.572456e+06 4.516344e+06 42137.83 4.269989e+06 4.875513e+06 4.580356e+06 33495.70 4.113982e+06 4.419532e+06 4.468381e+06 4.281073e+04 4.258586e+06 4.371762e+06 4.179483e+06 2.392901e+04 4.444572e+06 4.394003e+06 4.682421e+06 10933.105 4.199386e+06 4.626268e+06 4.595997e+06 1.088825e+04 4.186309e+06 4.424085e+06 4.292593e+06 40250.49 4.393166e+06 4.732965e+06 3.835399e+06 2.869854e+04 4.281265e+06 4.817856e+06 4.827407e+06 4.211282e+04 4.119346e+06 4.312952e+06 4.644527e+06 4.470712e+04 4.313917e+06 4.004196e+06 4.680414e+06 4.086549e+06 5.029019e+06 4.504140e+06 6.221896e+06 5.113469e+06 5.660654e+06 5.363763e+06 5.285079e+06 4.987837e+06 5.748902e+06 5.705997e+06 5.970275e+06 5.416349e+06 5.181076e+06 5.355797e+06 5.486323e+06 3.946920e+06 4.880752e+06 4.608116e+06 4.228359e+06 5.466926e+06 4.708589e+06 4.790029e+06 4.699650e+06 4.490326e+06 5.030885e+06 4.741976e+06 4.883936e+06 4.885354e+06 5.728959e+06 6.117957e+06 5.183372e+06 3.858921e+06 4.493367e+06 4.681429e+06 5.238602e+06 4.574615e+06 4.346951e+06 4.746949e+06 4.405440e+06 5.011881e+06 4.791354e+06 4.717105e+06 4.050246e+06 5.281037e+06 4.443790e+06 5.565395e+06 3.778732e+06 4.978403e+06 4.346196e+06 3.340741e+06 5.320129e+06 4.474656e+06 4.437410e+06 3.851132e+06 4.992566e+06 4.358605e+06 4.884354e+06 4.409974e+06 5.444728e+06 5.302470e+06 4.484763e+06 4.297542e+06 4.536484e+06 3.990249e+06 3.806210e+06 4.361519e+06 4.973698e+06 5.094645e+06 4.262763e+06 5.828156e+06 5.440164e+06 4.231404e+06 4.087456e+06 4.028794e+06 4.824667e+06 4.395871e+06 4.393111e+06 3.905279e+06 3.734440e+06 4.193454e+06 3.854876e+06 5.048031e+06 5.163816e+06 4.335125e+06 4.008013e+06 4.248496e+06 3.771371e+06 3.931669e+06 5.261660e+06 4.579833e+06 5.292879e+06 4.175336e+06 4.908017e+06 4.794832e+06 4.397684e+06 4.494539e+06 4.543108e+06 3.722343e+06 4.669816e+06 4.957983e+06 5.134816e+06 4.281431e+06 5.462929e+06 4.980621e+06 4.981683e+06 5.236272e+06 5.337037e+06 4.873762e+06 3.786185e+06 5.018169e+06 4.940476e+06 4.898223e+06 5.502786e+06 4.536071e+06 4.802860e+06 4.713788e+06 4.204971e+06 4.308751e+06 4.135506e+06 4.207719e+06 4.788404e+06 4.891879e+06 5.120020e+06 4.958970e+06 4.782259e+06 5.104455e+06 4.345965e+06 5.361935e+06 4.707431e+06 4.740056e+06 4.148525e+06 3.802744e+06 4.706677e+06 5.424350e+06 3.876353e+06 4.139385e+06 3.787047e+06 3.933097e+06 4.239354e+06 4.742857e+06 4.417110e+06 4.690373e+06 4.658132e+06 4.661637e+06 5.168390e+06 2.801210e+06 4.346241e+06 4.581631e+06 4.015476e+06 4.810186e+06 4.735422e+06 5.419606e+06 4.776526e+06 5.040751e+06 4.531505e+06 3.398566e+06 4.076430e+06 4.959131e+06 4.290341e+06 4.888657e+06 4.074489e+06 4.816934e+06 4.541782e+06 4.046198e+06 4.351821e+06 4.403311e+06 5.297837e+06 4.229978e+06 4.246660e+06 6.371589e+06 5.681368e+06 4.810347e+06 4.786263e+06 5.104781e+06 3.915364e+06 4.688907e+06 4.635841e+06 4.228933e+06 3.752407e+06 4.464745e+06 4.941543e+06 5.064623e+06 3.617289e+06 5.305922e+06 4.378637e+06 5.607990e+06 4.335654e+06 4.595496e+06 4.571179e+06 3.980163e+06 5.289931e+06 5.003260e+06 3.808634e+06 4.089388e+06 5.384818e+06 4.473641e+06 4.320417e+06 5.247674e+06 3.648956e+06 4.758113e+06 4.679049e+06 4.304117e+06 4.804706e+06 4.511722e+06 4.836454e+06 5.280908e+06 4.259872e+06 5.027447e+06 4.722086e+06 5.148889e+06 3.749619e+06 5.270448e+06 4.637014e+06 C6 H O10 P3_10.224 2.242013e+07 1.968167e+07 1.959380e+07 1.945280e+07 3.546830e+04 1.600063e+07 1.911535e+07 1.996539e+07 39078.97 1.868365e+07 1.979668e+07 2.001996e+07 33001.25 1.804235e+07 1.881774e+07 1.975707e+07 4.025271e+04 1.777871e+07 1.816670e+07 1.888518e+07 2.093169e+04 1.793801e+07 1.968524e+07 2.243972e+07 6995.505 1.710477e+07 1.849239e+07 1.852636e+07 2.069188e+04 1.862952e+07 1.880845e+07 2.075516e+07 32631.72 1.889112e+07 1.906804e+07 1.653921e+07 2.360996e+04 1.898459e+07 1.902830e+07 2.029056e+07 3.366301e+04 1.848245e+07 1.952383e+07 1.998639e+07 3.409772e+04 1.827206e+07 1.707160e+07 2.014489e+07 1.795418e+07 1.899937e+07 1.770937e+07 2.683613e+07 2.102700e+07 2.080339e+07 2.335938e+07 2.345490e+07 2.007061e+07 2.760731e+07 2.709005e+07 2.518019e+07 2.493770e+07 2.399240e+07 2.368379e+07 2.493524e+07 1.488317e+07 2.028383e+07 1.818915e+07 1.723656e+07 2.360337e+07 1.812224e+07 1.844077e+07 2.123041e+07 1.956705e+07 1.979821e+07 1.965624e+07 1.925678e+07 2.093396e+07 2.269032e+07 2.548165e+07 2.236279e+07 1.674254e+07 1.991291e+07 2.062685e+07 2.215615e+07 1.992483e+07 1.904267e+07 1.933326e+07 1.803893e+07 2.001289e+07 1.671036e+07 2.020181e+07 1.810467e+07 2.121960e+07 1.920680e+07 2.291705e+07 1.995852e+07 2.067272e+07 1.790738e+07 1.264245e+07 2.142700e+07 1.494903e+07 1.664655e+07 1.459789e+07 2.103776e+07 1.729833e+07 1.950716e+07 1.947087e+07 2.274523e+07 1.977538e+07 1.659593e+07 1.656354e+07 1.909472e+07 1.484523e+07 1.647052e+07 1.914366e+07 2.138159e+07 2.121754e+07 1.660708e+07 2.530895e+07 2.131824e+07 1.736906e+07 2.045692e+07 1.680773e+07 2.078971e+07 1.873574e+07 2.050492e+07 2.025697e+07 1.600565e+07 2.051510e+07 1.551372e+07 2.211869e+07 2.294561e+07 1.873085e+07 1.566387e+07 1.753416e+07 1.530931e+07 1.608277e+07 1.969465e+07 1.949558e+07 1.806508e+07 1.818470e+07 1.996754e+07 1.990865e+07 1.691470e+07 1.705963e+07 1.849142e+07 1.480031e+07 2.020028e+07 2.023394e+07 2.010622e+07 1.803816e+07 2.155669e+07 2.035603e+07 1.992289e+07 2.229586e+07 2.439069e+07 2.075183e+07 2.043120e+07 1.911663e+07 1.773397e+07 2.086625e+07 2.151775e+07 1.935012e+07 2.020317e+07 2.041694e+07 1.537508e+07 1.902305e+07 1.924577e+07 1.837967e+07 2.105199e+07 2.035421e+07 2.127350e+07 2.015366e+07 1.991158e+07 2.089744e+07 1.778129e+07 2.372161e+07 2.060744e+07 1.982878e+07 1.837746e+07 1.353313e+07 1.899844e+07 2.230557e+07 1.632328e+07 1.706842e+07 1.693068e+07 1.969913e+07 1.674836e+07 1.999137e+07 1.854539e+07 1.856635e+07 1.869506e+07 1.699556e+07 2.111526e+07 1.235243e+07 1.741728e+07 1.946956e+07 1.789887e+07 1.938077e+07 2.052149e+07 2.230194e+07 1.732221e+07 2.018107e+07 1.870315e+07 1.121288e+07 1.504085e+07 1.881672e+07 1.762971e+07 1.935089e+07 1.729113e+07 2.028211e+07 1.900028e+07 1.665142e+07 1.852625e+07 1.779721e+07 2.117876e+07 1.843514e+07 1.820940e+07 2.684603e+07 2.295856e+07 1.914411e+07 1.974881e+07 1.963029e+07 1.182703e+07 1.864222e+07 1.803628e+07 1.812510e+07 1.591219e+07 1.913822e+07 2.081441e+07 1.934632e+07 1.722918e+07 2.154056e+07 1.789249e+07 2.145812e+07 1.899516e+07 2.077437e+07 1.864778e+07 1.764926e+07 2.275157e+07 2.061613e+07 1.586679e+07 1.607975e+07 2.311102e+07 1.715881e+07 1.810091e+07 2.083018e+07 1.840672e+07 2.059385e+07 1.870449e+07 1.752019e+07 2.117465e+07 1.895348e+07 2.061853e+07 2.268756e+07 1.937666e+07 1.872192e+07 1.915963e+07 2.229705e+07 1.593633e+07 2.020412e+07 1.993421e+07 C25 H5 O14 P3 S4_10.224 4.150850e+06 3.748705e+06 3.646498e+06 3.183235e+06 2.981117e+04 3.049664e+06 3.206441e+06 3.771669e+06 32237.27 3.411806e+06 3.439534e+06 3.736878e+06 26591.56 3.296273e+06 3.290003e+06 3.695696e+06 3.209729e+04 3.249321e+06 3.239998e+06 3.642205e+06 1.694236e+04 3.078963e+06 3.483499e+06 3.843592e+06 5707.052 3.231684e+06 3.513818e+06 3.246442e+06 7.326629e+03 3.415714e+06 3.352935e+06 3.835095e+06 26709.59 3.478575e+06 3.378278e+06 2.920487e+06 1.954929e+04 3.474909e+06 3.427205e+06 3.662322e+06 2.755541e+04 3.330171e+06 3.529420e+06 3.561881e+06 2.741570e+04 3.432138e+06 3.186860e+06 3.533621e+06 3.281372e+06 3.328405e+06 3.120292e+06 4.830582e+06 3.801153e+06 3.641240e+06 4.009987e+06 4.357643e+06 3.393760e+06 4.599816e+06 5.251901e+06 3.925869e+06 4.511719e+06 4.593474e+06 4.376393e+06 4.850579e+06 2.549050e+06 3.238275e+06 3.130767e+06 3.010233e+06 4.347806e+06 3.169177e+06 3.321941e+06 3.767526e+06 3.806958e+06 3.518118e+06 3.518632e+06 3.515341e+06 3.864233e+06 3.167117e+06 4.013517e+06 3.991864e+06 2.966774e+06 3.341392e+06 3.641199e+06 3.870912e+06 3.483900e+06 3.425285e+06 3.627366e+06 3.121950e+06 3.753400e+06 3.041721e+06 3.560953e+06 3.491818e+06 3.758890e+06 3.234916e+06 3.538845e+06 3.739725e+06 3.922962e+06 3.600109e+06 1.991821e+06 3.721529e+06 2.440970e+06 3.164886e+06 2.693164e+06 3.984326e+06 3.151476e+06 3.559801e+06 3.872094e+06 4.037818e+06 3.327002e+06 3.061157e+06 2.779545e+06 3.275687e+06 2.642820e+06 3.118006e+06 3.457737e+06 3.709153e+06 3.968214e+06 3.266007e+06 4.540217e+06 3.949018e+06 2.875373e+06 3.734762e+06 2.619498e+06 4.129353e+06 3.555585e+06 3.920126e+06 3.520958e+06 2.501881e+06 3.623669e+06 2.615074e+06 4.080504e+06 3.674337e+06 3.072269e+06 2.738771e+06 3.072073e+06 2.534066e+06 2.849745e+06 3.495805e+06 3.510634e+06 3.106881e+06 3.560178e+06 3.435569e+06 3.605515e+06 3.045327e+06 3.017364e+06 3.405699e+06 2.500310e+06 3.575133e+06 3.577212e+06 3.471513e+06 3.291527e+06 3.756385e+06 3.649344e+06 3.276617e+06 4.276065e+06 4.519643e+06 3.713625e+06 3.607031e+06 3.466804e+06 2.942191e+06 3.850235e+06 3.654539e+06 3.605207e+06 3.731495e+06 3.718521e+06 1.987889e+06 3.299623e+06 3.563772e+06 3.198173e+06 3.811115e+06 3.217742e+06 3.810295e+06 3.785553e+06 2.960838e+06 3.914123e+06 3.111036e+06 4.201119e+06 3.823527e+06 3.413969e+06 3.032746e+06 2.148258e+06 3.403281e+06 3.786423e+06 2.868446e+06 2.992771e+06 2.963910e+06 3.627767e+06 3.005631e+06 3.894974e+06 3.156856e+06 3.495602e+06 3.181155e+06 2.962273e+06 3.837380e+06 1.665372e+06 3.086002e+06 3.681498e+06 3.325868e+06 2.636497e+06 3.548620e+06 3.800790e+06 3.181694e+06 3.784409e+06 3.463983e+06 1.832803e+06 2.655331e+06 3.331130e+06 3.243575e+06 3.674603e+06 3.071966e+06 3.851834e+06 3.381942e+06 2.889596e+06 3.052027e+06 3.088011e+06 3.948358e+06 3.233666e+06 3.318231e+06 4.545757e+06 3.966483e+06 3.462168e+06 3.515571e+06 3.613294e+06 1.949893e+06 3.342532e+06 2.611608e+06 2.994602e+06 2.587809e+06 3.190538e+06 3.972797e+06 3.181543e+06 2.964909e+06 4.268630e+06 2.966955e+06 3.793429e+06 3.447363e+06 3.924987e+06 3.351781e+06 3.284962e+06 4.216772e+06 3.360783e+06 2.896963e+06 2.688409e+06 4.107134e+06 2.937861e+06 3.515774e+06 3.806600e+06 2.975469e+06 3.769132e+06 3.095731e+06 2.835555e+06 3.413991e+06 2.803333e+06 3.648427e+06 4.213208e+06 3.208084e+06 3.660475e+06 3.073281e+06 3.788840e+06 2.650882e+06 3.505351e+06 3.387388e+06 C56 H107 N O3 P2_10.225 1.289097e+06 1.009401e+06 1.073785e+06 1.137404e+06 1.549581e+04 1.029049e+06 1.071860e+06 1.176809e+06 18480.52 1.033401e+06 9.863516e+05 1.199367e+06 16560.57 1.040403e+06 1.130082e+06 1.080941e+06 2.168837e+04 1.011702e+06 9.241241e+05 1.111890e+06 1.169973e+04 9.943703e+05 1.074617e+06 1.178691e+06 3791.032 1.117446e+06 1.147564e+06 9.087234e+05 4.932435e+03 1.073557e+06 1.091597e+06 1.168773e+06 18102.12 9.539573e+05 1.219048e+06 8.881149e+05 1.320571e+04 1.093318e+06 1.064026e+06 1.075271e+06 1.934963e+04 1.093014e+06 1.160195e+06 1.083281e+06 2.010065e+04 1.020500e+06 9.637263e+05 1.150454e+06 1.166584e+06 8.679129e+05 8.649566e+05 1.274008e+06 9.992722e+05 8.574810e+05 1.198940e+06 1.436039e+06 1.276860e+06 1.321432e+06 1.362067e+06 1.109294e+06 1.204258e+06 1.148946e+06 1.359251e+06 1.244661e+06 1.284105e+06 1.162775e+06 1.247502e+06 1.194825e+06 1.131135e+06 1.073756e+06 1.423884e+06 1.379029e+06 1.240213e+06 1.314055e+06 1.293407e+06 1.123246e+06 1.135474e+06 1.073017e+06 1.150030e+06 1.036703e+06 9.945748e+05 1.024503e+06 9.469129e+05 1.219199e+06 1.011257e+06 1.080222e+06 9.472258e+05 8.444438e+05 9.669111e+05 9.671855e+05 1.182156e+06 9.818571e+05 1.071837e+06 9.679855e+05 9.658306e+05 1.339040e+06 1.059729e+06 1.076326e+06 1.091753e+06 9.692132e+05 9.256710e+05 1.069348e+06 1.130352e+06 9.826902e+05 1.157727e+06 1.042152e+06 1.110161e+06 1.062015e+06 8.032544e+05 8.762790e+05 1.099972e+06 1.103224e+06 9.674546e+05 1.413333e+06 9.951287e+05 1.190995e+06 1.159171e+06 1.178564e+06 1.056123e+06 1.184920e+06 7.875486e+04 9.943189e+05 9.449071e+05 1.055832e+06 1.257175e+06 1.027201e+06 1.231059e+06 5.702329e+04 1.111059e+06 1.223861e+06 1.117986e+06 8.995634e+05 1.004199e+06 9.887255e+05 1.031395e+06 1.025504e+06 9.843317e+05 1.097409e+06 3.070616e+04 9.635075e+05 1.128462e+06 1.264957e+06 1.085880e+06 9.547306e+05 1.109538e+06 1.083922e+06 1.104912e+06 1.154095e+06 9.713100e+05 1.181617e+06 1.091707e+06 1.075598e+06 2.290487e+05 1.111437e+06 1.238804e+06 1.153557e+06 1.179687e+06 1.062686e+06 1.075806e+06 1.083170e+06 1.074422e+06 1.093793e+06 1.194416e+06 1.009645e+06 1.156514e+06 1.279873e+06 1.072954e+06 9.883509e+05 1.056365e+06 1.269522e+06 1.185332e+06 1.207269e+06 1.209839e+06 1.149966e+06 9.927967e+05 1.016581e+06 1.017011e+06 1.163782e+06 1.058465e+06 1.255235e+06 1.296325e+06 9.053265e+05 1.096365e+06 1.175128e+06 1.151167e+06 1.134730e+06 1.167000e+06 9.114483e+05 9.435497e+05 9.913756e+05 9.855949e+05 1.065324e+06 1.115503e+06 1.346269e+06 1.120464e+06 8.750111e+05 1.192213e+06 1.344241e+06 9.715194e+05 1.034617e+06 1.036396e+06 1.163068e+06 9.161625e+05 1.138522e+06 6.786999e+05 9.817397e+05 1.094315e+06 1.034269e+06 1.092591e+06 1.033430e+06 1.148254e+06 1.103375e+06 7.766683e+05 1.113653e+06 8.013712e+05 1.178320e+06 1.003509e+06 1.034507e+06 9.948781e+05 1.057596e+06 1.104987e+06 1.040629e+06 1.137931e+06 5.530431e+05 1.209641e+06 1.140284e+06 1.118091e+06 9.602401e+05 1.183256e+06 1.147428e+06 1.207150e+06 1.214245e+06 1.128799e+06 1.099906e+06 1.029248e+06 1.104784e+06 1.018001e+06 1.183417e+06 9.348390e+05 1.138949e+06 1.070463e+06 1.093456e+06 1.058709e+06 1.039480e+06 1.092386e+06 1.076759e+06 1.258025e+06 1.056888e+06 1.137603e+06 1.341255e+06 1.131674e+06 1.046261e+06 1.147682e+06 1.033211e+06 1.066488e+06 1.172062e+06 1.068911e+06 1.115977e+06 1.127619e+06 1.118190e+06 1.083566e+06 1.208248e+06 C5 H5 N2 O9 P3 S2_10.225 2.267850e+07 2.053617e+07 1.934600e+07 1.980794e+07 3.489112e+04 1.667598e+07 1.989299e+07 2.088281e+07 39135.95 1.896164e+07 1.999342e+07 2.032795e+07 33500.93 1.810089e+07 1.969921e+07 2.001569e+07 4.059655e+04 1.823049e+07 1.842365e+07 2.042051e+07 2.090895e+04 1.791627e+07 2.009690e+07 2.214467e+07 7006.813 1.821023e+07 1.920579e+07 1.843436e+07 9.052753e+03 1.916994e+07 1.925501e+07 2.115267e+07 32523.40 1.928963e+07 1.979795e+07 1.722908e+07 2.348069e+04 1.948263e+07 1.939632e+07 2.025630e+07 3.381985e+04 1.902933e+07 2.064533e+07 1.981598e+07 3.430270e+04 1.857298e+07 1.788890e+07 2.055579e+07 1.906717e+07 2.005289e+07 1.869868e+07 2.651385e+07 2.146111e+07 2.055081e+07 2.306742e+07 2.393778e+07 2.033220e+07 2.697471e+07 2.674010e+07 2.462303e+07 2.487268e+07 2.485448e+07 2.441230e+07 2.494958e+07 1.546439e+07 2.009075e+07 1.857379e+07 1.719627e+07 2.354953e+07 1.897245e+07 1.925453e+07 2.189685e+07 2.101731e+07 2.010664e+07 2.011779e+07 1.929782e+07 2.167211e+07 2.287085e+07 2.515662e+07 2.212277e+07 1.774940e+07 1.995643e+07 2.084332e+07 2.192474e+07 1.985487e+07 1.988968e+07 1.983269e+07 1.788284e+07 2.023351e+07 1.693829e+07 1.977598e+07 1.915202e+07 2.098035e+07 1.896133e+07 2.253016e+07 2.021211e+07 2.067663e+07 1.868436e+07 1.402086e+07 2.176744e+07 1.556708e+07 1.737800e+07 1.515448e+07 2.174784e+07 1.769637e+07 1.994488e+07 1.962328e+07 2.331724e+07 1.981623e+07 1.683140e+07 1.700434e+07 1.873405e+07 1.527630e+07 1.735017e+07 1.966937e+07 2.159312e+07 2.167678e+07 1.718371e+07 2.483414e+07 2.164599e+07 1.758996e+07 2.114222e+07 1.751423e+07 2.109692e+07 1.957117e+07 2.046149e+07 2.069010e+07 1.629554e+07 2.011519e+07 1.707139e+07 2.240917e+07 2.255150e+07 1.889958e+07 1.631440e+07 1.766425e+07 1.576840e+07 1.673163e+07 2.047041e+07 2.070680e+07 1.710395e+07 1.877827e+07 2.037333e+07 2.022565e+07 1.773152e+07 1.799285e+07 1.937493e+07 1.639219e+07 2.064558e+07 2.124348e+07 1.958942e+07 1.850501e+07 2.138001e+07 2.028208e+07 1.895169e+07 2.274333e+07 2.384715e+07 2.065463e+07 2.059430e+07 1.993538e+07 1.816693e+07 2.147317e+07 2.235218e+07 2.055952e+07 1.988554e+07 2.071572e+07 1.675575e+07 1.849057e+07 1.961103e+07 1.869302e+07 2.177452e+07 2.105731e+07 2.125971e+07 2.077751e+07 2.019717e+07 2.147310e+07 1.829583e+07 2.304579e+07 2.124419e+07 2.038208e+07 1.910952e+07 1.431500e+07 1.921178e+07 2.280226e+07 1.724411e+07 1.646715e+07 1.750428e+07 1.944419e+07 1.713702e+07 2.054395e+07 1.902835e+07 1.898515e+07 1.877338e+07 1.750318e+07 2.268816e+07 1.323439e+07 1.815085e+07 2.012230e+07 1.898595e+07 1.998744e+07 2.095089e+07 2.240558e+07 1.814795e+07 2.006470e+07 1.978258e+07 1.141599e+07 1.591699e+07 1.916619e+07 1.794862e+07 1.958759e+07 1.807874e+07 2.060962e+07 1.877670e+07 1.632096e+07 1.845261e+07 1.852036e+07 2.151862e+07 1.869530e+07 1.890902e+07 2.635319e+07 2.301629e+07 1.940048e+07 2.019498e+07 1.987061e+07 1.204699e+07 1.939717e+07 1.816120e+07 1.843974e+07 1.669435e+07 1.992400e+07 2.102954e+07 1.989475e+07 1.737083e+07 2.152572e+07 1.867930e+07 2.095880e+07 1.915470e+07 2.093457e+07 1.919451e+07 1.805805e+07 2.176119e+07 2.089154e+07 1.687472e+07 1.664025e+07 2.338163e+07 1.826067e+07 1.888533e+07 2.105832e+07 1.867525e+07 2.076832e+07 1.965634e+07 1.778576e+07 2.144425e+07 1.944141e+07 2.106301e+07 2.249731e+07 1.956950e+07 1.942859e+07 1.972744e+07 2.191045e+07 1.695384e+07 2.024691e+07 2.040040e+07 C22 H4 N4 O17 P2 S5_10.225 3.755025e+06 3.199847e+06 3.196325e+06 3.173678e+06 2.670693e+04 2.595643e+06 3.072628e+06 2.733104e+06 31380.28 3.098308e+06 3.268923e+06 3.414531e+06 26294.12 2.841073e+06 3.035363e+06 3.097034e+06 3.214541e+04 3.076263e+06 2.767191e+06 2.957894e+06 1.696067e+04 2.841048e+06 3.212697e+06 3.587860e+06 5691.420 2.927634e+06 3.060730e+06 2.961484e+06 7.642436e+03 2.684226e+06 3.301219e+06 3.162451e+06 27875.44 2.802841e+06 3.449685e+06 2.439759e+06 1.945933e+04 3.078813e+06 3.231575e+06 3.172615e+06 2.693060e+04 2.756329e+06 3.240462e+06 3.385986e+06 2.695294e+04 2.916306e+06 2.837521e+06 3.072044e+06 2.652570e+06 2.469771e+06 2.737459e+06 3.733033e+06 3.509841e+06 2.337044e+06 3.472258e+06 4.204770e+06 3.283437e+06 4.472109e+06 4.435519e+06 3.309773e+06 4.221062e+06 3.738320e+06 3.239579e+06 2.523674e+06 2.380593e+06 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3.310620e+04 8.164834e+05 8.353607e+05 1.304199e+06 9.168426e+05 9.015354e+05 5.999626e+04 1.030223e+06 8.601088e+05 8.398892e+05 7.976419e+04 2.944752e+04 1.000049e+06 1.336154e+06 9.380872e+05 1.276399e+05 9.560989e+05 1.312726e+06 2.201590e+04 8.608136e+05 1.078764e+06 6.875569e+05 8.731938e+05 9.342055e+05 7.944652e+05 7.536158e+05 8.369187e+05 8.555220e+05 1.356765e+06 7.732372e+05 1.975994e+05 1.316992e+04 8.891729e+05 1.078040e+06 2.076487e+04 9.077406e+05 105.94324_10.228 4.686338e+07 4.360971e+07 4.386833e+07 4.349151e+07 4.428857e+04 3.641477e+07 4.397076e+07 4.558577e+07 54786.66 4.160054e+07 4.328619e+07 4.502997e+07 43584.70 4.000672e+07 4.195259e+07 4.383077e+07 5.377317e+04 4.052009e+07 4.159550e+07 4.315191e+07 2.767172e+04 4.070805e+07 4.328771e+07 4.644660e+07 9589.785 4.136880e+07 4.257134e+07 4.164501e+07 1.214632e+04 4.213275e+07 4.233933e+07 4.509589e+07 44483.67 4.240558e+07 4.264728e+07 3.510297e+07 3.148503e+04 4.350681e+07 4.557686e+07 4.537713e+07 4.459369e+04 4.087576e+07 4.506027e+07 4.411658e+07 4.652244e+04 3.929564e+07 3.922813e+07 4.519015e+07 4.067670e+07 4.466315e+07 4.133638e+07 5.431615e+07 4.622561e+07 4.783749e+07 5.137785e+07 5.171643e+07 4.437883e+07 5.226031e+07 4.990130e+07 5.149124e+07 5.633459e+07 4.844774e+07 5.024067e+07 4.916786e+07 3.878042e+07 4.332400e+07 4.324881e+07 4.035968e+07 4.869305e+07 4.327368e+07 4.777859e+07 4.696827e+07 4.509075e+07 4.436573e+07 4.394831e+07 4.428738e+07 4.678607e+07 4.984045e+07 5.407853e+07 4.776537e+07 3.857516e+07 4.393311e+07 4.535674e+07 4.646116e+07 4.293184e+07 4.202337e+07 4.279172e+07 4.013640e+07 4.327901e+07 3.861525e+07 4.517840e+07 3.956218e+07 4.975403e+07 4.161850e+07 4.775137e+07 4.539869e+07 4.332919e+07 4.099885e+07 3.339365e+07 4.629995e+07 3.787458e+07 3.590693e+07 3.886476e+07 4.555508e+07 4.245574e+07 4.538257e+07 4.124659e+07 4.538118e+07 4.273882e+07 3.858540e+07 4.036653e+07 4.472206e+07 3.480839e+07 3.951247e+07 4.199014e+07 4.513653e+07 4.612178e+07 3.946777e+07 5.023337e+07 4.752893e+07 3.857849e+07 4.363317e+07 3.926215e+07 4.435578e+07 4.261953e+07 4.344729e+07 4.570132e+07 3.725214e+07 4.266231e+07 3.935411e+07 4.707598e+07 4.624096e+07 4.104386e+07 3.921237e+07 3.961055e+07 3.708933e+07 3.972229e+07 4.386011e+07 4.514462e+07 3.975681e+07 3.972532e+07 4.661224e+07 4.383674e+07 4.105959e+07 4.103081e+07 4.483223e+07 3.790783e+07 4.624049e+07 4.467347e+07 4.599179e+07 4.220476e+07 4.852862e+07 4.501871e+07 4.538490e+07 4.670451e+07 4.824522e+07 4.746499e+07 4.616986e+07 4.556397e+07 4.309161e+07 4.747805e+07 5.036565e+07 4.522385e+07 4.356708e+07 4.716128e+07 4.188016e+07 4.300782e+07 4.165928e+07 4.122753e+07 4.614762e+07 4.592627e+07 4.457720e+07 4.494578e+07 4.465460e+07 4.408160e+07 4.001902e+07 5.050756e+07 4.538739e+07 4.455147e+07 4.227495e+07 3.548687e+07 4.167648e+07 8.500985e+06 3.779451e+07 3.903701e+07 4.083431e+07 4.497447e+07 4.127204e+07 4.478579e+07 4.017123e+07 4.037026e+07 4.181210e+07 4.282825e+07 4.567878e+07 3.413896e+07 4.068392e+07 4.359408e+07 4.335860e+07 4.335958e+07 4.336823e+07 4.880502e+07 4.317881e+07 4.478284e+07 4.486652e+07 2.673786e+07 3.782175e+07 4.222872e+07 4.080118e+07 4.258987e+07 3.848055e+07 4.551836e+07 4.244431e+07 3.318076e+07 4.270098e+07 4.011127e+07 4.498394e+07 4.181721e+07 4.069248e+07 5.309740e+07 4.636068e+07 4.264526e+07 4.382238e+07 4.481257e+07 2.748657e+07 4.504326e+07 4.218382e+07 3.921269e+07 3.840635e+07 4.295960e+07 4.514550e+07 4.482517e+07 3.902341e+07 4.875680e+07 4.214022e+07 4.668903e+07 4.246781e+07 4.456565e+07 4.296035e+07 4.253764e+07 4.740605e+07 4.795164e+07 3.830807e+07 4.163522e+07 4.819275e+07 4.039807e+07 4.199622e+07 4.941417e+07 4.225720e+07 4.523117e+07 4.660952e+07 4.196574e+07 4.669231e+07 4.311349e+07 4.446032e+07 5.143583e+07 4.355597e+07 4.061709e+07 4.310980e+07 4.777938e+07 3.783074e+07 4.657652e+07 4.701933e+07 C33 H5 N2 O17 P3 S5_10.228 1.966744e+06 1.772913e+06 1.884127e+06 1.881481e+06 2.383304e+04 1.464355e+06 1.592883e+06 1.845353e+06 28118.93 1.868968e+06 1.543333e+06 1.906695e+06 23725.39 1.749852e+06 1.774619e+06 1.712318e+06 2.884305e+04 1.791025e+06 1.682393e+06 1.754764e+06 1.579290e+04 1.641830e+06 1.996622e+06 1.312968e+06 5541.584 1.940514e+06 1.763771e+06 1.838868e+06 7.131259e+03 1.997914e+06 1.466242e+06 1.611916e+06 26978.40 1.952661e+06 1.681968e+06 1.593764e+06 1.875634e+04 1.848152e+06 1.760337e+06 1.549570e+06 2.564741e+04 1.893975e+06 1.890342e+06 1.863968e+06 2.527522e+04 1.651548e+06 1.609964e+06 1.808905e+06 1.773881e+06 1.527538e+06 1.456638e+06 2.112959e+06 1.862076e+06 1.808161e+06 1.699088e+06 2.182051e+06 2.078280e+06 2.416345e+06 2.581702e+06 1.986666e+06 2.457008e+06 1.881222e+06 2.273179e+06 2.302844e+06 1.576716e+06 2.037714e+06 1.592321e+06 1.860516e+06 1.951599e+06 1.789892e+06 1.748314e+06 2.065289e+06 1.797104e+06 1.837494e+06 1.937503e+06 1.699955e+06 1.882879e+06 1.923816e+06 2.000674e+06 1.723620e+06 1.511186e+06 1.884796e+06 1.843783e+06 1.931914e+06 1.627015e+06 1.944334e+06 1.637183e+06 1.551300e+06 1.788177e+06 1.648599e+06 2.098466e+06 1.772450e+06 1.340728e+06 1.611206e+06 1.846233e+06 1.869243e+06 1.567822e+06 1.623723e+06 1.287906e+06 1.780932e+06 1.397087e+06 1.702926e+06 1.618865e+06 1.966613e+06 1.751505e+06 1.639834e+06 2.210574e+06 2.088499e+06 1.854556e+06 1.812989e+06 1.894108e+06 1.856767e+06 1.388009e+06 1.681667e+06 1.882908e+06 1.933147e+06 7.033156e+04 1.702540e+06 2.361053e+06 1.938864e+06 1.434413e+06 1.703964e+06 1.431771e+06 1.722596e+06 1.863978e+06 2.026137e+06 1.814947e+06 1.649147e+06 1.896543e+06 1.568016e+06 2.181585e+06 1.906662e+06 1.608330e+06 1.585626e+06 1.709782e+06 1.470878e+06 1.475381e+06 1.744054e+06 1.923891e+06 1.323560e+06 1.766731e+06 2.012969e+06 1.979466e+06 1.645313e+06 1.521595e+06 1.890243e+06 1.627149e+06 2.061868e+06 2.023764e+06 1.761112e+06 1.801452e+06 1.778683e+06 1.954837e+06 1.865071e+06 2.008659e+06 2.253837e+06 1.829422e+06 1.936961e+06 1.915768e+06 1.724559e+06 2.073177e+06 2.142971e+06 1.988762e+06 1.842281e+06 1.704150e+06 1.425766e+06 1.776695e+06 1.688656e+06 1.620693e+06 1.807849e+06 1.906157e+06 1.961970e+06 1.848345e+06 2.042765e+06 1.866726e+06 1.540499e+06 2.094148e+06 1.861342e+06 1.795547e+06 1.635103e+06 1.554223e+06 1.683314e+06 1.669727e+06 1.597820e+06 1.721007e+06 1.270130e+06 1.888306e+06 1.561783e+06 1.702853e+06 1.674739e+06 1.877950e+06 1.754062e+06 1.798545e+06 1.947555e+06 1.209962e+06 1.665192e+06 1.717300e+06 2.117444e+06 1.736049e+06 1.907593e+06 2.029687e+06 1.664490e+06 1.763247e+06 1.834248e+06 9.996282e+05 1.459963e+06 1.971445e+06 1.688799e+06 2.015912e+06 1.575239e+06 1.965225e+06 1.457746e+06 1.461806e+06 1.920098e+06 1.416058e+06 1.086277e+06 1.706518e+06 1.406847e+06 2.138727e+06 2.069221e+06 1.635327e+06 1.702725e+06 1.857526e+06 1.014711e+06 1.890723e+06 1.930655e+06 1.750127e+06 1.403153e+06 1.682410e+06 2.038093e+06 1.725415e+06 1.507340e+06 2.261872e+06 1.782702e+06 2.013234e+06 1.900882e+06 1.798211e+06 1.988278e+06 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8.965404e+06 2.030122e+04 8.275976e+06 9.188532e+06 9.768015e+06 6834.004 8.534306e+06 8.505806e+06 8.423835e+06 8.885993e+03 8.797331e+06 8.540063e+06 9.681072e+06 32096.65 8.391700e+06 9.216170e+06 7.826368e+06 2.319341e+04 8.972552e+06 8.509125e+06 8.924948e+06 3.351377e+04 8.728109e+06 9.359706e+06 9.106124e+06 3.382871e+04 8.431333e+06 8.071107e+06 9.225770e+06 8.390799e+06 8.900843e+06 8.299595e+06 1.114007e+07 9.102527e+06 9.058361e+06 9.686527e+06 1.067753e+07 9.030423e+06 1.119615e+07 1.119253e+07 1.058019e+07 1.149208e+07 1.034576e+07 1.068138e+07 1.079137e+07 8.033131e+06 8.941089e+06 8.985970e+06 8.261595e+06 9.459993e+06 8.505151e+06 9.456978e+06 1.016751e+07 9.216219e+06 8.953504e+06 8.828660e+06 8.865177e+06 9.589385e+06 9.652536e+06 1.051351e+07 9.341249e+06 8.009237e+06 9.259516e+06 8.925305e+06 9.658100e+06 8.596730e+06 9.345610e+06 8.346117e+06 8.046614e+06 8.853040e+06 7.938098e+06 9.155137e+06 8.537852e+06 8.867340e+06 8.675081e+06 9.511942e+06 9.587396e+06 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8.249201e+06 7.770277e+06 7.241836e+06 7.091582e+06 7.142944e+06 4.239239e+06 7.146304e+06 7.060711e+06 7.075269e+06 6.327061e+06 6.987325e+06 7.488005e+06 6.986067e+06 6.534069e+06 7.545017e+06 6.787053e+06 7.490650e+06 7.522101e+06 7.525557e+06 6.870287e+06 6.681937e+06 7.608343e+06 6.995115e+06 6.832631e+06 7.130614e+06 8.230145e+06 6.350518e+06 7.070586e+06 8.190235e+06 7.084846e+06 7.446474e+06 7.375700e+06 6.393662e+06 7.539520e+06 7.474330e+06 7.574170e+06 8.058933e+06 7.151532e+06 7.138995e+06 6.986460e+06 7.497407e+06 6.738559e+06 6.663036e+06 7.421418e+06 C3 H N2 O P3_10.23 2.934755e+07 2.744332e+07 2.625767e+07 2.602123e+07 4.402734e+04 2.189799e+07 2.709748e+07 2.709888e+07 55483.72 2.570125e+07 2.579104e+07 2.779413e+07 45011.45 2.405791e+07 2.593885e+07 2.630429e+07 5.461929e+04 2.468532e+07 2.505709e+07 2.562215e+07 2.780666e+04 2.478872e+07 2.709780e+07 2.934846e+07 23052.928 2.437691e+07 2.511120e+07 2.509315e+07 1.470812e+04 2.571653e+07 2.637398e+07 2.700429e+07 44949.65 2.571683e+07 2.556517e+07 2.238517e+07 3.197489e+04 2.611819e+07 2.779011e+07 2.676375e+07 4.561458e+04 2.522454e+07 2.724065e+07 2.593851e+07 4.705792e+04 2.486746e+07 2.385734e+07 2.742396e+07 2.472328e+07 2.780372e+07 2.486206e+07 3.261458e+07 2.897842e+07 2.734760e+07 3.159844e+07 3.156246e+07 2.699953e+07 3.095717e+07 3.075115e+07 3.100199e+07 3.215269e+07 3.112222e+07 2.863051e+07 2.902022e+07 2.461059e+07 2.545389e+07 2.697393e+07 2.634755e+07 2.891410e+07 2.602081e+07 3.053170e+07 2.857026e+07 2.949946e+07 2.670570e+07 2.728622e+07 2.568290e+07 2.964238e+07 2.896527e+07 3.215988e+07 2.803401e+07 2.447366e+07 2.647622e+07 2.573270e+07 2.851264e+07 2.666737e+07 2.578163e+07 2.445833e+07 2.452203e+07 2.554807e+07 2.359402e+07 2.705184e+07 2.439968e+07 2.799762e+07 2.657151e+07 2.850935e+07 2.912723e+07 2.654019e+07 2.456994e+07 2.182207e+07 2.838087e+07 2.282963e+07 2.265896e+07 2.308154e+07 2.851381e+07 2.626666e+07 2.748304e+07 2.678933e+07 2.738632e+07 2.500192e+07 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1.544138e+08 1.766753e+08 1.742783e+08 1.477130e+08 1.582590e+08 1.769830e+08 1.482950e+08 1.550281e+08 1.883337e+08 1.659740e+08 1.783214e+08 1.721967e+08 1.583188e+08 1.751938e+08 1.604332e+08 1.736579e+08 1.826470e+08 1.636628e+08 1.637103e+08 1.568754e+08 1.798459e+08 1.557192e+08 1.750101e+08 1.809601e+08 C21 H5 N6 O15 P3 S4_10.234 5.053362e+06 4.974709e+06 4.860756e+06 5.021354e+06 2.624385e+04 3.846185e+06 4.413949e+06 5.260116e+06 32779.10 4.433083e+06 4.617651e+06 5.335255e+06 25941.16 4.710611e+06 4.677226e+06 4.396613e+06 3.385999e+04 4.500809e+06 4.624890e+06 4.661450e+06 1.817464e+04 4.758574e+06 4.572915e+06 5.096238e+06 6104.512 4.551660e+06 4.574210e+06 4.690937e+06 7.608821e+03 4.854223e+06 4.758896e+06 4.756034e+06 28238.62 4.968956e+06 4.617949e+06 3.880185e+06 2.070095e+04 5.147414e+06 4.509411e+06 4.699191e+06 3.179287e+04 4.665706e+06 5.139445e+06 4.778946e+06 3.262162e+04 4.769680e+06 4.152175e+06 4.966314e+06 4.827911e+06 4.552832e+06 4.092047e+06 6.793783e+06 4.518845e+06 4.802469e+06 5.342933e+06 5.907599e+06 5.706969e+06 6.331769e+06 5.495821e+06 5.436051e+06 5.261740e+06 6.579174e+06 5.737714e+06 6.237481e+06 5.505470e+06 5.661994e+06 4.989267e+06 4.336762e+06 5.318758e+06 5.214634e+06 6.010219e+06 5.675564e+06 6.256333e+06 4.585383e+06 5.035518e+06 5.213754e+06 5.214248e+06 4.760831e+06 5.359114e+06 5.476485e+06 3.842261e+06 4.379335e+06 5.109650e+06 4.643092e+06 4.778127e+06 4.955149e+06 4.315934e+06 3.652299e+06 5.124579e+06 3.813183e+06 5.109468e+06 4.602467e+06 4.224620e+06 4.430283e+06 5.574498e+06 5.632956e+06 5.505281e+06 5.218178e+06 4.575523e+06 4.826475e+06 3.771343e+06 4.255618e+06 4.180230e+06 4.496219e+06 5.049595e+06 4.739591e+06 4.946372e+06 4.402779e+06 3.984745e+06 4.218169e+06 4.818541e+06 4.999450e+06 3.519891e+06 5.011631e+06 4.167971e+06 4.859179e+06 5.176017e+06 4.721181e+06 4.710016e+06 5.719228e+06 4.787940e+06 4.479550e+06 4.151080e+06 5.539735e+06 5.316905e+06 5.518940e+06 4.730609e+06 3.915537e+06 4.668091e+06 4.498680e+06 5.167618e+06 4.917429e+06 5.222172e+06 3.591719e+06 4.684796e+06 4.623104e+06 4.849708e+06 4.462560e+06 4.751980e+06 3.802619e+06 4.881222e+06 4.896631e+06 4.545243e+06 4.582908e+06 4.236088e+06 4.998814e+06 5.063521e+06 5.265764e+06 4.858482e+06 5.144461e+06 4.868896e+06 4.334206e+06 4.452153e+06 4.901103e+06 5.584293e+06 4.904530e+06 5.274544e+06 4.466316e+06 5.089388e+06 4.807243e+06 4.566148e+06 3.489930e+06 4.906555e+06 4.869596e+06 5.443095e+06 4.658406e+06 4.939672e+06 5.878774e+06 5.724626e+06 5.768022e+06 5.224463e+06 5.020856e+06 5.239255e+06 4.990622e+06 5.296212e+06 4.389816e+06 4.429550e+06 4.881543e+06 4.383710e+06 5.374329e+06 5.360193e+06 4.876974e+06 5.362035e+06 4.874491e+06 5.082352e+06 4.673020e+06 5.111705e+06 4.938507e+06 4.940584e+06 4.397167e+06 4.043917e+06 4.384473e+06 4.646826e+06 6.078382e+06 4.252877e+06 3.844077e+06 4.555058e+06 4.561942e+06 4.499406e+06 4.145472e+06 3.893766e+06 4.392212e+06 5.056615e+06 4.111953e+06 3.206393e+06 4.397283e+06 4.368851e+06 3.924382e+06 4.382639e+06 4.176193e+06 5.214211e+06 4.916422e+06 4.194202e+06 4.164274e+06 4.795410e+06 4.397696e+06 4.377562e+06 4.293006e+06 4.687789e+06 4.576279e+06 4.744771e+06 5.030701e+06 4.769410e+06 2.764457e+06 4.433999e+06 4.264756e+06 5.007112e+06 5.122508e+06 5.092261e+06 5.716752e+06 5.049797e+06 4.689181e+06 4.904118e+06 5.250146e+06 4.919624e+06 4.506534e+06 4.915865e+06 4.366847e+06 4.660481e+06 5.542781e+06 4.619072e+06 4.676929e+06 4.225914e+06 5.622903e+06 4.605605e+06 5.496998e+06 5.917315e+06 4.532190e+06 4.826650e+06 5.191763e+06 4.851156e+06 4.693190e+06 5.074513e+06 4.564688e+06 5.704342e+06 4.265130e+06 4.906491e+06 4.409386e+06 5.116201e+06 5.585264e+06 4.201916e+06 4.606029e+06 1603.58236_10.235 5.554435e+06 4.522097e+06 4.517330e+06 4.788642e+06 2.767441e+04 4.118338e+06 4.658540e+06 4.764993e+06 34510.90 4.528134e+06 4.603614e+06 4.807877e+06 27654.34 4.389850e+06 4.258691e+06 4.772813e+06 3.435993e+04 4.551350e+06 4.039830e+06 5.040709e+06 1.774672e+04 4.102800e+06 4.713213e+06 4.926445e+06 6059.404 4.478541e+06 4.590180e+06 4.233715e+06 8.004313e+03 4.484909e+06 4.430331e+06 4.983872e+06 29292.24 4.606484e+06 4.813434e+06 3.858272e+06 2.070209e+04 4.378033e+06 4.581218e+06 4.537869e+06 3.047815e+04 4.619129e+06 5.037512e+06 4.635033e+06 3.085980e+04 4.386445e+06 4.116405e+06 4.784300e+06 4.486075e+06 4.215555e+06 3.860478e+06 5.739909e+06 4.728684e+06 4.442667e+06 4.588224e+06 5.483288e+06 4.777107e+06 5.389769e+06 5.764638e+06 4.984363e+06 5.538234e+06 5.527172e+06 5.459563e+06 5.400241e+06 4.691316e+06 4.795974e+06 4.778545e+06 4.832679e+06 4.601381e+06 4.726322e+06 5.460593e+06 5.300636e+06 3.547658e+06 4.579172e+06 4.508071e+06 4.621514e+06 4.641247e+06 4.723884e+06 4.995923e+06 4.628071e+06 4.153517e+06 4.456654e+06 4.426028e+06 4.673806e+06 4.244489e+06 4.608542e+06 4.078348e+06 4.081838e+06 4.437013e+06 3.984982e+06 4.912992e+06 4.070522e+06 4.582285e+06 4.055489e+06 4.696572e+06 4.986072e+06 4.608405e+06 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4.486488e+06 4.202604e+06 4.186424e+06 3.533876e+06 3.265245e+06 6.206409e+06 4.579472e+06 4.358382e+06 5.481169e+06 5.301047e+06 4.237558e+06 5.335047e+06 5.122773e+06 6.225507e+06 5.562121e+06 4.214510e+06 3.186022e+06 3.733314e+06 8.346035e+06 4.028991e+06 4.761059e+06 3.751054e+06 4.835741e+06 5.697533e+06 3.739708e+06 3.489327e+06 3.708768e+06 4.993733e+06 4.395610e+06 4.538265e+06 4.695606e+06 4.561723e+06 3.467650e+06 4.280846e+06 4.793065e+06 4.248186e+06 4.291352e+06 4.229263e+06 4.746017e+06 5.028249e+06 4.832557e+06 3.160323e+06 4.321295e+06 2.896019e+06 5.133798e+06 3.271062e+06 3.419688e+06 4.015566e+06 4.899254e+06 3.833533e+06 4.490880e+06 4.780530e+06 3.654195e+06 3.405836e+06 4.076245e+06 3.571479e+06 4.723730e+06 5.267574e+06 5.107635e+06 4.156816e+06 3.728060e+06 6.050513e+06 4.304804e+06 3.326775e+06 3.725466e+06 5.237390e+06 5.763812e+06 3.882606e+06 4.258088e+06 2.271579e+06 4.862163e+06 3.941999e+06 4.614312e+06 4.297392e+06 4.241358e+06 3.211902e+06 5.102375e+06 3.932290e+06 3.834212e+06 7.571022e+06 2.934002e+06 8.278727e+06 3.744278e+06 4.220114e+06 6.332032e+06 3.352896e+06 3.892588e+06 4.901743e+06 4.978279e+06 5.743264e+06 4.226437e+06 4.530054e+06 4.006029e+06 4.034457e+06 4.922334e+06 5.923018e+06 4.876403e+06 4.807193e+06 4.565710e+06 3.812370e+06 4.648939e+06 7.444314e+06 4.648841e+06 C7 H8 N6 O4_10.373 3.468855e+08 8.625984e+07 1.421102e+08 1.123187e+08 4.982000e+05 1.129113e+08 1.550327e+08 2.093887e+08 2359983.66 5.203790e+07 1.585356e+08 1.354485e+08 1377534.14 1.184034e+08 1.341151e+08 4.479648e+07 3.161998e+05 1.262157e+08 1.105768e+08 2.205619e+08 1.222248e+06 8.036288e+07 2.143969e+08 7.202862e+07 1297681.411 1.164526e+08 7.627871e+07 1.704165e+08 8.989513e+04 3.506622e+07 2.680816e+08 5.615045e+07 1789746.44 1.073407e+08 1.743192e+08 1.140027e+08 1.913666e+06 1.103243e+08 1.362534e+08 1.334013e+08 3.180460e+05 1.127918e+08 1.425972e+08 1.345675e+08 1.345169e+06 9.394187e+07 1.565648e+08 1.168114e+08 1.079160e+08 1.365630e+08 1.189690e+08 3.209764e+08 7.269819e+07 1.152087e+08 1.383527e+08 1.793421e+08 3.370504e+07 8.126679e+07 3.438691e+08 1.229340e+08 1.364778e+08 1.771721e+08 2.872987e+08 1.775952e+08 1.794062e+08 8.537062e+07 6.136975e+07 1.604630e+08 1.049801e+08 2.239402e+08 1.766183e+08 1.010824e+08 1.142089e+08 1.110811e+08 1.744093e+08 1.318135e+08 3.225779e+07 3.494819e+07 1.494312e+08 1.024815e+08 1.039601e+08 1.215848e+08 1.321950e+08 1.738719e+08 9.730992e+07 6.900908e+07 7.715993e+07 6.141008e+07 9.312079e+07 2.698632e+07 2.168074e+08 1.007385e+08 1.918371e+08 6.336427e+07 1.979928e+08 3.296719e+07 9.981315e+07 1.241542e+08 3.392304e+07 4.533873e+07 1.344165e+08 5.253016e+07 2.009687e+08 2.177976e+08 2.390830e+08 1.304694e+08 1.615982e+08 1.356809e+08 1.021252e+08 1.175257e+08 3.041888e+08 1.981876e+08 1.413053e+08 1.572259e+08 1.553270e+08 8.991348e+07 1.001133e+08 1.313063e+08 2.231574e+08 8.597440e+07 1.336728e+08 1.549905e+08 6.109142e+07 1.431449e+08 1.175651e+08 1.559622e+08 1.261866e+08 6.405437e+07 1.368166e+08 9.639774e+07 8.011297e+07 9.821065e+07 5.062545e+07 2.553967e+08 2.326401e+08 1.932473e+08 5.530845e+07 1.523433e+08 1.211531e+08 1.917096e+08 8.221585e+07 1.177752e+08 1.634447e+08 1.278496e+08 2.645143e+08 1.148004e+08 1.581616e+08 8.448372e+07 1.546383e+08 4.646557e+07 1.366856e+08 1.694139e+08 6.007050e+07 1.508673e+08 1.208353e+08 5.567971e+07 1.907480e+08 1.923769e+08 8.594832e+07 1.268505e+08 1.766706e+08 1.473348e+08 1.259941e+08 9.437473e+07 1.382401e+08 1.151489e+08 1.329299e+08 1.497209e+08 8.080985e+07 2.702497e+07 2.470831e+08 9.417762e+07 1.523139e+08 2.562120e+07 1.105908e+08 1.413853e+08 3.174575e+08 7.615128e+07 1.293917e+08 1.424276e+08 2.768020e+08 8.076305e+07 2.023515e+08 1.124552e+08 6.762950e+07 1.123890e+08 2.206263e+08 8.515510e+07 1.042020e+08 9.621781e+07 2.578091e+08 4.356666e+07 9.689677e+07 1.064780e+08 1.114731e+08 4.549315e+07 1.146476e+08 5.188760e+07 1.640854e+08 6.912195e+07 1.319430e+08 9.234506e+07 1.920371e+08 1.176076e+08 5.483821e+07 2.544573e+08 1.557942e+08 2.564538e+08 1.191132e+08 2.753280e+08 1.129494e+08 2.360644e+07 9.888179e+07 7.649860e+07 1.036506e+08 1.022120e+08 7.408192e+07 1.278435e+08 2.959786e+08 1.033746e+08 5.369202e+07 1.534152e+08 6.500529e+07 6.991774e+07 1.340901e+08 2.579630e+08 1.553559e+08 1.094071e+08 9.060641e+07 1.868827e+08 8.507385e+07 8.764494e+07 7.796997e+07 1.148993e+08 1.892826e+08 1.843114e+08 1.326628e+08 1.200549e+08 1.677377e+08 2.797426e+08 1.737863e+08 3.788295e+08 1.727444e+08 3.236656e+08 1.043421e+08 1.227785e+08 5.318910e+07 1.513413e+08 1.216199e+08 8.528848e+07 9.707896e+07 2.894339e+08 1.527483e+08 1.664865e+08 1.728630e+08 1.006947e+08 3.926119e+07 1.251795e+08 4.576639e+07 1.693972e+08 5.339408e+07 3.461200e+07 C6 H6 O14 P2_10.379 1.804733e+07 1.817020e+07 1.290103e+07 1.644865e+07 5.407606e+05 1.184727e+07 1.497673e+07 1.353145e+07 447248.14 2.278180e+07 1.536487e+07 1.445151e+07 368680.51 1.525098e+07 1.949832e+07 1.324214e+07 5.232939e+05 1.203503e+07 1.482570e+07 1.945458e+07 2.933218e+05 1.177095e+07 1.488917e+07 2.161596e+07 95497.245 1.046901e+07 1.744953e+07 1.751771e+07 1.116200e+05 1.324298e+07 1.768651e+07 1.409878e+07 456328.62 1.589185e+07 1.524428e+07 1.245475e+07 3.329579e+05 1.639393e+07 1.720201e+07 1.443846e+07 4.229699e+05 1.438256e+07 1.344550e+07 2.150407e+07 4.006347e+05 1.731079e+07 1.289208e+07 1.457685e+07 1.285735e+07 1.521734e+07 1.276720e+07 2.756484e+07 1.792393e+07 2.156094e+07 1.452230e+07 1.542472e+07 2.675277e+07 2.105875e+07 3.431835e+07 1.717484e+07 3.061592e+07 1.409865e+07 1.966664e+07 1.976430e+07 1.714059e+07 1.559145e+07 2.264098e+07 1.533753e+07 1.765668e+07 1.971099e+07 1.401038e+07 1.887868e+07 1.681372e+07 2.175759e+07 1.336451e+07 1.733284e+07 1.551233e+07 1.686300e+07 1.635192e+07 1.885471e+07 1.190118e+07 1.644629e+07 1.418351e+07 1.435916e+07 1.727735e+07 1.803493e+07 9.179237e+06 1.483489e+07 1.616570e+07 1.151060e+07 2.177487e+07 1.405994e+07 1.219568e+07 9.441655e+06 2.461300e+07 1.790681e+07 1.336581e+07 1.633642e+07 1.897202e+07 1.090071e+07 1.497810e+07 1.206685e+07 1.368428e+07 1.564972e+07 1.613985e+07 1.501515e+07 1.335886e+07 1.489185e+07 1.020334e+07 1.120507e+07 1.145660e+07 1.296712e+07 1.212688e+07 1.568204e+07 9.861459e+06 1.363920e+07 2.072524e+07 1.437165e+07 1.245008e+07 1.743063e+07 1.757245e+07 1.556928e+07 1.578036e+07 1.481598e+07 1.337311e+07 1.563924e+07 1.158535e+07 1.046120e+07 1.074954e+07 1.920949e+07 1.501734e+07 1.652336e+07 9.300796e+06 1.769130e+07 1.263594e+07 1.526733e+07 1.439293e+07 1.471560e+07 1.603681e+07 1.167802e+07 1.431204e+07 1.445432e+07 1.167999e+07 1.370580e+07 1.507635e+07 1.295315e+07 1.555170e+07 1.482261e+07 2.000629e+07 1.665480e+07 1.733287e+07 1.955073e+07 1.348310e+07 2.001492e+07 1.363924e+07 1.158524e+07 1.559556e+07 1.405504e+07 1.338488e+07 1.607068e+07 2.363824e+07 1.670841e+07 1.902218e+07 9.506276e+06 2.772031e+07 1.327490e+07 2.179030e+07 1.541198e+07 1.822118e+07 1.967022e+07 1.184153e+07 1.439118e+07 1.630970e+07 1.246196e+07 1.648914e+07 9.723713e+06 1.809652e+07 1.906376e+07 2.433237e+07 1.375283e+07 1.602356e+07 1.099798e+07 1.450241e+07 1.295736e+07 2.525556e+07 1.371689e+07 1.115223e+07 1.516639e+07 1.148020e+07 1.166821e+07 1.482442e+07 1.294606e+07 1.542056e+07 1.610661e+07 1.641582e+07 9.619744e+06 1.475198e+07 1.473586e+07 1.826765e+07 1.592126e+07 1.445646e+07 1.725579e+07 1.606448e+07 1.608756e+07 1.009401e+07 1.698955e+07 1.098913e+07 1.581809e+07 1.665801e+07 1.218553e+07 1.388286e+07 1.707181e+07 1.115839e+07 1.029958e+07 1.184105e+07 1.351373e+07 1.100728e+07 1.048740e+07 2.064661e+07 1.170389e+07 1.047876e+07 9.706175e+06 1.656111e+07 9.109949e+06 1.734067e+07 1.048469e+07 1.865355e+07 1.405472e+07 1.673301e+07 1.334834e+07 1.811119e+07 1.467647e+07 1.322484e+07 1.816720e+07 1.495275e+07 1.729052e+07 1.202379e+07 1.360667e+07 1.528346e+07 2.253089e+07 1.319767e+07 1.077259e+07 1.564766e+07 1.494168e+07 9.949261e+06 1.157334e+07 1.457223e+07 1.201960e+07 1.719490e+07 1.662273e+07 1.300482e+07 1.276258e+07 1.502626e+07 1.809233e+07 1.477155e+07 1.440973e+07 1.147262e+07 1.449119e+07 1.455715e+07 1.327037e+07 1.727488e+07 1.846863e+07 C4 H4 O7 P2_10.492 7.639957e+09 1.729617e+09 4.616572e+09 5.196991e+09 3.369440e+05 3.455046e+09 5.842247e+09 5.404047e+09 292927.60 3.435271e+09 3.085645e+09 4.985579e+09 235203.95 3.726068e+09 4.324114e+09 3.128821e+09 2.608595e+05 4.695320e+09 4.849192e+09 3.065995e+09 1.523478e+05 4.077009e+09 4.001461e+09 5.475046e+09 978453.541 4.500182e+09 3.564033e+09 4.693711e+09 6.758605e+04 3.786926e+09 3.731358e+09 3.583864e+09 245590.94 3.560998e+09 5.317103e+09 3.743526e+09 1.487399e+05 4.009353e+09 4.575383e+09 5.195231e+09 2.158418e+05 2.956063e+09 5.006781e+09 3.214600e+09 2.268545e+05 4.898903e+09 3.189022e+09 4.695051e+09 3.444817e+09 3.062543e+09 5.322185e+09 4.269863e+09 3.396750e+09 4.678585e+09 3.396304e+09 4.935514e+09 7.280789e+09 6.079271e+09 5.727980e+09 3.941159e+09 7.900306e+09 6.222140e+09 6.448952e+09 3.547474e+09 3.753954e+09 5.227056e+09 5.572221e+09 5.658539e+09 5.291741e+09 3.530144e+09 5.291477e+09 4.111899e+09 6.735769e+09 3.926808e+09 5.531977e+09 4.875986e+09 3.315371e+09 3.796031e+09 6.630059e+09 4.995683e+09 3.598002e+09 4.736442e+09 3.141319e+09 3.700672e+09 4.658763e+09 4.644214e+09 3.580286e+09 2.742458e+09 4.028370e+09 2.510948e+09 5.144165e+09 3.415368e+09 5.914691e+09 3.227674e+09 3.663632e+09 5.604018e+09 2.789460e+09 4.457987e+09 3.664248e+09 4.316336e+09 3.113866e+09 3.175382e+09 5.133183e+09 3.674666e+09 4.989432e+09 6.312042e+09 3.739267e+09 4.950398e+09 4.839901e+09 4.159956e+09 5.410362e+09 3.211194e+09 4.016252e+09 4.130886e+09 3.564891e+09 5.188059e+09 4.355697e+09 3.244270e+09 5.819265e+09 4.804101e+09 4.528193e+09 2.782349e+09 3.840192e+09 5.827430e+09 2.868828e+09 3.159673e+09 5.121124e+09 4.698657e+09 1.717842e+09 3.241738e+09 5.482686e+09 3.244349e+09 5.076983e+09 5.761676e+09 3.569507e+09 3.967231e+09 5.010735e+09 4.664926e+09 3.466357e+09 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3.327388e+07 1.408589e+07 5.589964e+07 5.867623e+06 9.504037e+05 6.792445e+07 5.916147e+07 6.999663e+07 5.421836e+07 4.420761e+07 5.389672e+07 9.059953e+07 8.954053e+07 2.926361e+07 4.389677e+07 6.265566e+07 3.529740e+07 2.916800e+07 3.473295e+07 3.017769e+07 7.513592e+07 5.511718e+07 4.085189e+07 9.801234e+07 2.523046e+07 8.197462e+07 7.537328e+07 6.904632e+07 5.518156e+07 8.041799e+07 3.210580e+07 4.342211e+07 6.316799e+07 1.026997e+08 3.366604e+07 8.919708e+07 5.908029e+07 5.884217e+07 3.482959e+07 5.324713e+07 5.797031e+07 1.480152e+08 4.630933e+07 7.562167e+07 5.410247e+07 6.625955e+07 3.230848e+07 2.881193e+07 7.499468e+07 3.578302e+07 3.874542e+07 5.010865e+07 4.124514e+07 1.101424e+08 9.984221e+07 3.576382e+07 2.079754e+07 1.118305e+08 4.187340e+07 2.065125e+07 1.006624e+08 3.517492e+07 4.653908e+07 2.900573e+07 9.013025e+07 6.055359e+07 3.561223e+07 1.028704e+08 2.516592e+07 2.776199e+07 6.427937e+07 6.622986e+07 3.838016e+07 6.709663e+07 6.297567e+07 5.127451e+07 5.261358e+05 9.417242e+07 8.293616e+07 5.526918e+07 1.924420e+07 9.216184e+07 6.932552e+07 2.826627e+07 7.234188e+07 4.225625e+07 4.684325e+07 8.824474e+07 6.635084e+06 6.753589e+07 1.615411e+07 6.562392e+07 6.799041e+07 5.352206e+07 5.093604e+07 6.149990e+07 2.687592e+07 C7 H8 N6 O4_10.981 9.268542e+07 4.290539e+05 1.119260e+08 6.564020e+06 8.210359e+06 7.776371e+07 1.076832e+08 5.458242e+07 355949.50 6.617690e+07 1.029207e+08 1.199677e+08 283046.86 8.702979e+07 1.668953e+08 1.159841e+06 1.515872e+06 8.661731e+07 8.649254e+07 1.098764e+08 1.467464e+06 8.311303e+07 1.014859e+08 1.356580e+08 4346611.657 6.996223e+07 5.234249e+07 1.405930e+08 1.215232e+05 5.281450e+07 7.720462e+07 1.321518e+08 2996394.04 1.051221e+08 8.617850e+07 1.734015e+06 3.242649e+05 1.012107e+08 1.865397e+08 1.539009e+08 7.910949e+05 2.814580e+06 4.428236e+07 8.884838e+07 1.784657e+06 7.991495e+07 1.721398e+08 5.108587e+07 9.394193e+07 1.068539e+08 1.124480e+08 6.696867e+07 1.203226e+08 9.433867e+07 1.242312e+08 7.368511e+07 1.046866e+08 1.645049e+08 6.234281e+07 1.599515e+08 1.536599e+08 1.074088e+08 1.873473e+07 9.532972e+07 4.101067e+07 1.252703e+08 5.326918e+07 1.471050e+08 9.367377e+07 2.002201e+06 1.106951e+08 1.016751e+08 1.355378e+08 5.558496e+07 5.945701e+07 1.690363e+08 1.534345e+08 8.707733e+07 1.152207e+08 1.423303e+08 1.179708e+08 1.287580e+08 1.306083e+08 8.140276e+07 1.227130e+08 2.112897e+08 5.131770e+07 6.695452e+07 1.286671e+08 5.313278e+05 5.029067e+07 1.226156e+08 6.669127e+07 1.193041e+08 2.269365e+06 5.935119e+06 7.729100e+07 9.661549e+07 6.104011e+07 8.098161e+07 8.715623e+07 7.538689e+07 7.190905e+05 1.045175e+08 7.165281e+07 7.254238e+07 5.698956e+07 7.362096e+07 1.274982e+08 1.084170e+08 7.466001e+05 6.975199e+07 1.017219e+08 6.790439e+07 9.381857e+07 5.951691e+07 1.463921e+08 1.572461e+08 1.122818e+08 1.326163e+08 1.305339e+06 2.345025e+06 5.728358e+07 8.205807e+07 1.221054e+08 9.345400e+07 1.162127e+08 1.049871e+06 4.956696e+07 1.263974e+08 1.309853e+08 1.389195e+08 1.408030e+08 7.441400e+07 7.294642e+07 1.487347e+07 1.511497e+08 1.256394e+08 1.335099e+08 9.993339e+07 1.623899e+08 9.682166e+07 8.122455e+07 1.006233e+08 7.889724e+07 1.326506e+08 1.028324e+08 2.429881e+06 1.130657e+08 1.371876e+08 1.272316e+08 7.624344e+06 6.937309e+05 1.146729e+08 9.047340e+07 7.570867e+07 1.313864e+08 7.682141e+07 1.490277e+08 6.492186e+07 8.477320e+07 9.492541e+07 1.260584e+08 6.346081e+07 1.239483e+08 1.156089e+08 9.049792e+07 1.415530e+07 1.530396e+08 1.499166e+07 6.938041e+07 8.106291e+07 9.051869e+07 7.037921e+07 9.562923e+07 6.577400e+07 2.115716e+07 1.295285e+06 1.496869e+08 1.235174e+08 7.508696e+07 1.017375e+06 1.946996e+07 1.163170e+08 1.394403e+08 9.649392e+07 6.021189e+07 1.361986e+08 1.400677e+08 1.278122e+08 1.039149e+08 1.139522e+08 1.781142e+08 1.500345e+08 1.558163e+08 6.661777e+07 1.662705e+08 6.718953e+07 1.143218e+08 9.082433e+07 1.179430e+08 7.167902e+07 1.389585e+08 1.310233e+08 4.640644e+07 7.280155e+07 1.378063e+08 6.641043e+07 1.085840e+08 5.003115e+07 1.405419e+08 7.286944e+05 6.797254e+07 2.065130e+06 7.448206e+07 1.273443e+08 1.180686e+08 9.113565e+07 7.057708e+07 6.878849e+07 1.204998e+08 5.050908e+07 7.993564e+07 6.301197e+06 1.115591e+08 5.538415e+05 8.857190e+07 1.095934e+08 1.554054e+08 1.341880e+08 1.340240e+08 6.973040e+07 1.300582e+08 1.237503e+08 9.742659e+05 6.932205e+07 7.684797e+07 8.175168e+07 8.004284e+07 8.767744e+07 7.018733e+07 1.341579e+06 5.832893e+07 1.593063e+06 1.226790e+08 8.098905e+07 1.378909e+08 7.757730e+07 7.337032e+07 9.455278e+07 7.755600e+07 9.230121e+06 1.144175e+08 1.260748e+08 1.098914e+08 7.977265e+07 1.434567e+06 9.123012e+07 7.910258e+07 7.533981e+07 1.076810e+06 3.211708e+06 C9 H16 N4 O5_11.342 2.177923e+05 9.469420e+04 1.257919e+05 9.254270e+04 3.105853e+04 1.151599e+05 1.040205e+05 1.063113e+05 32500.04 1.097825e+05 1.052228e+05 1.127844e+05 33841.11 2.999305e+04 1.084561e+05 9.788151e+04 3.666161e+04 9.005373e+04 1.085211e+05 1.403732e+05 2.524452e+04 8.669893e+04 1.035912e+05 1.290186e+05 11394.847 1.024835e+05 7.085345e+04 1.070126e+05 1.311039e+04 1.281940e+05 1.063575e+05 1.094513e+05 33875.55 1.112521e+05 3.677951e+04 9.162848e+04 2.990583e+04 1.084072e+05 1.188640e+05 1.200154e+05 4.254698e+04 5.275875e+04 1.143792e+05 1.456631e+05 3.487930e+04 1.064681e+05 9.133307e+04 1.040258e+05 4.920949e+04 6.878248e+04 2.215785e+05 1.073330e+05 3.706417e+05 1.232162e+05 3.400116e+04 3.687106e+04 6.909958e+04 5.383582e+05 3.170852e+06 8.259680e+04 5.524703e+05 3.428349e+04 3.886976e+04 4.258095e+04 1.473259e+05 3.869965e+04 4.806297e+04 3.250010e+04 2.575413e+04 2.017739e+06 5.639897e+04 6.848321e+04 3.712765e+04 6.749075e+04 1.260866e+05 4.768374e+04 2.573456e+06 4.266492e+04 2.305858e+05 6.981401e+04 4.047788e+04 3.996395e+04 1.276851e+06 7.646065e+04 2.631822e+04 1.974879e+05 4.131988e+04 3.855879e+04 4.792868e+04 4.829884e+04 6.880052e+05 8.188099e+04 5.677639e+04 2.828522e+04 6.887201e+05 4.908377e+04 1.095549e+05 4.463784e+04 2.982256e+04 2.843749e+04 3.526323e+04 3.415460e+04 2.615527e+04 3.299875e+04 3.835917e+04 3.107429e+04 4.104182e+04 3.041253e+04 4.572947e+04 2.547768e+04 3.181640e+04 2.465150e+04 2.350230e+05 3.730047e+04 7.872676e+04 2.507579e+04 7.125807e+04 3.873354e+04 1.333512e+05 5.160929e+04 1.205969e+05 3.647830e+04 3.620682e+04 2.688150e+04 5.216991e+04 3.829909e+04 2.528851e+04 3.837848e+04 3.708256e+04 3.723265e+04 3.634212e+04 6.117999e+04 3.817698e+04 5.770043e+05 3.691706e+05 3.090158e+04 1.102657e+06 3.139241e+04 3.601267e+04 3.120737e+04 4.671656e+04 3.935045e+04 4.199438e+04 4.823441e+04 2.516336e+04 3.594354e+05 3.558141e+04 4.593460e+04 4.228274e+04 3.651594e+04 8.051342e+05 4.010556e+04 3.407383e+04 5.278661e+04 3.399585e+05 4.703484e+04 5.124473e+04 2.599555e+04 5.664911e+04 3.010133e+04 4.202096e+04 6.835695e+04 2.585073e+04 3.887846e+04 3.613834e+04 3.342106e+04 8.838923e+04 5.072614e+04 3.708492e+04 1.158062e+05 2.985268e+04 3.337010e+04 4.677816e+04 3.656486e+04 4.970798e+04 3.099960e+04 3.746571e+04 4.316612e+04 3.643419e+04 7.885328e+04 5.232555e+04 3.623443e+04 5.150240e+05 5.204744e+04 2.622404e+04 4.411921e+05 2.896870e+04 3.825337e+05 3.334055e+04 4.785744e+04 2.966326e+04 2.947156e+04 4.040753e+04 4.047315e+04 5.257549e+04 3.433305e+04 4.768278e+04 2.920619e+04 3.053519e+04 3.069122e+04 3.743761e+04 3.435407e+04 7.161304e+05 4.409539e+05 1.949032e+04 4.293207e+04 3.243949e+04 1.178989e+05 5.081824e+04 7.243886e+04 1.769770e+05 4.110835e+04 2.214547e+04 2.936628e+04 3.564211e+04 3.359235e+04 3.528859e+04 4.712528e+04 3.139327e+04 4.283490e+04 2.652213e+04 8.226568e+04 4.697771e+04 3.537176e+04 5.254055e+04 3.834838e+04 6.400970e+04 3.652433e+04 4.911004e+04 3.573434e+04 7.763283e+04 3.500024e+04 3.433241e+04 2.683610e+04 2.845717e+04 4.149584e+04 2.509584e+04 5.011726e+04 2.665875e+04 4.852094e+04 2.817985e+05 3.900385e+04 2.991709e+04 7.555812e+05 6.261278e+04 3.559173e+04 2.713657e+04 3.870532e+04 2.631198e+04 3.001058e+04 2.964049e+04 5.417216e+04 2.726688e+04 2.605190e+04 3.969210e+04 1.451131e+05 1.303936e+05 3.604887e+04 4.059068e+04 3.853041e+04 1.315272e+05 6.449438e+05 C7 H13 N3 O5_11.44 2.604570e+05 1.727673e+05 1.792657e+05 1.640936e+05 3.840241e+04 1.763819e+05 1.893190e+05 1.630189e+05 37517.09 1.692188e+05 1.895703e+05 1.949184e+05 31446.05 1.569121e+05 1.601700e+05 1.890759e+05 3.048679e+04 1.857332e+05 1.720695e+05 1.651404e+05 2.410229e+04 1.578830e+05 1.768474e+05 2.126728e+05 10917.264 1.521795e+05 1.705475e+05 1.762476e+05 1.731053e+04 8.206657e+04 1.859231e+05 1.658310e+05 33658.59 1.886155e+05 2.016351e+05 1.177537e+05 2.867613e+04 1.409175e+05 2.150669e+05 1.959047e+05 3.493133e+04 1.555268e+05 1.898709e+05 1.726616e+05 4.042532e+04 6.778564e+04 1.781710e+05 1.664080e+05 3.859150e+04 6.057907e+04 3.198904e+05 1.607289e+05 6.639289e+05 1.233810e+05 2.975578e+04 6.928661e+04 9.676565e+04 7.848229e+05 5.110040e+06 1.542154e+05 7.779316e+05 5.270103e+04 5.229330e+04 1.085216e+05 2.892688e+05 4.095440e+04 1.379316e+05 1.247493e+05 4.456213e+04 2.481672e+06 1.047456e+06 1.718278e+05 3.227221e+04 1.208800e+05 2.498396e+05 8.356318e+04 3.239211e+06 1.053247e+05 3.109469e+05 3.686428e+04 2.839640e+04 1.415929e+05 1.991674e+06 1.568858e+05 5.879492e+04 3.264667e+05 3.961586e+04 3.370984e+04 2.793351e+04 2.717772e+04 1.048250e+06 1.459575e+05 7.102764e+04 2.852016e+04 8.372468e+05 8.230256e+04 3.217770e+05 3.791010e+04 9.324801e+04 3.672647e+04 4.565753e+04 2.371551e+04 2.746308e+04 3.592051e+04 3.992538e+04 3.224002e+04 8.278541e+04 1.221534e+05 4.704865e+04 1.869734e+05 5.204328e+04 6.110250e+04 4.605009e+05 8.140178e+04 1.223740e+05 1.393755e+05 2.600162e+05 3.701950e+04 1.309200e+06 5.899816e+04 7.008344e+04 3.526641e+04 3.947547e+04 2.937098e+04 3.859268e+04 5.802549e+04 5.054100e+04 4.933817e+04 8.472998e+04 2.799900e+04 3.783158e+04 4.000815e+04 3.963047e+04 1.016892e+05 3.860941e+05 2.927493e+04 1.553802e+06 5.501615e+04 3.195628e+04 2.085679e+04 5.182748e+04 2.960695e+04 4.576003e+04 3.006445e+04 5.156908e+04 9.258063e+05 3.721395e+04 3.862699e+04 4.728724e+04 5.960075e+04 9.181246e+05 7.642830e+04 7.345253e+04 4.700363e+04 4.175900e+05 2.937386e+04 8.104595e+04 2.896220e+04 3.355166e+04 3.567643e+04 7.871062e+04 9.648046e+04 2.629540e+04 5.067006e+04 3.972590e+04 6.334603e+04 7.483206e+04 1.123435e+05 5.215258e+04 3.067215e+05 6.426856e+04 4.282548e+04 5.676321e+04 4.621759e+04 4.151971e+04 4.253705e+04 3.876911e+04 6.237668e+04 2.608303e+04 3.579309e+04 4.745052e+04 4.014674e+04 6.849347e+05 2.837666e+04 4.199307e+04 5.515457e+05 3.840759e+04 5.593095e+05 4.590761e+04 4.640322e+04 3.011934e+04 4.747984e+04 3.558236e+04 4.315715e+04 5.284966e+04 2.930023e+04 3.718584e+04 3.293549e+04 6.037253e+04 5.275199e+04 2.652701e+04 5.104964e+04 8.462990e+05 5.234976e+05 2.811874e+04 1.272794e+05 3.862870e+04 1.404429e+05 2.710613e+04 1.340617e+05 1.508335e+05 4.444228e+04 4.143899e+04 7.765104e+04 4.961703e+04 2.724849e+04 3.805845e+04 3.498155e+04 1.009386e+05 4.962922e+04 5.416670e+04 9.698373e+04 2.991803e+04 4.601852e+04 2.766718e+04 3.909915e+04 8.200477e+04 4.943835e+04 1.238742e+05 3.580812e+04 1.180689e+05 4.772158e+04 5.030860e+04 3.361853e+04 4.585560e+04 4.560504e+04 6.267671e+04 3.544726e+04 3.800262e+04 3.898600e+04 3.923380e+05 5.553761e+04 4.958585e+04 1.070009e+06 7.135198e+04 1.161683e+05 6.663701e+04 5.450875e+04 5.628467e+04 4.675676e+04 2.756489e+04 1.399642e+05 3.333805e+04 3.070236e+04 5.913925e+04 2.368194e+05 1.827612e+05 5.634963e+04 3.269886e+04 5.888489e+04 1.898829e+05 7.867781e+05 C8 H14 N4 O5_11.603 3.865470e+05 3.786579e+05 3.544218e+05 3.799854e+05 3.772103e+04 3.551555e+05 3.351701e+05 4.317163e+05 37366.94 3.368796e+05 3.530803e+05 4.002125e+05 35254.34 3.693511e+05 3.530156e+05 3.459049e+05 3.531544e+04 3.368082e+05 3.446901e+05 3.441587e+05 2.465718e+04 4.649251e+05 3.382309e+05 4.145018e+05 10983.255 3.344189e+05 3.661082e+05 3.528190e+05 1.677492e+04 3.554443e+05 3.553217e+05 4.301052e+05 36102.73 3.575947e+05 3.682925e+05 2.775799e+05 3.146433e+04 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1.650759e+07 1.573811e+07 7.615483e+06 9.012425e+06 9.166515e+06 1.164579e+07 1.726246e+07 1.811892e+07 2.174480e+07 1.229538e+07 4.966466e+05 2.103781e+05 1.345493e+07 6.037081e+06 CYSTINE 6.895186e+07 1.879008e+07 1.810018e+07 2.245841e+07 3.989569e+05 3.621566e+07 2.408438e+07 2.826173e+07 342834.91 2.036245e+07 2.629086e+07 2.585855e+07 246739.55 2.435340e+07 3.215942e+07 1.778174e+07 1.401768e+05 1.769235e+07 2.592989e+07 2.582979e+07 1.405917e+05 1.968410e+07 2.600894e+07 3.225212e+07 85227.545 2.180841e+07 2.471630e+07 2.159629e+07 3.173831e+05 2.462177e+07 2.328935e+07 2.517360e+07 65536.96 2.884557e+07 2.741363e+07 1.355471e+07 1.171751e+06 2.002294e+07 2.695368e+07 2.921187e+07 6.842797e+04 2.432210e+07 2.632258e+07 2.104720e+07 9.042938e+05 2.482410e+07 3.146694e+07 1.819264e+07 3.013584e+07 2.467014e+07 8.760709e+06 2.379633e+07 2.661058e+07 1.812429e+07 3.103112e+07 1.908749e+07 1.060160e+07 2.792061e+07 3.688670e+07 6.348194e+06 3.963018e+07 1.137159e+07 1.784049e+07 1.644719e+07 2.438385e+07 2.512436e+07 1.960520e+07 4.113757e+07 3.332225e+07 1.948288e+07 4.131908e+07 1.642219e+07 1.430921e+07 1.807481e+07 4.980534e+07 1.537453e+07 5.006282e+07 1.247877e+07 4.000649e+07 2.946978e+07 1.307398e+07 3.331555e+07 2.612947e+07 1.960542e+07 3.781521e+07 6.608866e+06 2.143167e+07 1.673304e+07 2.665030e+07 4.775319e+07 4.598762e+07 1.741471e+07 8.757462e+06 3.453627e+07 2.253226e+07 2.525745e+07 3.086528e+07 4.130618e+06 1.135181e+07 2.314180e+07 2.447257e+07 8.392534e+06 1.220590e+07 2.342525e+07 3.492696e+07 2.497696e+07 2.059480e+07 1.790679e+07 4.128886e+07 1.758757e+07 1.599539e+07 3.300600e+07 2.420402e+07 1.227005e+07 1.666578e+07 1.984835e+07 1.560566e+07 2.295707e+07 5.229435e+07 2.951572e+07 7.401019e+06 2.009916e+07 1.164248e+07 8.986713e+07 2.415966e+07 1.367035e+07 2.102781e+07 2.533300e+07 1.801653e+07 3.443846e+07 2.625322e+07 5.020739e+07 1.082393e+07 1.441113e+07 4.423768e+06 9.144176e+06 1.449241e+07 2.208621e+07 2.223531e+07 1.849942e+07 2.811206e+07 2.298386e+07 1.429165e+07 2.782189e+07 1.796677e+07 1.276679e+07 8.578600e+06 1.480414e+07 8.282292e+07 1.296084e+07 4.716006e+06 1.161770e+07 3.510410e+07 3.421280e+07 3.499579e+07 3.454609e+07 3.860461e+07 3.257501e+07 3.248373e+07 2.540209e+07 3.750312e+07 5.541987e+07 3.872064e+07 1.947615e+07 5.584127e+07 4.020866e+07 2.596022e+07 2.589708e+07 2.184240e+07 2.192329e+07 1.417546e+07 5.199821e+07 2.480603e+07 3.068592e+07 3.353086e+07 8.557578e+06 4.731458e+07 2.741251e+07 3.526561e+07 2.178271e+07 8.409428e+06 5.523978e+07 3.208109e+07 5.272828e+06 4.254113e+07 1.566302e+07 4.351530e+07 3.076583e+07 1.627770e+07 1.404218e+07 1.262674e+07 3.134219e+07 9.630265e+06 1.629305e+07 1.148979e+07 2.598729e+07 2.992863e+07 3.944217e+07 3.903793e+07 9.550744e+06 2.529342e+07 8.887301e+06 2.419393e+07 1.681096e+07 1.035513e+07 1.568970e+07 1.564246e+07 1.188474e+07 1.703889e+07 2.941442e+07 1.821420e+07 2.061472e+07 1.056277e+07 2.519435e+07 7.741330e+06 3.778415e+07 1.445396e+07 1.872226e+07 3.401565e+07 4.237631e+07 1.327697e+07 1.040805e+07 1.931911e+07 3.087343e+07 2.109245e+07 2.668555e+07 1.674684e+07 2.296273e+07 1.025926e+07 3.089545e+07 4.300996e+07 3.616020e+07 5.192145e+07 9.955097e+06 3.130698e+07 1.701627e+07 1.586818e+07 7.661270e+07 9.007052e+06 9.568156e+06 2.398171e+07 1.213981e+07 1.052846e+07 5.650144e+07 2.246181e+07 2.126903e+07 1.907452e+07 5.335360e+07 2.551730e+07 2.616578e+07 1.700053e+07 3.631465e+07 1.658848e+07 1.306806e+07 1.895662e+07 2.542570e+07 3.353090e+07 1.356601e+07 4.572587e+07 8.271632e+07 3.251935e+07 8.175302e+06 C43 H75 N3 O12 P2 S_12.09 4.369149e+05 1.105621e+06 8.633228e+05 8.445492e+05 4.787176e+04 9.220871e+05 9.997480e+05 1.032356e+06 57686.21 8.378984e+05 8.782285e+05 1.097496e+06 47028.72 9.664181e+05 9.614927e+05 8.973116e+05 4.898091e+04 8.075676e+05 9.364236e+05 1.088198e+06 3.850249e+04 8.742953e+05 9.263037e+05 1.112596e+06 18327.470 8.269377e+05 9.172242e+05 8.769827e+05 2.272977e+04 1.080003e+06 8.562655e+05 1.000655e+06 50417.41 1.042586e+06 9.237995e+05 5.843638e+05 4.550058e+04 1.142583e+06 9.681009e+05 9.851267e+05 5.230958e+04 8.656988e+05 9.865556e+05 1.113568e+06 4.754741e+04 9.040538e+05 8.193404e+05 9.813747e+05 5.868039e+04 6.622117e+04 1.253463e+06 5.668417e+05 4.180438e+05 1.990418e+05 4.451876e+04 7.512674e+04 6.919396e+04 1.880317e+05 9.535707e+04 2.007050e+05 3.055156e+06 8.819109e+05 2.798998e+06 5.031622e+05 1.018525e+06 1.824992e+06 5.140585e+06 6.282034e+06 4.344877e+06 9.702333e+06 3.709237e+05 1.065385e+06 9.047775e+04 1.894456e+06 2.774569e+06 8.006005e+04 2.337558e+06 2.059579e+05 1.782243e+05 7.192599e+04 4.351296e+04 1.902733e+06 9.098176e+04 1.440937e+06 4.015854e+05 8.136083e+04 2.799173e+06 1.255702e+06 9.246793e+05 9.605860e+05 2.817230e+06 4.355330e+04 1.045877e+06 4.369429e+04 2.384143e+06 3.023684e+05 6.398710e+05 5.576189e+06 4.078520e+06 7.267882e+04 6.240520e+06 2.313121e+06 8.860885e+05 5.738299e+04 2.960148e+06 5.574169e+04 1.584214e+05 2.404631e+06 1.226345e+05 1.258936e+07 1.634254e+06 1.094955e+06 1.855817e+06 1.551729e+05 4.756362e+05 7.425857e+06 7.182225e+06 2.343213e+06 1.053970e+07 1.013217e+05 1.087563e+05 5.650469e+05 2.056316e+06 7.846538e+04 5.850226e+04 7.055868e+06 1.824088e+06 5.542213e+04 4.633647e+06 4.987547e+04 5.717992e+04 2.045816e+06 5.784237e+04 6.548361e+04 7.285672e+04 7.344746e+05 6.006355e+04 1.195766e+05 4.338087e+04 4.696401e+04 5.567414e+04 1.810870e+05 4.768682e+05 3.675844e+05 2.814475e+05 4.721289e+06 4.203410e+05 1.189843e+05 6.678949e+04 5.963140e+04 2.410919e+06 1.263616e+05 3.578111e+05 4.013722e+05 5.789526e+06 4.558257e+04 1.345847e+05 7.077600e+04 2.522308e+05 6.414823e+06 2.990874e+05 3.836205e+06 1.242669e+06 1.131944e+05 4.560507e+05 8.710813e+04 1.663776e+05 6.374761e+04 5.691339e+04 1.120309e+06 5.164068e+04 3.005429e+05 4.614634e+05 4.510607e+04 1.078146e+05 7.877086e+04 2.040722e+05 8.441509e+04 4.339398e+04 7.839821e+05 5.960647e+04 4.997412e+05 5.919818e+04 6.142431e+04 1.630982e+05 2.183623e+05 4.897841e+04 1.309340e+05 4.383756e+04 6.906625e+05 9.394620e+04 5.588771e+04 6.829419e+04 5.729532e+04 5.894705e+04 4.421464e+04 5.399830e+04 6.883202e+04 3.970116e+05 4.174446e+04 5.154377e+04 7.187011e+04 5.994238e+04 8.935163e+05 3.252286e+05 1.237172e+05 4.767501e+04 1.086708e+05 6.263367e+04 4.383930e+04 7.119293e+04 4.320547e+04 4.103794e+04 5.359079e+04 9.876085e+04 3.436148e+05 1.240623e+05 3.387465e+05 4.787681e+04 7.596040e+05 1.034927e+05 5.648591e+04 5.871654e+04 3.749508e+05 5.466435e+05 2.495494e+05 6.065392e+04 5.457927e+04 8.214666e+04 3.897047e+06 1.509213e+05 1.366587e+05 6.106307e+04 5.106574e+04 4.840931e+04 6.288827e+04 4.642813e+04 8.021714e+04 8.300842e+04 5.166549e+04 5.497431e+04 2.354895e+05 4.382659e+05 1.271273e+06 5.065524e+05 2.774959e+05 7.591481e+05 1.222624e+05 5.908516e+04 2.037670e+06 2.523804e+05 7.361837e+04 1.312714e+06 1.327045e+06 2.307299e+05 1.833457e+05 1.273003e+05 7.641291e+04 3.671229e+06 5.994267e+04 2.145659e+06 7.160594e+04 120.01189_12.097 4.742942e+06 1.866908e+06 1.676335e+06 1.784860e+06 5.418638e+04 1.820886e+06 2.466867e+06 1.838929e+06 55876.06 1.593623e+06 1.964764e+06 2.216922e+06 85008.12 1.529320e+06 1.903817e+06 1.602028e+06 4.420589e+04 1.876955e+06 1.942635e+06 1.825471e+06 3.033570e+04 1.447440e+06 2.383780e+06 2.560816e+06 13808.793 1.582176e+06 1.569621e+06 1.776083e+06 1.862470e+04 1.464848e+06 1.733294e+06 1.711075e+06 38255.57 2.937783e+06 1.877315e+06 1.090864e+06 3.822946e+04 1.881184e+06 2.332838e+06 2.011514e+06 4.970740e+04 1.250617e+06 2.192816e+06 2.084757e+06 4.756310e+04 1.594931e+06 1.691375e+06 2.053591e+06 2.984257e+06 2.291484e+06 1.820873e+06 2.171435e+06 1.139285e+06 1.168194e+06 3.731756e+06 1.910769e+06 8.943064e+05 1.332059e+06 2.452341e+06 7.917420e+05 1.966712e+06 1.668550e+06 3.688478e+06 1.135612e+06 1.798566e+06 2.257968e+06 1.211212e+06 2.400788e+06 2.129761e+06 1.750408e+06 2.726438e+06 8.362964e+05 8.959486e+05 1.257096e+06 2.600655e+06 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2.244280e+06 4.528330e+06 3.282083e+06 1.900220e+06 2.806972e+06 2.332491e+06 2.755544e+06 4.147518e+06 2.567158e+06 3.285211e+06 3.323912e+06 1.841525e+06 4.068370e+06 6.258933e+06 2.275170e+06 2.729259e+06 3.226181e+06 2.184879e+06 2.157088e+06 3.715526e+06 2.278723e+06 3.493455e+06 3.896092e+06 1.190560e+06 3.022543e+06 2.975062e+06 2.274981e+06 1.489233e+06 6.711811e+05 2.535767e+06 2.135984e+06 5.249555e+05 3.372776e+06 8.180843e+05 3.526284e+06 2.205572e+06 1.597797e+06 9.653678e+05 8.107501e+05 3.145867e+06 3.359615e+05 1.087948e+06 7.664656e+05 1.870372e+06 2.631664e+06 3.415896e+06 2.725226e+06 8.499644e+05 2.181333e+06 5.177061e+05 1.329476e+06 2.871259e+06 6.367243e+05 1.739002e+06 1.080323e+06 9.717400e+05 1.811294e+06 1.961986e+06 1.270204e+06 2.005047e+06 1.233455e+06 1.822756e+06 5.590583e+06 2.254215e+06 8.006696e+05 1.234567e+06 2.062788e+06 3.418886e+06 1.873598e+06 8.348190e+05 2.129812e+06 2.421187e+06 2.693329e+06 2.136380e+06 1.314155e+06 3.658063e+06 1.294772e+06 2.275003e+06 3.564447e+06 1.869028e+06 3.209160e+06 1.325682e+06 2.139218e+06 1.084089e+06 1.327304e+06 4.193881e+06 9.629702e+05 6.767299e+05 2.729343e+06 1.883355e+06 9.087721e+05 4.340471e+06 2.067249e+06 2.537851e+06 2.437999e+06 2.981371e+06 1.983350e+06 1.443155e+06 1.144197e+06 4.370078e+06 1.342391e+06 1.106032e+06 2.773887e+06 2.127785e+06 3.047518e+06 7.058620e+05 3.807043e+06 5.555686e+06 2.107832e+06 1.098075e+06 C24 H49 N6 O9 P_12.599 4.518604e+04 1.339326e+05 1.479264e+05 1.179999e+05 4.052552e+04 1.485848e+05 1.319661e+05 1.482117e+05 41510.92 8.701371e+04 1.658094e+05 1.388033e+05 39570.31 1.232535e+05 1.418664e+05 1.603939e+05 5.255079e+04 1.234709e+05 1.260656e+05 1.129941e+05 2.930162e+04 1.149403e+05 1.133816e+05 2.265027e+05 18019.420 1.123453e+05 1.237691e+05 1.168636e+05 1.786218e+04 1.540768e+05 1.131158e+05 1.535808e+05 44253.13 1.670280e+05 1.105202e+05 7.920095e+04 5.048351e+04 1.131997e+05 1.666971e+05 1.209554e+05 4.310632e+04 1.478445e+05 1.601796e+05 1.426028e+05 4.272713e+04 1.262674e+05 1.290130e+05 1.294933e+05 5.181956e+04 3.450138e+04 5.032200e+04 5.255313e+04 6.121022e+04 1.414419e+05 3.456034e+04 5.038095e+04 3.631840e+04 7.284378e+04 7.268158e+04 3.784733e+04 5.819308e+04 4.915090e+04 4.061369e+04 5.346025e+04 1.332176e+05 5.138576e+04 7.960791e+04 1.254098e+05 8.330042e+04 7.408331e+04 5.800510e+04 3.248907e+04 4.735678e+04 3.241611e+04 2.379546e+05 3.191819e+04 1.794263e+05 3.181662e+04 6.832166e+05 5.228782e+04 3.753395e+04 7.718081e+04 2.920662e+05 5.641599e+04 3.274444e+04 5.598363e+04 3.144676e+05 2.178379e+05 2.925864e+04 2.241718e+04 1.747527e+05 3.708767e+04 3.701523e+04 3.786983e+04 1.248525e+05 3.613701e+04 6.259074e+04 5.677668e+04 6.480843e+05 3.825536e+04 1.175951e+07 2.753534e+04 2.823430e+04 6.239347e+04 5.824117e+04 4.009341e+04 5.562776e+04 1.963335e+05 4.041852e+04 7.035656e+06 4.128237e+04 2.810004e+04 2.600469e+04 4.824779e+04 3.740941e+04 2.068663e+06 1.083742e+06 5.253225e+04 1.024364e+07 5.709082e+04 2.678538e+05 4.582166e+04 5.149130e+04 3.010638e+04 4.933125e+04 1.040116e+05 3.738835e+04 5.201693e+04 4.957992e+05 4.151865e+04 3.028691e+04 9.142077e+05 5.276232e+04 3.922018e+04 5.783948e+04 3.548040e+04 1.139209e+05 2.882947e+04 2.940825e+04 2.263967e+04 5.686055e+04 2.939322e+04 3.860355e+04 4.003810e+04 3.655764e+04 4.525565e+06 4.715507e+04 4.194781e+04 3.766458e+04 5.831631e+04 4.079464e+04 3.798395e+04 4.088002e+04 5.719490e+04 1.973209e+05 3.939849e+04 5.828712e+04 3.739413e+04 4.210337e+04 6.223740e+04 6.846626e+04 1.494729e+05 3.278062e+04 5.161752e+04 6.255804e+04 3.774890e+04 7.041032e+04 4.606404e+04 4.854919e+04 8.764454e+05 3.851538e+04 3.393884e+04 5.375027e+04 2.852387e+04 4.904367e+04 3.950398e+04 6.510769e+04 5.300322e+04 3.415947e+04 3.423359e+04 5.279124e+04 4.917234e+04 4.801457e+04 3.860153e+04 3.177242e+04 9.487703e+04 3.845913e+04 9.989686e+04 3.797900e+04 4.674758e+04 3.661515e+04 3.887941e+04 6.558877e+04 5.406625e+04 5.165862e+04 3.803968e+04 4.518574e+04 3.347351e+04 4.485415e+04 3.358754e+04 4.015725e+04 3.366482e+04 2.743260e+05 3.613495e+04 2.892673e+04 3.825446e+04 3.147632e+04 3.786877e+04 2.843557e+04 4.942419e+04 6.065692e+04 2.768159e+04 4.841683e+04 3.875183e+04 4.863892e+04 3.389442e+04 4.782962e+04 4.708585e+04 3.819636e+04 2.821649e+04 3.839802e+04 6.066083e+04 3.277229e+04 4.594422e+04 3.145327e+04 3.974592e+04 5.497430e+04 4.733857e+04 5.402164e+04 3.837433e+04 3.301683e+04 4.697748e+04 5.389381e+04 3.419575e+04 3.272197e+04 5.752482e+04 3.573848e+04 4.954235e+04 3.802343e+04 3.669552e+04 3.413177e+04 3.693177e+04 2.939828e+04 6.828872e+04 5.290272e+04 4.953357e+04 3.748361e+04 4.380681e+04 3.559993e+04 3.558546e+04 3.985619e+04 3.991311e+04 4.258050e+04 3.720675e+04 4.440446e+04 3.435333e+04 1.113410e+05 5.180210e+04 3.539589e+04 5.709138e+04 8.961603e+04 3.502073e+04 C10 H20 O9_12.872 2.603909e+06 1.637326e+06 1.365949e+06 1.612905e+06 4.084996e+04 1.574039e+06 1.915217e+06 1.645101e+06 58222.56 1.267681e+06 1.653322e+06 1.805610e+06 30375.97 1.442915e+06 1.645385e+06 1.591910e+06 3.030844e+04 1.659763e+06 1.445873e+06 1.532220e+06 2.636797e+04 1.461895e+06 1.512350e+06 2.100672e+06 14362.339 1.420020e+06 1.573295e+06 1.671445e+06 1.562065e+04 1.339878e+06 1.618664e+06 1.937201e+06 32035.21 1.485141e+06 1.771710e+06 8.716235e+05 4.294777e+04 1.489440e+06 1.929915e+06 1.736408e+06 3.146905e+04 1.510075e+06 1.821353e+06 1.520299e+06 3.126389e+04 1.496544e+06 1.346618e+06 1.783586e+06 1.426600e+06 1.678762e+06 2.359948e+06 1.633421e+06 3.115337e+06 1.527532e+06 3.481555e+06 3.281938e+06 2.234254e+06 2.905544e+06 4.053730e+06 1.507077e+06 2.694524e+06 2.756467e+06 1.924504e+06 2.439673e+06 1.458087e+06 1.399433e+06 2.407296e+06 1.613426e+06 1.892918e+06 1.168966e+06 1.291907e+06 2.243232e+06 1.564149e+06 1.442578e+06 3.391762e+06 1.298697e+06 2.410862e+06 2.276988e+06 4.367660e+06 2.506918e+06 1.257013e+06 1.699784e+06 1.749119e+06 1.724648e+06 1.854860e+06 3.050512e+06 1.305983e+06 1.316416e+06 2.519586e+06 1.272208e+06 1.777905e+06 1.744102e+06 1.198024e+06 2.379442e+06 2.040712e+06 2.104121e+06 2.222598e+06 2.180865e+06 8.015572e+05 2.447000e+06 1.685755e+06 6.006542e+05 2.190200e+06 1.454118e+06 1.664130e+06 1.801903e+06 1.816800e+06 2.714661e+06 1.674057e+06 1.196860e+06 1.364494e+06 1.941912e+06 9.023992e+05 1.121726e+06 7.653730e+05 1.770044e+06 2.034477e+06 1.700114e+06 2.296078e+06 2.155276e+06 1.182870e+06 1.654333e+06 9.963940e+05 7.370580e+05 1.451817e+06 1.702216e+06 1.190734e+06 1.102716e+06 1.512732e+06 1.830296e+06 2.510573e+06 3.738488e+06 1.190851e+06 1.490168e+06 1.683918e+06 1.000796e+06 1.218008e+06 1.677661e+06 1.719397e+06 1.485064e+06 1.702254e+06 1.415488e+06 1.423497e+06 1.705986e+06 1.359257e+06 7.704581e+05 9.289224e+05 1.912333e+06 1.438194e+06 1.354740e+06 9.314093e+05 1.286214e+06 1.736068e+06 2.321733e+06 1.810672e+06 2.020260e+06 2.762100e+06 1.130587e+06 1.140396e+06 1.176572e+06 2.043961e+06 1.319099e+06 1.286385e+06 2.027819e+06 1.613168e+06 2.909080e+06 2.093557e+06 1.531490e+06 3.472582e+06 2.126430e+06 1.873352e+06 1.495617e+06 2.518355e+06 1.836119e+06 1.987467e+06 1.206685e+06 2.656950e+06 2.075374e+06 1.945346e+06 1.321974e+06 5.312970e+05 1.048778e+06 2.200316e+06 7.547459e+05 9.101008e+05 1.332997e+06 1.597666e+06 1.701085e+06 1.672933e+06 2.663840e+06 1.602212e+06 1.346444e+06 6.639649e+05 1.796389e+06 5.685045e+05 1.808396e+06 2.067444e+06 1.228092e+06 1.847687e+06 2.119372e+06 1.843287e+06 7.652687e+05 2.251157e+06 2.173015e+06 5.355701e+05 1.234569e+06 1.517869e+06 9.636717e+05 1.068938e+06 6.900075e+05 2.505505e+06 1.647871e+06 1.149130e+06 1.589290e+06 9.264733e+05 2.299925e+06 9.525499e+05 1.707092e+06 1.094122e+06 1.823844e+06 1.344973e+06 1.579631e+06 1.683738e+06 1.726291e+06 1.543137e+06 1.394650e+06 1.679708e+06 1.198361e+06 1.711429e+06 1.822160e+06 1.547728e+06 8.697576e+05 1.675476e+06 1.755801e+06 1.258116e+06 1.780375e+06 1.829359e+06 1.834224e+06 2.016969e+06 1.081604e+06 2.006856e+06 1.142578e+06 1.922122e+06 1.948518e+06 1.529090e+06 2.935123e+06 2.136784e+06 1.964787e+06 2.424347e+06 1.725465e+06 2.230416e+06 2.873195e+06 1.156377e+06 2.125510e+06 1.849718e+06 1.607748e+06 2.240717e+06 1.903071e+06 1.510826e+06 9.903653e+05 2.722728e+06 2.450646e+06 SYMMETRIC DIMETHYLARGININE (SDMA) 8.585662e+06 5.907849e+06 5.936512e+06 6.348843e+06 3.894215e+04 6.033773e+06 6.724722e+06 6.180371e+06 36085.26 5.059195e+06 5.387591e+06 7.197076e+06 33315.93 6.138989e+06 6.638048e+06 6.049995e+06 3.368763e+04 5.415401e+06 6.247705e+06 6.152743e+06 2.958562e+04 5.528483e+06 5.709928e+06 7.764080e+06 18993.429 5.270577e+06 5.716503e+06 5.915786e+06 2.008099e+04 6.450975e+06 6.463495e+06 6.647996e+06 37940.53 5.877077e+06 5.120605e+06 5.473453e+06 3.700940e+04 6.053033e+06 6.155766e+06 6.405306e+06 3.530145e+04 5.787475e+06 6.220459e+06 6.329733e+06 3.214532e+04 7.104468e+06 5.652697e+06 5.537362e+06 5.488267e+06 8.452242e+06 7.232923e+06 7.975960e+06 9.016594e+06 6.365681e+06 9.847610e+06 7.958570e+06 9.230435e+06 1.003164e+07 1.359559e+07 8.980531e+06 2.105455e+07 1.044858e+07 1.057132e+07 8.740365e+06 6.740557e+06 5.664478e+06 8.900422e+06 7.492569e+06 6.255498e+06 5.685114e+06 8.878542e+06 7.389927e+06 7.312257e+06 5.702532e+06 8.101869e+06 7.494827e+06 8.074416e+06 8.773102e+06 1.086065e+07 7.672642e+06 5.893538e+06 5.639219e+06 9.239823e+06 6.656790e+06 7.797493e+06 6.324064e+06 5.042914e+06 5.752691e+06 8.116008e+06 5.482331e+06 1.032232e+07 5.769453e+06 6.588993e+06 7.702667e+06 7.526393e+06 8.089912e+06 7.026814e+06 6.162543e+06 5.170560e+06 9.387969e+06 4.638118e+06 5.065285e+06 4.658969e+06 1.014289e+07 6.099472e+06 9.016523e+06 5.638904e+06 6.443787e+06 9.063995e+06 6.471906e+06 4.272643e+06 1.050258e+07 5.540157e+06 6.557616e+06 6.633857e+06 6.924692e+06 1.026441e+07 7.871795e+06 7.237249e+06 1.208695e+07 5.732848e+06 5.774930e+06 3.878835e+06 5.946112e+06 5.649681e+06 6.770829e+06 6.270685e+06 5.268299e+06 9.679437e+06 8.690560e+06 1.344303e+07 8.787807e+06 4.454239e+06 7.074113e+06 7.098513e+06 8.002253e+06 5.517063e+06 8.474711e+06 7.465639e+06 5.470422e+06 6.288248e+06 6.384318e+06 5.276445e+06 6.911168e+06 8.209573e+06 7.319014e+06 5.628785e+06 6.828096e+06 6.002405e+06 6.652693e+06 5.452673e+06 6.776772e+06 6.774292e+06 7.564087e+06 6.472399e+06 7.114924e+06 1.018337e+07 5.107708e+06 6.377266e+06 8.314322e+06 7.560736e+06 1.546950e+07 5.637496e+06 5.584413e+06 4.833349e+06 8.747538e+06 8.791795e+06 6.391933e+06 6.113252e+06 9.566308e+06 7.026921e+06 6.923971e+06 7.958606e+06 6.553902e+06 7.534634e+06 7.495662e+06 9.498380e+06 5.865150e+06 7.680108e+06 7.348939e+06 4.291787e+06 5.156778e+06 5.409646e+06 4.758148e+06 4.391263e+06 7.004927e+06 7.409896e+06 4.564340e+06 7.787265e+06 6.986496e+06 5.192880e+06 4.655962e+06 1.210499e+07 7.392491e+06 3.583692e+06 5.754822e+06 5.215188e+06 8.903989e+06 6.523187e+06 7.564060e+06 4.906348e+06 6.161684e+06 7.261792e+06 6.306535e+06 2.465343e+06 4.900683e+06 6.399579e+06 5.485911e+06 7.335505e+06 4.428183e+06 8.220453e+06 6.847852e+06 5.232244e+06 5.715517e+06 4.448907e+06 8.958371e+06 5.064456e+06 5.139953e+06 5.887887e+06 8.086970e+06 5.245780e+06 6.079292e+06 7.607466e+06 5.108573e+06 6.646153e+06 5.336823e+06 5.406941e+06 3.602061e+06 5.800876e+06 5.337926e+06 6.772111e+06 5.200794e+06 7.002358e+06 6.221613e+06 6.125191e+06 7.301778e+06 5.759978e+06 7.862280e+06 6.464837e+06 7.272121e+06 7.882462e+06 5.375304e+06 6.939783e+06 9.223208e+06 5.378550e+06 7.390234e+06 6.193045e+06 7.278062e+06 8.961348e+06 6.145211e+06 8.237943e+06 8.329832e+06 5.122808e+06 9.022605e+06 8.779528e+06 6.516410e+06 5.403010e+06 6.187357e+06 7.263720e+06 6.955726e+06 9.458204e+06 8.944189e+06 78.06864_13.119 2.215089e+06 1.470668e+06 1.376152e+06 1.923288e+06 3.811905e+04 1.464049e+06 1.813074e+06 1.444240e+06 37123.73 1.596668e+06 1.573202e+06 1.617436e+06 38875.45 1.456863e+06 1.739958e+06 1.507901e+06 3.989862e+04 1.576240e+06 1.667464e+06 1.521044e+06 3.366144e+04 1.355681e+06 1.543717e+06 2.156152e+06 20619.437 1.373042e+06 1.394392e+06 1.536994e+06 2.196686e+04 1.715224e+06 1.586972e+06 1.774414e+06 42986.42 1.463438e+06 1.537492e+06 8.530459e+05 4.277020e+04 2.073907e+06 1.711254e+06 1.626355e+06 4.484496e+04 1.532843e+06 1.747758e+06 1.502721e+06 4.154461e+04 1.507880e+06 1.404465e+06 1.749359e+06 1.534103e+06 2.057436e+06 1.912560e+06 2.510786e+06 1.833876e+06 1.886969e+06 2.478903e+06 1.660837e+06 2.450420e+06 2.259342e+06 3.823264e+06 2.290466e+06 4.122692e+06 2.484367e+06 2.459390e+06 2.126965e+06 1.433109e+06 1.468185e+06 1.820211e+06 1.748485e+06 1.513683e+06 1.372868e+06 2.238124e+06 1.708944e+06 1.953377e+06 1.299961e+06 2.184067e+06 1.745500e+06 1.849057e+06 2.243431e+06 2.808808e+06 1.651630e+06 1.409651e+06 1.395603e+06 1.830989e+06 1.833936e+06 1.721682e+06 2.123275e+06 1.343159e+06 1.489674e+06 1.985132e+06 7.798454e+05 1.980776e+06 1.474243e+06 1.618634e+06 2.026393e+06 2.154342e+06 1.624706e+06 1.637683e+06 2.005940e+06 1.044827e+06 2.298063e+06 1.186129e+06 6.348108e+05 1.117719e+06 1.792207e+06 1.058726e+06 2.261868e+06 2.184325e+06 1.750962e+06 2.406682e+06 9.754953e+05 1.264605e+06 1.793736e+06 8.021112e+05 1.609835e+06 1.255482e+06 1.706025e+06 2.456938e+06 1.526495e+06 1.601334e+06 3.117899e+06 1.334114e+06 1.401007e+06 9.208413e+05 9.586836e+05 1.707576e+06 1.604755e+06 1.303354e+06 1.516129e+06 2.305316e+06 2.115677e+06 3.356831e+06 2.305453e+06 1.150328e+06 1.599827e+06 1.437888e+06 1.523429e+06 1.408578e+06 1.968870e+06 1.784713e+06 9.369959e+05 1.642135e+06 1.852928e+06 1.441078e+06 1.604453e+06 1.885650e+06 1.767032e+06 1.404866e+06 1.450596e+06 1.349556e+06 1.360701e+06 1.093790e+06 1.418902e+06 1.428623e+06 2.758403e+06 1.411610e+06 1.659550e+06 2.148068e+06 1.192187e+06 1.095631e+06 1.984571e+06 2.243886e+06 2.776604e+06 1.444469e+06 1.295308e+06 1.664373e+06 2.149643e+06 2.205325e+06 1.799521e+06 1.565414e+06 1.689870e+06 1.795958e+06 1.361905e+06 1.688188e+06 1.942659e+06 1.584096e+06 2.263358e+06 1.998472e+06 1.706596e+06 1.971279e+06 1.367158e+06 1.335896e+06 1.434358e+06 1.326422e+06 1.214617e+06 1.297676e+06 1.375026e+06 1.732494e+06 1.114143e+06 1.684707e+06 1.477657e+06 1.473631e+06 1.191849e+06 9.780551e+05 2.073963e+06 8.256781e+05 1.307115e+06 1.546545e+06 2.145946e+06 1.755723e+06 1.940605e+06 1.513053e+06 3.011647e+06 2.204587e+06 1.424214e+06 5.212297e+05 1.123944e+06 1.958203e+06 1.452983e+06 1.523842e+06 1.044464e+06 1.699352e+06 1.891545e+06 8.805768e+05 1.061484e+06 1.357876e+06 1.863489e+06 1.138699e+06 1.237560e+06 1.337237e+06 1.958806e+06 1.322310e+06 1.675452e+06 2.100828e+06 1.463555e+06 1.732118e+06 1.191853e+06 1.371307e+06 1.349822e+06 1.394796e+06 1.393339e+06 1.808813e+06 1.202580e+06 1.618035e+06 1.484387e+06 1.611419e+06 2.119762e+06 1.373350e+06 2.004137e+06 1.566744e+06 1.845815e+06 1.999337e+06 1.664853e+06 1.582581e+06 2.058980e+06 1.421752e+06 2.315010e+06 1.304862e+06 1.702152e+06 2.367016e+06 1.250265e+06 1.929862e+06 2.187749e+06 1.527804e+06 1.847088e+06 2.108907e+06 1.481750e+06 1.244925e+06 1.776840e+06 1.889032e+06 1.370153e+06 2.007540e+06 2.685049e+06 C27 H40 N8 O6_13.186 6.197825e+05 1.234343e+06 1.294681e+06 1.387785e+06 5.780171e+04 1.350976e+06 1.255033e+06 1.473114e+06 52192.56 1.146813e+06 1.340092e+06 1.422565e+06 47968.88 1.373187e+06 1.237277e+06 1.342169e+06 4.988934e+04 1.192762e+06 1.169821e+06 1.391959e+06 4.237032e+04 1.463857e+06 1.191471e+06 1.623461e+06 25934.802 1.150957e+06 1.250567e+06 1.152459e+06 3.076051e+04 1.522830e+06 1.270876e+06 1.432170e+06 58489.43 1.311175e+06 1.283407e+06 7.238608e+05 5.522500e+04 1.363189e+06 1.824470e+06 1.358945e+06 5.276474e+04 1.224292e+06 1.389873e+06 1.352783e+06 5.385425e+04 1.173928e+06 1.093840e+06 1.501440e+06 3.566306e+05 4.500525e+04 5.741224e+05 3.155994e+06 5.035863e+05 1.443116e+05 1.971216e+05 6.159580e+04 5.373438e+04 2.725989e+05 6.691390e+05 1.971543e+05 2.279042e+07 8.680794e+05 3.264529e+06 5.641821e+04 4.323596e+05 3.430020e+06 4.030252e+06 2.236242e+06 3.881851e+06 1.591961e+07 2.346503e+05 1.101550e+05 1.203736e+05 2.734680e+05 6.180155e+06 4.508913e+05 4.022189e+06 2.967828e+05 5.145284e+04 1.073787e+05 8.453754e+05 5.606011e+06 1.267224e+05 8.350274e+05 4.432855e+04 1.010948e+05 7.064980e+06 6.523290e+05 4.049267e+05 5.868669e+05 5.013881e+06 1.951184e+06 4.959326e+05 1.604445e+05 2.531023e+06 6.578936e+05 5.987137e+05 3.355806e+06 4.039005e+06 4.767005e+04 3.256990e+06 3.564151e+06 7.092093e+05 6.419791e+04 8.897419e+05 1.734214e+05 2.403658e+05 8.495336e+06 1.779234e+05 2.227653e+06 1.235563e+06 9.279761e+05 1.386681e+07 5.990372e+04 2.498888e+05 7.020321e+06 2.532992e+06 1.418072e+06 1.326653e+07 6.590335e+04 9.426998e+04 1.257199e+06 4.778349e+06 7.340766e+05 1.920394e+05 5.766469e+06 5.310212e+05 1.714241e+05 7.485011e+06 7.699039e+04 5.053962e+04 5.354348e+05 1.054609e+05 9.477690e+04 8.272154e+04 7.509118e+05 5.944752e+04 1.259451e+05 5.296287e+04 3.528237e+04 1.020253e+05 1.566664e+05 1.344565e+05 1.871896e+05 9.195520e+05 4.657968e+05 2.226970e+05 9.867196e+04 5.827280e+05 6.630294e+04 2.123200e+06 5.755986e+04 1.623120e+06 3.258917e+06 1.453320e+07 1.156957e+05 1.468372e+05 4.914591e+04 1.270649e+06 2.815443e+06 3.162839e+05 1.157236e+06 1.617977e+06 1.054744e+05 6.534391e+05 9.090307e+04 1.240750e+06 1.230353e+06 5.763269e+04 7.207277e+06 1.002407e+05 1.607583e+05 7.174049e+05 6.626386e+05 1.204861e+05 3.522435e+05 1.609633e+05 6.000811e+04 2.314497e+05 5.584523e+05 5.701845e+04 9.037379e+05 4.737740e+04 2.047834e+05 5.966825e+05 1.304667e+06 6.159436e+04 8.969502e+04 4.867340e+04 1.474752e+06 6.855465e+04 5.159647e+04 7.386046e+04 5.914631e+04 1.355777e+06 1.812947e+05 5.846113e+04 2.966380e+06 3.791127e+05 1.343045e+05 8.990459e+05 9.503022e+04 5.894516e+04 8.961657e+05 7.837391e+05 1.054214e+06 6.768793e+04 7.659539e+04 5.341908e+04 8.329361e+04 1.651711e+05 4.612680e+04 3.677967e+04 7.727781e+04 1.780906e+06 3.295401e+05 2.704825e+05 2.938627e+05 1.787123e+05 3.363702e+05 5.436800e+04 4.947811e+04 8.875878e+04 1.657551e+05 1.198436e+06 1.243868e+05 1.386886e+05 1.341829e+05 1.067635e+05 2.025281e+06 1.445687e+06 5.756996e+04 6.711742e+04 7.865248e+05 1.630030e+05 6.055736e+04 5.182928e+04 1.356538e+05 4.893853e+04 5.241479e+04 6.674927e+04 1.866817e+05 9.240298e+05 1.503800e+07 7.693358e+05 8.589089e+05 3.818544e+06 5.472842e+05 4.682829e+04 4.616191e+06 4.997329e+04 2.027621e+05 2.586115e+06 4.791590e+05 5.112859e+04 3.508707e+05 9.801572e+04 5.706616e+04 4.822866e+06 1.682325e+06 1.460347e+07 1.483596e+05 C9 H16 N4 O3_13.199 1.669438e+06 1.541231e+06 1.483062e+06 1.500711e+06 3.763806e+04 1.704561e+06 1.630787e+06 1.672733e+06 34800.09 1.474235e+06 1.534154e+06 1.753775e+06 32634.70 1.426486e+06 1.499088e+06 1.726890e+06 3.335869e+04 1.492391e+06 1.557783e+06 1.659430e+06 2.836099e+04 1.344056e+06 1.510730e+06 1.993032e+06 16333.093 1.379888e+06 1.518420e+06 1.476010e+06 1.907133e+04 1.621146e+06 1.562070e+06 1.785066e+06 35740.61 1.589077e+06 1.528292e+06 1.037071e+06 3.660951e+04 1.718768e+06 1.655224e+06 1.770160e+06 3.492972e+04 1.451057e+06 1.687205e+06 1.645949e+06 3.284849e+04 1.462777e+06 1.372723e+06 1.707358e+06 6.972821e+05 7.051612e+05 1.195963e+06 4.006323e+05 2.959687e+06 9.917694e+05 1.200849e+06 2.357432e+06 8.127828e+06 9.203105e+06 1.245037e+06 1.303134e+06 6.152139e+05 2.103140e+06 7.904782e+05 4.872085e+05 6.785283e+05 9.114019e+04 2.179980e+06 5.432086e+06 5.668147e+06 3.351754e+06 5.694276e+06 4.190186e+06 3.853142e+06 6.518846e+05 1.115705e+06 1.447935e+06 4.718505e+05 1.120305e+06 1.485343e+06 7.108698e+05 8.912605e+06 3.835925e+05 4.204885e+05 2.545360e+05 6.266686e+05 5.255752e+05 3.236053e+06 3.822506e+06 3.244128e+05 2.100311e+06 4.034374e+05 9.927117e+05 1.407576e+06 5.655240e+05 1.862315e+06 1.150573e+06 5.312341e+06 3.484663e+06 2.087962e+06 5.253733e+05 5.128115e+06 7.694594e+05 2.590530e+06 4.321256e+06 6.187792e+05 7.181261e+05 3.568851e+06 3.445039e+06 1.244222e+06 5.590143e+05 5.841425e+05 2.265359e+07 2.964788e+06 1.677858e+06 1.570944e+06 9.019071e+05 1.328118e+06 1.434728e+06 2.204789e+06 2.392329e+06 3.559855e+05 6.070145e+06 1.362393e+06 2.977236e+06 2.049834e+06 2.628195e+06 2.063932e+05 3.592612e+05 1.077666e+06 9.055999e+05 1.788506e+06 2.237142e+06 1.967473e+06 2.027201e+06 1.079996e+06 4.134057e+06 1.813867e+06 3.595903e+06 5.957446e+05 9.460519e+05 2.090401e+06 8.263858e+05 1.886090e+06 2.938957e+06 1.379096e+06 2.130804e+06 7.558290e+05 1.898871e+06 1.482613e+06 2.572999e+05 1.139888e+06 3.395464e+06 5.101398e+06 1.065013e+06 2.004931e+06 2.835996e+06 1.012920e+06 1.955431e+05 8.988572e+05 1.175559e+06 1.208626e+06 1.963104e+05 1.383963e+06 6.610507e+05 6.381586e+05 3.387338e+06 9.576144e+05 1.497413e+06 3.109221e+06 2.496363e+06 2.412900e+06 6.783452e+05 1.039204e+06 1.040107e+06 7.639449e+05 4.412466e+05 9.229922e+05 1.788444e+06 2.765279e+06 8.840193e+05 1.095865e+06 9.198544e+05 1.298520e+06 8.962283e+05 1.441274e+06 9.231673e+05 2.748314e+05 7.366343e+05 2.785153e+05 4.440384e+05 6.331628e+06 2.815986e+05 6.884333e+05 4.647130e+06 1.515792e+05 1.207799e+06 1.072332e+06 3.456091e+05 4.651739e+05 8.900628e+05 1.963626e+06 1.775814e+06 1.129352e+06 1.561696e+06 7.302410e+05 6.608584e+05 1.256768e+06 2.370005e+06 3.580809e+05 1.346904e+06 7.399478e+05 1.975548e+05 3.990829e+05 8.066144e+05 6.349374e+05 4.422627e+06 7.766466e+05 1.170209e+06 8.661269e+05 1.647484e+06 1.400005e+06 1.005512e+06 1.362251e+06 5.298679e+05 1.131739e+06 4.042250e+05 5.245105e+05 1.211630e+06 3.450653e+06 1.543380e+06 2.110270e+06 7.126949e+05 1.825858e+06 7.873249e+05 7.629775e+05 3.093645e+05 4.732120e+06 6.178080e+05 9.969382e+05 1.677488e+06 9.313587e+05 3.501396e+05 6.862743e+05 1.969253e+06 1.085008e+06 2.661140e+05 1.481314e+06 3.060194e+05 1.142832e+06 1.300809e+06 1.289944e+06 4.763237e+05 1.698548e+06 5.620240e+05 1.059542e+06 1.175849e+06 1.816823e+05 1.714401e+06 5.221016e+06 2.472020e+05 7.803442e+05 1.759929e+06 "ASYMMETRIC N,N-DIMETHYLARGININE (ADMA)" 1.058565e+07 8.584892e+06 8.472901e+06 9.270223e+06 4.649844e+04 8.693232e+06 9.085835e+06 8.803226e+06 39175.41 7.341831e+06 8.401286e+06 1.122756e+07 33835.92 8.632270e+06 7.928671e+06 8.820874e+06 3.393153e+04 7.832598e+06 9.260068e+06 8.611812e+06 2.759680e+04 7.616691e+06 9.949085e+06 1.069026e+07 17680.176 6.957656e+06 9.139123e+06 8.342697e+06 2.759278e+04 8.166164e+06 8.413710e+06 9.787613e+06 37101.38 9.089962e+06 8.460932e+06 6.642337e+06 3.343378e+04 8.098353e+06 1.126409e+07 9.616625e+06 3.560135e+04 7.897178e+06 9.434899e+06 8.957468e+06 3.563832e+04 7.103365e+06 7.436481e+06 1.022466e+07 8.926872e+06 1.223535e+07 1.115465e+07 1.416716e+07 8.570255e+06 7.079728e+06 1.303306e+07 1.362931e+07 1.026655e+07 1.463120e+07 1.014289e+07 1.713856e+07 1.128135e+07 1.323429e+07 9.729018e+06 1.254452e+07 8.487927e+06 7.356437e+06 1.218388e+07 7.439451e+06 8.356243e+06 9.566648e+06 1.158567e+07 1.335244e+07 1.255675e+07 6.294838e+06 1.319954e+07 9.015078e+06 9.446901e+06 8.959681e+06 1.448553e+07 1.111816e+07 7.787909e+06 1.122134e+07 6.752801e+06 1.075444e+07 9.699373e+06 1.426414e+07 4.552963e+06 1.056262e+07 9.751347e+06 5.316572e+06 1.456708e+07 7.913431e+06 6.823690e+06 9.585984e+06 1.133250e+07 1.207322e+07 1.193579e+07 1.097523e+07 7.189997e+06 9.218277e+06 9.032181e+06 7.225591e+06 9.232118e+06 8.977569e+06 8.294123e+06 7.909504e+06 1.127463e+07 1.191333e+07 1.101976e+07 8.342998e+06 6.296042e+06 9.729840e+06 9.256600e+06 9.737841e+06 1.032132e+07 1.218591e+07 1.219642e+07 7.974843e+06 1.041464e+07 1.407302e+07 1.002628e+07 5.845983e+06 7.342360e+06 8.966349e+06 7.910155e+06 8.486870e+06 8.522012e+06 4.402187e+06 8.101639e+06 9.389638e+06 8.290759e+06 1.497731e+07 7.677236e+06 1.095416e+07 1.069668e+07 6.010302e+06 1.120104e+07 1.056015e+07 1.067397e+07 1.060955e+07 8.542087e+06 1.166139e+07 1.168661e+07 8.965630e+06 1.519792e+07 8.424790e+06 1.030118e+07 9.004435e+06 1.015420e+07 7.200180e+06 8.747648e+06 1.273446e+07 9.537320e+06 6.118344e+06 9.714633e+06 9.450096e+06 1.189548e+07 1.102941e+07 8.460238e+06 7.314009e+06 1.435249e+07 2.127532e+07 1.172593e+07 7.598565e+06 6.852490e+06 1.277578e+07 7.688423e+06 1.142082e+07 1.040081e+07 1.147472e+07 1.058787e+07 1.165030e+07 1.303594e+07 9.848049e+06 6.876581e+06 7.057318e+06 1.349992e+07 7.932015e+06 1.059834e+07 9.271537e+06 5.043535e+06 7.916661e+06 8.746314e+06 6.100904e+06 6.153289e+06 8.668081e+06 8.006048e+06 8.743860e+06 8.471830e+06 9.315550e+06 8.853492e+06 6.793590e+06 1.426283e+07 8.266969e+06 3.794297e+06 9.727730e+06 1.156274e+07 1.004227e+07 8.031178e+06 9.539257e+06 1.160449e+07 7.574654e+06 1.060339e+07 1.094468e+07 4.774120e+06 5.851989e+06 8.376574e+06 8.754413e+06 6.812216e+06 7.425156e+06 8.649657e+06 1.010388e+07 6.616682e+06 1.007171e+07 8.775551e+06 1.222915e+07 7.374998e+06 7.868233e+06 1.095839e+07 9.562535e+06 7.266443e+06 9.900764e+06 1.326617e+07 7.474368e+06 8.330795e+06 7.325182e+06 7.616853e+06 9.182406e+06 9.228270e+06 8.795300e+06 1.051941e+07 7.513261e+06 9.049909e+06 8.933463e+06 1.164515e+07 7.617369e+06 1.163820e+07 1.104346e+07 9.056540e+06 1.040184e+07 1.338828e+07 6.746414e+06 1.029889e+07 9.446203e+06 8.125226e+06 8.704521e+06 1.224884e+07 1.040142e+07 1.022335e+07 1.027582e+07 1.132849e+07 1.382692e+07 1.073890e+07 1.143670e+07 1.280044e+07 9.202305e+06 7.639984e+06 1.304597e+07 1.022609e+07 9.156874e+06 1.295206e+07 1.182664e+07 151.57707_13.273 6.186289e+06 4.498286e+06 4.337623e+06 4.335077e+06 3.569845e+04 4.620324e+06 5.031857e+06 4.868887e+06 38431.52 4.077205e+06 4.633473e+06 5.234692e+06 45559.81 4.258879e+06 4.203489e+06 4.756934e+06 2.990162e+04 4.225281e+06 4.654970e+06 4.641381e+06 2.528407e+04 3.964381e+06 4.550894e+06 5.720622e+06 15590.786 4.038334e+06 4.488451e+06 4.486064e+06 1.673460e+04 4.460337e+06 4.535227e+06 5.027336e+06 33838.81 4.433871e+06 4.936091e+06 2.860320e+06 5.460247e+04 4.665155e+06 5.084424e+06 5.203859e+06 3.413881e+04 4.148631e+06 4.904674e+06 4.921069e+06 3.183573e+04 3.903909e+06 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7.900584e+05 37843.90 8.248897e+05 7.411481e+05 9.083085e+05 36296.76 5.702513e+05 7.541087e+05 8.048843e+05 3.554930e+04 7.361441e+05 7.363584e+05 6.726041e+05 2.828383e+04 6.350436e+05 1.073542e+06 8.491311e+05 17861.185 6.344991e+05 7.814658e+05 6.430321e+05 2.154067e+04 7.689115e+05 7.646844e+05 1.029224e+06 43477.62 6.899594e+05 6.757462e+05 4.518865e+05 4.711033e+04 8.796263e+05 8.035094e+05 8.772564e+05 4.128978e+04 6.921777e+05 8.557359e+05 7.872337e+05 3.930018e+04 7.250494e+05 6.605549e+05 8.230721e+05 1.740785e+05 9.077777e+04 1.498042e+05 5.617874e+06 1.122389e+06 1.515716e+05 1.743606e+05 1.545521e+05 1.072328e+05 1.346514e+05 1.845250e+05 1.201538e+05 9.119248e+06 1.491756e+06 1.169765e+06 1.383055e+05 6.538110e+05 1.849628e+06 1.009950e+06 1.110039e+06 4.536970e+06 1.247889e+07 3.845889e+05 2.960773e+05 1.276110e+05 1.137199e+05 6.603074e+05 5.634192e+05 1.716726e+06 6.950355e+05 1.585329e+05 1.387839e+05 1.229839e+05 2.038864e+06 1.166602e+05 1.523046e+05 1.163188e+05 1.867027e+05 2.469473e+06 1.286333e+06 3.807703e+05 6.445433e+05 2.691219e+06 1.046718e+06 4.935832e+05 1.151593e+05 1.495485e+06 1.310480e+06 3.434704e+05 3.693647e+06 1.269805e+06 1.155077e+05 7.377207e+05 1.056297e+06 3.958425e+05 1.244049e+05 3.078672e+05 1.110915e+05 3.443548e+05 7.765944e+05 8.973127e+04 4.552382e+05 5.140548e+05 1.924851e+06 1.993711e+06 4.417046e+05 6.943159e+05 5.614456e+06 4.831031e+05 2.054997e+05 1.560232e+06 1.357691e+05 9.971327e+04 1.393089e+06 2.949138e+06 1.358454e+06 3.465765e+05 2.111763e+06 1.075374e+06 3.373240e+05 5.004674e+05 9.239609e+04 1.010009e+05 3.111126e+06 1.704017e+05 1.119755e+05 9.290599e+04 6.770904e+05 1.032656e+05 2.846505e+05 9.887106e+04 5.953995e+04 1.126809e+05 3.513078e+05 5.656098e+05 5.750385e+05 1.000473e+06 9.222292e+04 9.786721e+05 1.111614e+05 1.096185e+06 1.079239e+05 3.288900e+06 9.614038e+04 1.869216e+06 2.469154e+06 7.182686e+06 1.634696e+05 1.374357e+05 1.005667e+05 8.646697e+05 1.288880e+06 1.282676e+05 1.894418e+06 2.524196e+06 1.288655e+05 1.701154e+06 1.213844e+05 1.441677e+06 4.921650e+05 1.732105e+05 1.246884e+05 8.946318e+04 1.592489e+05 1.500308e+06 9.747494e+04 1.184546e+05 8.303129e+04 1.481016e+05 1.277686e+05 1.844293e+05 6.529781e+05 7.840451e+04 2.106444e+06 9.284636e+04 1.035881e+05 1.433618e+06 9.589347e+05 9.021264e+04 1.741855e+05 9.162222e+04 2.299919e+06 3.671861e+05 8.512226e+04 1.852197e+05 1.308628e+05 2.421221e+06 9.525134e+04 1.262566e+05 5.025779e+05 4.005146e+05 1.290398e+05 9.351396e+04 6.710313e+04 1.310005e+05 1.633724e+06 9.094099e+04 2.745602e+06 8.733990e+04 7.347012e+04 5.824942e+04 1.655253e+05 1.403161e+05 8.243389e+04 5.344141e+04 1.000303e+05 3.596526e+05 1.019803e+06 1.082522e+06 6.351196e+05 1.510991e+06 3.880675e+05 8.817211e+04 9.975770e+04 1.098840e+05 3.184169e+05 1.546368e+06 1.640525e+06 1.046257e+05 3.424831e+05 8.389662e+04 2.585561e+06 8.099129e+04 8.284255e+04 1.093856e+05 1.357753e+05 7.684392e+04 1.294811e+05 1.086607e+05 1.270063e+05 1.118527e+05 9.767206e+04 9.488751e+04 3.811736e+05 1.657094e+06 4.664540e+06 1.034637e+05 1.005962e+06 5.294144e+05 1.880334e+05 9.576897e+04 4.589778e+06 2.778784e+05 1.278725e+05 2.502739e+06 9.358331e+05 1.373834e+05 1.607708e+06 9.652858e+04 1.204402e+05 1.366422e+06 1.678084e+06 5.645951e+06 1.076991e+05 1-METHYL-L-HISTIDINE 8.145629e+07 5.043193e+07 5.378701e+07 4.427279e+07 6.786620e+04 4.596710e+07 4.829515e+07 5.156623e+07 85948.25 5.063490e+07 4.560602e+07 5.859504e+07 39519.89 4.604496e+07 4.010331e+07 4.953397e+07 5.342029e+04 4.578084e+07 5.455596e+07 4.740791e+07 3.802254e+04 5.034666e+07 4.415962e+07 6.171222e+07 19699.573 4.120071e+07 5.059637e+07 4.253252e+07 2.226260e+04 5.431780e+07 4.925349e+07 5.453258e+07 57886.88 4.943381e+07 4.533977e+07 3.055707e+07 6.714104e+04 5.027420e+07 5.482531e+07 5.726644e+07 3.859023e+04 4.840509e+07 5.259839e+07 5.079571e+07 3.584766e+04 4.093809e+07 4.255908e+07 5.519474e+07 3.850905e+07 4.653893e+07 3.703641e+07 5.049936e+07 5.415940e+07 7.541442e+07 1.231228e+08 5.205590e+07 4.408675e+07 7.937726e+07 1.271700e+08 8.099379e+07 1.721815e+08 1.496580e+08 1.129497e+08 5.574800e+07 4.232849e+07 3.407395e+07 5.717625e+07 7.191398e+07 4.572336e+07 4.369060e+07 4.760739e+07 4.193013e+07 5.327226e+07 5.062114e+07 7.777929e+07 6.750607e+07 6.051204e+07 8.004366e+07 1.539800e+08 9.563279e+07 5.773160e+07 4.334835e+07 6.067793e+07 4.092588e+07 4.950135e+07 5.417894e+07 4.447949e+07 7.675648e+07 4.131613e+07 2.081243e+07 6.836191e+07 5.091324e+07 4.221601e+07 5.493940e+07 5.188717e+07 6.986173e+07 6.216800e+07 6.959011e+07 2.843154e+07 1.007016e+08 5.374000e+07 3.987621e+07 6.057836e+07 1.179235e+08 6.175188e+07 4.707226e+07 5.956876e+07 3.912385e+07 7.624800e+07 4.234746e+07 2.196001e+07 4.408814e+07 4.629113e+07 4.089913e+07 4.256320e+07 5.346132e+07 5.088548e+07 1.341930e+08 4.377678e+07 8.193010e+07 7.306527e+07 4.931573e+07 1.489536e+07 2.136381e+07 1.997608e+07 3.413081e+07 3.937265e+07 5.701968e+07 7.841794e+07 7.895659e+07 1.015283e+08 5.074076e+07 2.356999e+07 6.049805e+07 6.966634e+07 4.875013e+07 4.154694e+07 4.073638e+07 3.738382e+07 3.881123e+07 9.960122e+07 6.046461e+07 9.937948e+07 4.975228e+07 4.226269e+07 3.851323e+07 2.455136e+07 4.270340e+07 3.846509e+07 4.442448e+07 2.311853e+07 4.362416e+07 6.671745e+07 1.012059e+08 5.739152e+07 3.303963e+07 7.481134e+07 3.615733e+07 3.500439e+07 6.299680e+07 4.217275e+07 6.917671e+07 3.976534e+07 5.118038e+07 5.422058e+07 8.208033e+07 9.263979e+07 5.246148e+07 6.341432e+07 4.308094e+07 8.357325e+07 4.829440e+07 5.607530e+07 4.739210e+07 6.402103e+07 4.259140e+07 5.787689e+07 7.921592e+07 8.289235e+07 4.472534e+07 3.137599e+07 4.227977e+07 5.403944e+07 4.248027e+07 5.517020e+07 4.904726e+07 4.547893e+07 4.696308e+07 8.825348e+07 5.614917e+07 3.681745e+07 5.953277e+07 1.140608e+08 6.032537e+07 3.529213e+07 5.318444e+07 9.734785e+07 7.330423e+07 6.673536e+07 9.128143e+07 3.809957e+07 7.238654e+07 6.374357e+07 8.278165e+07 2.448018e+07 3.884414e+07 2.990852e+07 3.554227e+07 6.100723e+07 2.685391e+07 6.804002e+07 3.925001e+07 3.075802e+07 5.857138e+07 5.056546e+07 6.234038e+07 4.436062e+07 3.323042e+07 5.196091e+07 5.351149e+07 2.847316e+07 5.316112e+07 6.377017e+07 6.178649e+07 6.628629e+07 5.016620e+07 3.313390e+07 4.345100e+07 5.228694e+07 5.181656e+07 6.679338e+07 2.810275e+07 3.700251e+07 4.672611e+07 6.305539e+07 4.633813e+07 6.156801e+07 5.650368e+07 3.887471e+07 4.398237e+07 6.490900e+07 4.489566e+07 4.678389e+07 7.796615e+07 5.497477e+07 3.891993e+07 4.933132e+07 6.361574e+07 8.728672e+07 5.319744e+07 5.049994e+07 6.493223e+07 4.439734e+07 5.921817e+07 7.463197e+07 6.270111e+07 4.067777e+07 5.357666e+07 5.689134e+07 5.199724e+07 9.290587e+07 6.568094e+07 HISTIDINE 1.433559e+09 1.053313e+09 1.055140e+09 1.080287e+09 1.753852e+06 1.096313e+09 1.114661e+09 1.148791e+09 2403646.57 9.740387e+08 1.160924e+09 1.191746e+09 2429554.74 9.810351e+08 9.815484e+08 1.174713e+09 2.656912e+05 1.073628e+09 1.057840e+09 1.122371e+09 8.245291e+05 9.579111e+08 1.010642e+09 1.386644e+09 175355.780 9.533751e+08 1.013776e+09 1.140190e+09 4.059601e+05 1.047468e+09 1.038522e+09 1.246145e+09 572864.65 1.096073e+09 1.105850e+09 6.382923e+08 6.390174e+05 1.152621e+09 1.171575e+09 1.195858e+09 6.801141e+05 1.051800e+09 1.161265e+09 1.112996e+09 7.160104e+05 9.849985e+08 1.001215e+09 1.146428e+09 9.787680e+08 1.037570e+09 1.297224e+09 1.522240e+09 1.584402e+09 1.512758e+09 1.593760e+09 1.761140e+09 1.104671e+09 1.957798e+09 2.145002e+09 1.310977e+09 1.633369e+09 1.501826e+09 1.320357e+09 1.502292e+09 1.053292e+09 1.151270e+09 1.523934e+09 1.014829e+08 1.293780e+09 1.046613e+09 1.053644e+09 1.620715e+09 1.344460e+09 9.211557e+08 1.405071e+09 1.166439e+09 1.523596e+09 1.473391e+09 2.225381e+09 1.518203e+09 1.036700e+09 9.832941e+08 1.198834e+09 1.217652e+09 1.235678e+09 1.685366e+09 1.158147e+09 1.025044e+09 1.120440e+09 6.532530e+08 1.233207e+09 1.223040e+09 1.138177e+09 1.390274e+09 1.140386e+09 1.374200e+09 1.375410e+09 1.357835e+09 6.464384e+08 1.371089e+09 1.241956e+09 5.132275e+08 1.133832e+09 1.265172e+09 1.166906e+09 1.239498e+09 1.414483e+09 1.191091e+09 9.684033e+08 6.641965e+08 9.243277e+08 9.677708e+08 5.903005e+08 1.006662e+09 8.214112e+08 1.219774e+09 1.450839e+09 1.223751e+09 1.376179e+09 1.367579e+09 1.048251e+09 1.089182e+09 9.274093e+08 6.659968e+08 1.073873e+09 9.820970e+08 8.022832e+08 9.590372e+08 1.118989e+09 1.047434e+09 1.297021e+09 1.662774e+09 9.402805e+08 1.396846e+09 1.097368e+09 8.752008e+08 1.043358e+09 1.161142e+09 1.228985e+09 7.506106e+08 1.159309e+09 1.147245e+09 1.122915e+09 1.145580e+09 1.056060e+09 9.775718e+08 9.433187e+08 1.320734e+09 1.196530e+09 1.093981e+09 9.353116e+08 1.006359e+09 1.211711e+09 1.281948e+09 1.566602e+09 1.155055e+09 1.446831e+09 7.563167e+08 6.850135e+08 9.913541e+08 1.369993e+09 1.189929e+09 9.503132e+08 1.237772e+09 1.053054e+09 1.537133e+09 1.333516e+09 1.133746e+09 1.377461e+09 1.290843e+09 1.053846e+09 1.069648e+09 1.688123e+09 1.220366e+09 1.099846e+09 9.093670e+08 1.723758e+09 1.186141e+09 1.351302e+09 1.123403e+09 5.255258e+08 8.891206e+08 1.232285e+09 7.777500e+08 7.642242e+08 1.188079e+09 1.026173e+09 1.073654e+09 1.106708e+09 1.245244e+09 8.682952e+08 1.023296e+09 8.294378e+08 1.288938e+09 5.290330e+08 1.134225e+09 1.488324e+09 8.970591e+08 1.114826e+09 1.167912e+09 1.017486e+09 6.857274e+08 1.472518e+09 1.479684e+09 4.172317e+08 1.039416e+09 1.047244e+09 7.812061e+08 6.341428e+08 6.654282e+08 1.462821e+09 1.036074e+09 6.029713e+08 1.041470e+09 8.370776e+08 1.274916e+09 8.238234e+08 9.674772e+08 1.220158e+09 1.225040e+09 1.003447e+09 1.209743e+09 1.272422e+09 9.992577e+08 1.041277e+09 8.954690e+08 1.033781e+09 1.036296e+09 1.072140e+09 1.332136e+09 9.926506e+08 8.052024e+08 1.103888e+09 1.142219e+09 8.778208e+08 1.032913e+09 1.236931e+09 1.409113e+09 7.949270e+08 8.639566e+08 1.295865e+09 8.464654e+08 1.041382e+09 1.371158e+09 1.252386e+09 1.206058e+09 1.183942e+09 1.029059e+09 1.130525e+09 1.124836e+09 1.165433e+09 1.739016e+09 1.346375e+09 1.314119e+09 1.262559e+09 1.148409e+09 1.108451e+09 1.181974e+09 1.298355e+09 8.759346e+08 1.521811e+09 1.333049e+09 C4 H3 N9_13.814 5.517959e+06 5.184665e+06 5.371861e+06 5.017165e+06 1.646810e+04 5.616274e+06 4.659893e+06 5.624451e+06 22328.77 5.482577e+06 6.362091e+06 4.293224e+06 27638.43 4.967177e+06 4.771618e+06 5.155804e+06 3.527881e+04 5.541661e+06 5.212092e+06 5.509034e+06 3.237804e+04 5.822046e+06 3.175529e+06 6.223048e+06 19949.540 5.907403e+06 4.743237e+06 5.584042e+06 2.558705e+04 6.195301e+06 4.043115e+06 6.294548e+06 40858.40 5.626619e+06 3.693507e+06 3.671780e+06 4.519292e+04 6.985805e+06 6.080532e+06 5.315442e+06 4.724703e+04 5.112208e+06 4.468711e+06 4.717542e+06 4.715043e+04 6.248649e+06 5.124863e+06 5.337479e+06 4.725045e+06 4.258468e+06 6.354186e+06 2.291258e+06 5.967314e+06 3.531732e+06 6.623178e+06 7.308687e+06 2.334918e+06 6.466821e+06 5.311455e+06 5.090653e+06 5.264084e+06 7.075871e+06 4.777825e+06 8.029459e+06 5.673252e+06 5.966501e+06 6.269509e+06 5.495972e+06 5.770395e+06 3.159294e+06 4.839686e+06 7.368531e+06 6.785475e+06 4.144824e+06 3.722836e+06 5.509032e+06 6.444693e+06 4.191419e+06 7.012948e+06 4.665486e+06 4.074694e+06 4.996172e+06 4.909840e+06 4.042234e+06 4.778211e+06 7.844374e+06 6.802576e+06 5.681898e+06 5.172868e+06 3.754284e+06 5.012857e+06 6.522187e+06 3.245782e+06 7.045063e+06 6.180701e+06 5.328525e+06 5.171881e+06 5.848197e+06 3.324015e+06 6.241381e+06 3.717282e+06 2.859755e+06 4.476542e+06 4.963404e+06 4.886333e+06 5.717063e+06 4.070819e+06 4.200094e+06 3.350769e+06 3.642316e+06 3.999965e+06 4.215687e+06 3.185896e+06 5.632519e+06 6.804751e+06 5.752626e+06 5.845747e+06 5.042089e+06 5.447739e+06 3.940923e+06 5.218717e+06 6.005083e+06 5.057807e+06 2.960885e+06 3.584860e+06 4.969924e+06 3.464061e+06 5.060440e+06 7.823322e+06 6.383703e+06 5.640471e+06 3.546750e+06 5.694516e+06 5.212716e+06 4.596496e+06 4.567593e+06 5.317529e+06 5.965289e+06 5.426194e+06 4.261346e+06 5.882409e+06 4.275602e+06 3.651657e+06 4.923956e+06 3.993380e+06 4.656049e+06 5.370700e+06 3.145168e+06 6.091628e+06 4.588781e+06 3.492284e+06 3.701162e+06 3.668344e+06 4.283562e+06 6.022269e+06 5.003312e+06 5.118712e+06 3.040171e+06 2.961724e+06 3.250980e+06 6.007579e+06 4.004658e+06 3.387202e+06 5.224802e+06 2.414516e+06 5.673431e+06 6.007988e+06 6.030552e+06 7.222263e+06 7.278232e+06 6.526458e+06 4.545950e+06 6.478240e+06 5.502150e+06 4.978146e+06 5.887827e+06 7.031128e+06 4.770213e+06 3.805482e+06 5.447242e+06 3.430100e+06 4.950507e+06 5.894592e+06 4.439825e+06 3.859510e+06 5.519211e+06 4.699616e+06 4.837137e+06 5.052728e+06 7.208979e+06 3.796516e+06 7.006931e+06 1.464920e+06 3.741918e+06 2.777840e+06 5.549959e+06 6.746362e+06 4.649901e+06 5.265065e+06 5.082603e+06 6.009668e+06 3.271399e+06 4.077465e+06 5.263689e+06 1.980114e+06 4.202871e+06 4.469040e+06 3.820628e+06 2.934811e+06 2.980941e+06 4.490987e+06 4.697717e+06 4.235492e+06 4.383697e+06 4.842257e+06 5.668365e+06 4.537940e+06 5.278124e+06 5.200914e+06 4.636894e+06 5.367108e+06 5.516484e+06 5.343865e+06 4.385105e+06 3.155384e+06 4.667924e+06 6.725481e+06 5.360977e+06 5.239219e+06 6.461530e+06 4.160107e+06 4.424350e+06 4.160520e+06 5.633010e+06 3.915425e+06 4.810291e+06 4.467956e+06 5.113455e+06 4.293337e+06 4.540102e+06 5.044224e+06 4.444237e+06 5.067449e+06 4.364603e+06 5.094064e+06 5.064709e+06 4.565079e+06 4.231923e+06 4.870562e+06 4.166725e+06 6.202037e+06 4.276089e+06 5.746356e+06 6.419367e+06 5.494894e+06 5.187819e+06 5.194229e+06 5.709136e+06 5.419406e+06 3.999056e+06 5.866856e+06 6.569081e+06 3-METHYL-L-HISTIDINE 1.639306e+08 1.382759e+08 1.328505e+08 1.476986e+08 1.283207e+05 1.449012e+08 1.497791e+08 1.546048e+08 130512.95 1.257951e+08 1.455251e+08 1.665452e+08 151106.58 1.317675e+08 1.339010e+08 1.463812e+08 6.418258e+04 1.496823e+08 1.397547e+08 1.359504e+08 1.290523e+05 1.210891e+08 1.330485e+08 1.993800e+08 47863.341 1.274115e+08 1.346363e+08 1.446318e+08 3.924421e+04 1.365963e+08 1.382791e+08 1.616053e+08 81216.76 1.429669e+08 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3.509512e+06 1.139479e+07 7.174628e+06 4.517859e+06 5.925322e+06 4.839379e+06 2.718179e+06 6.720173e+06 6.861303e+06 6.547882e+06 5.812405e+06 8.829711e+06 9.323410e+06 9.511298e+06 9.568857e+06 4.787617e+06 6.579986e+06 1.329365e+07 7.365058e+06 9.513895e+06 9.260225e+06 1.002867e+07 4.934159e+06 1.125848e+07 5.612760e+06 5.227787e+06 5.808556e+06 6.381928e+06 1.857862e+07 7.428275e+06 9.145934e+06 9.987206e+06 9.084536e+06 1.368914e+07 1.039234e+07 6.055004e+06 8.735159e+06 2.554151e+06 5.377003e+06 1.605221e+07 8.797237e+06 2.242506e+06 1.564060e+07 9.239801e+06 1.723447e+06 4.724223e+06 1.265302e+07 2.397431e+07 1.855880e+07 3.613030e+06 2.603501e+07 6.681391e+06 7.144478e+06 1.138640e+07 6.275398e+06 1.375325e+07 5.907786e+06 1.616262e+07 6.221296e+06 1.240415e+07 4.500286e+06 C7 H16 N4 O2_14.213 8.307285e+06 6.021651e+06 6.131006e+06 5.716176e+06 6.171863e+04 6.833509e+06 7.175649e+06 6.555456e+06 57764.34 5.434103e+06 5.790525e+06 8.469711e+06 54112.38 5.395105e+06 5.513832e+06 6.599453e+06 5.570340e+04 6.002387e+06 6.140393e+06 6.627536e+06 5.196226e+04 5.815521e+06 5.674293e+06 8.556217e+06 33421.598 5.127362e+06 5.826482e+06 6.051237e+06 3.740317e+04 6.482544e+06 6.719163e+06 7.163628e+06 63002.40 6.127330e+06 6.439114e+06 4.492713e+06 6.803535e+04 5.047818e+06 6.874033e+06 7.010047e+06 6.050904e+04 6.946096e+06 6.576007e+06 6.425521e+06 5.773288e+04 5.697700e+06 5.613549e+06 6.752153e+06 9.605696e+06 7.065474e+06 3.957913e+06 3.340853e+07 1.936821e+07 5.243084e+06 1.130904e+07 1.336754e+07 4.484753e+06 9.365372e+06 1.225855e+07 7.823172e+06 1.406171e+07 1.216937e+07 6.503973e+06 1.171132e+07 3.207560e+06 7.182288e+06 9.441187e+06 9.243028e+06 7.179019e+06 4.335405e+06 3.317818e+06 9.691435e+06 4.010542e+06 6.189089e+06 8.806681e+06 6.262299e+06 5.380235e+06 8.324209e+06 1.025784e+07 7.940347e+06 2.906359e+06 1.201401e+07 6.631932e+06 7.914294e+06 5.548235e+06 8.600512e+06 8.434740e+06 7.737117e+06 4.086649e+06 4.963136e+06 7.002847e+06 8.134457e+06 5.818407e+06 5.831629e+06 9.379471e+06 7.878095e+06 5.347720e+06 1.325460e+07 4.911628e+06 8.660362e+06 5.442844e+06 5.441610e+06 5.360876e+06 8.136761e+06 5.621345e+06 6.819807e+06 3.775135e+06 1.036236e+07 5.812062e+06 3.218246e+06 4.634839e+06 4.389229e+06 4.743011e+06 4.116751e+06 4.882347e+06 7.217222e+06 3.984368e+06 1.538857e+07 7.099901e+06 8.982853e+06 1.215428e+07 8.408761e+06 3.630559e+06 2.584648e+06 5.818840e+06 4.262653e+06 5.287865e+06 5.915972e+06 9.732567e+06 1.674643e+07 9.036515e+06 1.114218e+07 5.719115e+06 6.079154e+06 6.059578e+06 2.527228e+06 2.980940e+06 1.131264e+07 8.275801e+06 5.632009e+06 5.189870e+06 4.093596e+06 8.303604e+06 3.478993e+06 5.030262e+06 4.490291e+06 7.275258e+06 6.692145e+06 5.748653e+06 6.021120e+06 4.542000e+06 5.925365e+06 5.620069e+06 1.271201e+07 7.416359e+06 4.951167e+06 1.001931e+07 3.523476e+06 1.019882e+07 3.066009e+06 5.916978e+06 1.082514e+07 1.583347e+07 1.571925e+07 8.260529e+06 4.722603e+06 7.736716e+06 1.102763e+07 5.277035e+06 9.784117e+06 6.225892e+06 6.082860e+06 9.754911e+06 1.404595e+07 6.100768e+06 4.990894e+06 1.050380e+07 5.581253e+06 6.559450e+06 6.133778e+06 4.080634e+06 7.263364e+06 9.970148e+06 5.326874e+06 9.231047e+06 6.623747e+06 4.456518e+06 4.557837e+06 9.053894e+06 7.646217e+06 2.927483e+06 6.249556e+06 7.508549e+06 5.038843e+06 3.599815e+06 8.618935e+06 7.718873e+06 7.527314e+06 9.543722e+06 1.070357e+07 5.837436e+06 2.298139e+06 9.574590e+06 5.581548e+06 2.259073e+06 4.967812e+06 3.441418e+06 2.305519e+06 5.847734e+06 4.698747e+06 5.615181e+06 5.408655e+06 7.589039e+06 6.891870e+06 7.070475e+06 7.286270e+06 4.283154e+06 4.313326e+06 1.138448e+07 5.533496e+06 7.211718e+06 7.377409e+06 7.427459e+06 5.249025e+06 9.655863e+06 5.075256e+06 4.701102e+06 4.607521e+06 5.731349e+06 1.356670e+07 6.735060e+06 7.053977e+06 6.734914e+06 7.034487e+06 1.069415e+07 6.989614e+06 4.829615e+06 6.914722e+06 1.939250e+06 4.462720e+06 1.337854e+07 6.484954e+06 2.109687e+06 1.051810e+07 8.798878e+06 1.887765e+06 3.554514e+06 9.419601e+06 1.948011e+07 1.677557e+07 2.855383e+06 1.916246e+07 4.595688e+06 5.006287e+06 7.985413e+06 4.808178e+06 1.015826e+07 4.828123e+06 1.273994e+07 5.591405e+06 9.029711e+06 3.679661e+06 80.06054_14.241 3.958739e+07 1.644319e+07 1.580624e+07 1.625473e+07 6.518148e+04 1.670875e+07 1.592197e+07 1.590930e+07 60245.79 1.555918e+07 1.733263e+07 1.855978e+07 54781.97 1.522470e+07 1.536816e+07 1.762809e+07 5.610161e+04 1.486685e+07 1.607664e+07 1.734881e+07 8.264278e+04 1.464794e+07 1.459501e+07 2.145103e+07 34961.442 1.356518e+07 1.582156e+07 1.678540e+07 3.875327e+04 1.554266e+07 1.617718e+07 1.869754e+07 89550.42 1.632881e+07 1.645814e+07 9.743491e+06 7.015434e+04 1.751779e+07 1.755674e+07 1.818684e+07 5.667504e+04 1.567871e+07 1.783300e+07 1.633126e+07 5.566507e+04 1.512427e+07 1.465972e+07 1.741757e+07 3.645423e+06 7.790486e+06 7.481797e+06 8.402390e+06 5.628035e+06 1.607456e+07 2.940069e+07 1.770715e+07 1.184522e+07 2.176637e+07 1.712648e+08 6.766725e+06 1.706791e+07 1.132252e+07 1.970229e+07 1.959997e+07 6.705186e+06 6.306187e+06 1.664283e+07 3.738145e+06 5.459540e+06 4.706388e+06 1.767435e+07 1.172421e+07 1.401330e+07 2.104056e+07 8.142960e+06 1.659156e+07 2.858368e+07 1.319800e+07 1.734175e+07 2.057346e+07 5.733105e+06 7.310372e+06 2.796802e+07 9.120184e+06 1.133171e+07 9.842966e+07 9.032458e+06 1.296621e+07 3.146548e+07 1.502515e+07 1.683386e+07 1.035946e+07 5.161010e+06 1.974538e+07 1.164489e+07 7.840012e+06 9.637035e+06 1.767712e+07 1.816847e+07 3.012800e+07 1.215697e+07 7.819737e+06 1.048981e+07 1.476061e+07 8.435380e+06 1.456286e+07 6.532827e+07 1.488753e+07 2.423444e+08 9.853229e+06 1.193897e+07 7.835078e+06 2.836173e+07 1.218376e+07 1.214590e+07 9.906599e+06 1.665966e+07 1.178489e+07 2.008656e+07 1.016985e+07 3.074222e+07 7.307438e+06 8.203613e+06 1.329982e+07 1.450779e+07 2.165752e+07 1.553844e+07 8.318435e+06 8.997786e+06 8.948906e+06 6.768031e+06 2.667584e+07 7.505153e+06 1.756120e+07 6.822992e+06 1.448311e+07 1.031484e+07 9.187236e+06 1.018921e+07 1.667007e+07 1.020114e+07 2.527156e+07 1.398450e+07 1.503925e+07 1.318601e+07 5.462992e+06 1.594668e+07 1.127830e+07 1.371552e+07 1.217894e+07 3.770587e+06 1.389629e+07 2.685203e+07 1.430193e+07 1.018986e+07 1.578485e+07 1.191485e+07 1.091977e+07 1.002017e+07 1.579050e+07 1.093562e+07 2.477225e+07 6.532158e+06 4.481912e+06 2.404006e+07 1.587327e+07 1.740678e+07 9.481383e+06 8.372604e+07 1.222778e+07 1.022380e+07 1.194421e+07 2.615519e+07 6.411076e+06 2.144305e+07 8.926486e+07 1.714507e+07 2.476809e+07 8.778947e+06 2.439006e+07 1.101815e+07 5.899374e+06 4.431874e+06 1.284329e+07 1.509442e+07 2.313840e+07 8.754624e+06 1.862111e+07 1.289207e+07 1.471848e+07 1.581147e+07 2.027277e+07 2.416182e+07 8.500196e+06 4.232321e+06 6.322593e+07 2.804837e+07 1.308339e+07 3.544302e+06 1.405905e+07 4.834579e+07 6.343773e+06 7.917153e+07 3.052799e+07 7.780496e+06 1.381982e+07 2.771721e+07 1.663543e+07 1.291678e+07 8.766326e+06 1.267785e+07 4.534018e+07 3.482434e+06 9.701885e+06 1.393228e+07 6.548172e+06 2.190347e+07 4.366230e+06 5.908527e+06 2.083319e+07 6.730304e+06 1.463398e+07 1.608353e+07 1.305120e+07 8.513005e+06 4.615640e+06 1.934271e+07 7.831834e+06 1.225939e+07 7.771621e+06 9.555989e+07 1.140765e+07 1.370215e+07 7.782030e+06 1.558323e+07 1.042759e+07 1.214770e+07 2.693992e+07 1.600104e+07 7.422943e+06 3.812346e+07 5.038802e+06 1.524991e+07 1.303858e+07 7.110330e+07 2.471030e+07 1.987760e+07 1.444785e+07 1.039824e+07 6.982625e+06 1.960616e+07 1.762150e+07 8.131210e+06 1.898685e+07 7.560054e+06 1.142471e+07 1.356479e+07 8.922674e+06 1.086797e+07 1.845756e+07 2.505344e+07 2.122985e+07 N6-METHYLLYSINE_14.242 3.326265e+07 1.403304e+07 1.343150e+07 1.409587e+07 3.387760e+04 1.419657e+07 1.323934e+07 1.339607e+07 31623.17 1.349089e+07 1.475845e+07 1.578685e+07 28685.09 1.300381e+07 1.305762e+07 1.505718e+07 2.911557e+04 1.251473e+07 1.382670e+07 1.484111e+07 2.370362e+04 1.249932e+07 1.237561e+07 1.837987e+07 17941.204 1.142531e+07 1.354778e+07 1.417882e+07 1.982846e+04 1.312839e+07 1.381833e+07 1.605861e+07 31648.64 1.400207e+07 1.387359e+07 8.292841e+06 3.098760e+04 1.502231e+07 1.488515e+07 1.547485e+07 3.839909e+04 1.330375e+07 1.511876e+07 1.408757e+07 2.792032e+04 1.291018e+07 1.237163e+07 1.486130e+07 3.111892e+06 6.683024e+06 6.318182e+06 7.156261e+06 4.796867e+06 1.373879e+07 2.533867e+07 1.502661e+07 1.010651e+07 1.853218e+07 1.472893e+08 5.725506e+06 1.460266e+07 9.637257e+06 1.664856e+07 1.588047e+07 5.697882e+06 5.352759e+06 1.410750e+07 3.211602e+06 4.645247e+06 4.034487e+06 1.515465e+07 1.001324e+07 1.180408e+07 1.785143e+07 6.968247e+06 1.422956e+07 2.432596e+07 1.111045e+07 1.485728e+07 1.744120e+07 4.951935e+06 6.055210e+06 2.383298e+07 7.782991e+06 9.649280e+06 1.843557e+07 7.767899e+06 1.115835e+07 2.690058e+07 1.274848e+07 1.440650e+07 8.643926e+06 4.392828e+06 1.673516e+07 9.834621e+06 6.586577e+06 8.215845e+06 1.523687e+07 1.563048e+07 2.602529e+07 1.037498e+07 6.661226e+06 8.952380e+06 1.283390e+07 7.204881e+06 1.234679e+07 5.584886e+07 1.266834e+07 2.093032e+08 8.393828e+06 1.019388e+07 6.587207e+06 2.409043e+07 1.042766e+07 1.041103e+07 8.112413e+06 1.413704e+07 9.941690e+06 1.708452e+07 8.627596e+06 2.636674e+07 6.290786e+06 7.092615e+06 1.124724e+07 1.235337e+07 1.848800e+07 1.329004e+07 7.091090e+06 7.806350e+06 7.605565e+06 5.785526e+06 2.287200e+07 6.461725e+06 1.487229e+07 5.904502e+06 1.234155e+07 8.718460e+06 7.738818e+06 8.695248e+06 1.423855e+07 8.771490e+06 2.154018e+07 1.201340e+07 1.286496e+07 1.117220e+07 4.679592e+06 1.375889e+07 9.646699e+06 1.174896e+07 1.046900e+07 3.223811e+06 1.187939e+07 2.337367e+07 1.206264e+07 8.640661e+06 1.358576e+07 1.026968e+07 9.350585e+06 8.479288e+06 1.347672e+07 9.431825e+06 2.144838e+07 5.628687e+06 3.779272e+06 2.031932e+07 1.353250e+07 1.501145e+07 8.111596e+06 7.212253e+07 1.052750e+07 8.715804e+06 1.010253e+07 2.247206e+07 5.437222e+06 1.822054e+07 7.707039e+07 1.475008e+07 2.104138e+07 7.544675e+06 2.076470e+07 9.372647e+06 5.088438e+06 3.814796e+06 1.105493e+07 1.253721e+07 1.959785e+07 7.517630e+06 1.569477e+07 1.077166e+07 1.225637e+07 1.350353e+07 1.730404e+07 2.198372e+07 6.998609e+06 3.573192e+06 5.398403e+07 2.461385e+07 1.112354e+07 3.014758e+06 1.207780e+07 4.156944e+07 5.373518e+06 6.764294e+07 2.626922e+07 6.586171e+06 1.179060e+07 2.373497e+07 1.439354e+07 1.115807e+07 7.431003e+06 1.089749e+07 3.884490e+07 2.999163e+06 8.240225e+06 1.170928e+07 5.598006e+06 1.850793e+07 3.786907e+06 5.084183e+06 1.760350e+07 5.751843e+06 1.253587e+07 1.352213e+07 1.112669e+07 7.263262e+06 4.002060e+06 1.646161e+07 6.719151e+06 1.041037e+07 6.416196e+06 8.192123e+07 9.600747e+06 1.142855e+07 6.604171e+06 1.332756e+07 8.867651e+06 1.031714e+07 2.265170e+07 1.360220e+07 6.333390e+06 3.218795e+07 4.317959e+06 1.301094e+07 1.105297e+07 6.129073e+07 2.155789e+07 1.687604e+07 1.239333e+07 8.778266e+06 5.919854e+06 1.669029e+07 1.502623e+07 6.953546e+06 1.633865e+07 6.636624e+06 9.794699e+06 1.165154e+07 7.523855e+06 9.344696e+06 1.582766e+07 2.154753e+07 1.806925e+07 "N~6~,N~6~-Dimethyllysine_14.257" 5.860775e+06 2.453591e+06 2.266647e+06 2.494922e+06 3.256234e+04 2.517569e+06 2.556377e+06 2.671195e+06 29291.19 2.242506e+06 2.242750e+06 2.946815e+06 25054.94 2.288513e+06 2.573656e+06 2.566955e+06 2.399711e+04 2.150980e+06 2.504200e+06 2.224529e+06 1.968469e+04 2.349989e+06 2.536979e+06 3.235474e+06 14887.997 1.981532e+06 2.448442e+06 2.387669e+06 1.736871e+04 2.312836e+06 2.647835e+06 2.963559e+06 29066.52 2.359579e+06 2.102806e+06 1.723253e+06 2.837572e+04 2.424748e+06 2.856693e+06 2.807120e+06 2.515144e+04 2.252009e+06 2.810311e+06 2.575181e+06 2.473727e+04 2.075931e+06 2.239581e+06 2.640301e+06 1.385954e+06 2.866350e+06 1.574271e+06 2.404421e+06 1.642711e+06 1.921944e+06 3.951104e+06 3.373725e+06 2.591494e+06 3.467978e+06 2.250082e+07 2.771589e+06 3.904974e+06 3.715247e+06 3.028001e+06 3.768576e+06 1.632172e+06 1.167986e+06 2.515577e+06 1.534060e+06 1.349870e+06 1.683528e+06 3.070462e+06 2.579701e+06 2.789987e+06 2.376805e+06 2.577010e+06 2.849652e+06 3.080127e+06 2.062272e+06 3.432570e+06 2.497642e+06 1.540687e+06 1.877765e+06 6.209646e+06 2.020266e+06 1.645930e+06 1.176202e+07 1.325056e+06 2.967305e+06 4.556798e+06 2.431358e+06 3.322543e+06 1.568977e+06 1.486238e+06 2.946683e+06 2.456630e+06 2.448590e+06 2.566485e+06 2.345968e+06 2.860153e+06 2.768153e+06 2.503114e+06 1.666727e+06 1.822329e+06 2.843107e+06 1.608853e+06 2.902755e+06 5.650749e+06 3.127691e+06 3.634410e+07 2.617612e+06 1.339103e+06 2.718933e+06 3.982969e+06 2.312634e+06 1.910845e+06 1.300852e+06 3.184898e+06 2.595049e+06 3.596842e+06 5.003324e+06 4.072530e+06 1.360537e+06 1.323414e+06 2.088014e+06 1.705833e+06 2.654543e+06 2.558522e+06 1.225478e+06 3.409509e+06 1.646108e+06 2.028210e+06 3.049854e+06 1.715444e+06 3.287701e+06 1.822444e+06 1.889403e+06 2.024998e+06 1.539949e+06 1.454499e+06 2.544649e+06 2.258275e+06 3.086938e+06 2.552836e+06 2.321742e+06 2.764763e+06 1.580371e+06 1.785002e+06 2.002586e+06 1.997577e+06 1.623066e+06 1.092717e+06 2.208494e+06 4.386540e+06 4.149146e+06 1.960103e+06 2.640779e+06 2.475244e+06 2.284166e+06 1.564244e+06 2.569957e+06 2.317166e+06 7.598546e+06 1.784199e+06 1.447870e+06 2.403905e+06 2.487045e+06 2.188534e+06 1.903134e+06 7.954652e+06 2.212340e+06 1.721975e+06 2.161280e+06 3.387570e+06 1.848703e+06 2.681418e+06 7.259596e+06 3.124752e+06 2.505762e+06 2.266060e+06 2.595193e+06 1.065457e+06 1.286314e+06 9.631857e+05 2.266087e+06 1.826820e+06 2.392186e+06 1.302426e+06 2.727715e+06 2.375894e+06 1.794901e+06 2.250132e+06 2.167361e+06 5.606751e+06 1.768707e+06 9.041691e+05 6.894633e+06 8.275674e+06 2.545331e+06 1.416097e+06 2.703420e+06 7.321349e+06 2.528067e+06 8.757273e+06 3.442516e+06 9.841578e+05 2.532623e+06 2.939391e+06 2.234454e+06 1.866114e+06 1.333170e+06 1.755812e+06 3.389963e+06 1.292150e+06 1.821806e+06 1.491969e+06 1.857946e+06 2.244815e+06 1.042913e+06 1.552156e+06 2.724190e+06 1.431573e+06 2.872769e+06 3.355461e+06 1.426439e+06 1.682312e+06 1.327828e+06 2.556357e+06 1.981095e+06 2.198250e+06 1.544086e+06 1.218348e+07 1.535203e+06 2.340783e+06 1.684485e+06 2.845338e+06 1.733468e+06 3.037531e+06 4.610900e+06 2.331719e+06 1.875506e+06 9.454653e+06 1.489115e+06 2.909824e+06 3.006101e+06 7.622685e+06 2.782412e+06 2.826059e+06 1.835991e+06 2.821048e+06 1.659552e+06 3.702632e+06 2.528272e+06 2.081138e+06 4.147216e+06 2.237511e+06 2.129796e+06 1.671859e+06 4.094415e+06 2.600639e+06 3.211535e+06 3.311866e+06 4.000462e+06 C19 H45 N3 O3 P2 S_14.427 1.082801e+05 1.026494e+05 7.839305e+04 9.072215e+04 4.315792e+04 8.192692e+04 9.045869e+04 1.431121e+05 29586.58 7.253457e+04 1.248120e+05 1.031110e+05 31224.17 6.184512e+04 7.288813e+04 8.243009e+04 3.160991e+04 1.019903e+05 1.062821e+05 8.967124e+04 2.270160e+04 8.920259e+04 8.963230e+04 1.193695e+05 16569.092 8.115732e+04 1.196575e+05 6.759146e+04 1.909444e+04 9.607089e+04 7.235672e+04 1.302026e+05 30387.26 9.174387e+04 6.643258e+04 4.594209e+04 3.605741e+04 8.508644e+04 8.982209e+04 1.193443e+05 3.550050e+04 8.755041e+04 9.351341e+04 8.731723e+04 3.058754e+04 7.041054e+04 4.997259e+04 1.093218e+05 4.682735e+04 6.009568e+04 1.801165e+05 1.058595e+05 8.003650e+04 1.755605e+05 7.788015e+04 8.117443e+04 7.796166e+04 1.153654e+05 2.370287e+05 7.408327e+04 8.274914e+04 1.414041e+05 7.903608e+04 7.668343e+04 7.697549e+04 4.500059e+04 1.788408e+05 9.559728e+05 2.227008e+05 2.338140e+05 8.039498e+04 5.926126e+04 4.957167e+04 5.881128e+04 9.629363e+05 1.257437e+05 3.730763e+05 6.240058e+04 3.787727e+05 8.512867e+04 4.562406e+04 2.273069e+05 5.024043e+05 6.422474e+04 6.778244e+04 2.393416e+05 6.853319e+05 3.904437e+05 6.827709e+04 3.772669e+04 1.580739e+05 6.004406e+04 5.115941e+04 2.983831e+05 1.203563e+05 8.505069e+04 2.224756e+05 1.702771e+05 1.720296e+05 6.337082e+04 4.185710e+06 7.193299e+04 4.767241e+04 6.328050e+04 6.259417e+04 6.791084e+04 6.464093e+04 6.553844e+05 1.190673e+05 1.098929e+06 5.664632e+04 4.043327e+04 1.004076e+05 7.288088e+04 8.328579e+04 2.218887e+06 2.990601e+06 7.619074e+04 4.151217e+06 6.154973e+04 4.885775e+05 7.751643e+04 4.031051e+05 3.136590e+04 6.432769e+04 3.752836e+05 9.188098e+04 5.465066e+04 6.061516e+05 6.066024e+04 6.472263e+04 3.516530e+05 5.805860e+04 5.488933e+04 1.094342e+05 4.728126e+04 7.902833e+04 5.687536e+04 5.612100e+04 4.876255e+04 6.514393e+04 4.223664e+04 6.976895e+04 6.469807e+04 6.807070e+04 3.572142e+05 7.361276e+04 5.134632e+04 5.122060e+04 6.281623e+04 1.522889e+05 1.023536e+05 6.703714e+04 2.324146e+05 8.964675e+05 5.611186e+04 7.140736e+04 7.129967e+04 6.654837e+04 5.707697e+04 9.541491e+04 1.076946e+05 7.357414e+04 6.065359e+04 9.673734e+04 7.028899e+04 8.795907e+04 6.813101e+04 1.021768e+05 8.469445e+05 4.660168e+04 6.783764e+04 9.919641e+04 4.290962e+04 4.953750e+04 6.279682e+04 1.013507e+05 1.397889e+05 7.011808e+04 5.136049e+04 5.532957e+04 5.106647e+04 9.635766e+04 4.355081e+04 5.931344e+04 5.877389e+04 6.160790e+04 4.699531e+04 4.678050e+04 6.485622e+04 4.983806e+04 5.686369e+04 6.620285e+04 8.198267e+04 5.011655e+04 8.841134e+04 7.583810e+04 5.249713e+04 5.792093e+04 6.507678e+04 6.620580e+04 5.456484e+04 3.411961e+05 7.071485e+04 4.951282e+04 5.179186e+04 5.297388e+04 6.664675e+04 4.231434e+04 6.821940e+04 1.055334e+05 8.398206e+04 4.311708e+04 5.266151e+04 4.065449e+04 7.974505e+04 5.851401e+04 6.896795e+04 7.412226e+04 5.613207e+04 4.783343e+05 8.221282e+04 6.946148e+04 6.675151e+04 5.862248e+04 5.170217e+04 6.703554e+04 7.310334e+04 6.449904e+04 7.382109e+04 5.512146e+04 4.962693e+04 6.267890e+04 5.966610e+04 6.559674e+04 6.589102e+04 7.571651e+04 6.604338e+04 4.204216e+04 5.897082e+04 7.318657e+04 3.786420e+04 6.650901e+04 1.063971e+05 6.259775e+04 4.651685e+04 7.216634e+04 6.392225e+04 7.086448e+04 7.458635e+04 6.129429e+04 6.334144e+04 8.730042e+04 4.984897e+04 9.060705e+04 5.894419e+04 8.052033e+04 6.005171e+04 6.286798e+04 7.088430e+04 7.930027e+04 7.021695e+04 84.56629_14.482 2.235533e+06 1.463821e+06 1.310129e+06 1.191164e+06 1.955874e+04 1.302488e+06 1.414332e+06 1.467674e+06 17444.76 1.120307e+06 1.399476e+06 1.450237e+06 17700.53 1.163330e+06 1.302909e+06 1.486699e+06 1.742184e+04 1.304385e+06 1.311521e+06 1.405933e+06 1.499644e+04 1.188313e+06 9.517030e+05 1.717608e+06 11550.530 1.471383e+06 1.147389e+06 1.267496e+06 1.290324e+04 1.528792e+06 1.257048e+06 1.387292e+06 21671.62 1.370597e+06 1.280357e+06 8.780442e+05 2.226435e+04 1.456966e+06 1.461819e+06 1.387934e+06 2.070343e+04 1.363315e+06 1.423140e+06 1.279516e+06 2.097644e+04 1.386609e+06 1.080401e+06 1.472728e+06 8.326696e+05 1.364826e+06 1.411522e+06 2.770745e+06 2.030093e+06 2.575269e+06 2.213483e+06 2.128374e+06 1.447336e+06 4.094597e+06 3.262799e+06 1.581216e+06 2.573899e+06 2.194339e+06 1.393628e+06 3.855888e+06 1.396306e+06 7.842460e+05 1.962368e+06 1.559977e+06 1.107232e+06 1.310664e+06 2.204522e+06 1.260572e+06 1.210931e+06 1.748982e+06 2.346921e+06 1.367667e+06 2.399259e+06 1.720632e+06 2.476134e+06 1.722459e+06 1.098378e+06 9.839635e+05 1.291677e+06 1.530144e+06 1.276555e+06 1.701969e+06 1.079249e+06 2.849255e+06 1.221493e+06 1.293938e+06 2.025546e+06 1.784729e+06 1.466632e+06 2.148296e+06 1.921495e+06 1.979194e+06 1.987439e+06 1.765031e+06 6.301449e+05 1.511144e+06 1.467431e+06 9.519019e+05 1.393571e+06 1.674242e+06 1.187539e+06 1.337752e+06 1.677886e+06 2.639404e+06 8.400085e+05 1.147149e+06 1.385147e+06 8.577799e+05 7.535899e+05 2.459436e+06 1.271067e+06 2.003552e+06 1.317838e+06 1.200458e+06 2.378564e+06 1.115835e+06 1.550740e+06 1.376451e+06 1.159651e+06 5.119690e+05 1.126047e+06 9.026332e+05 9.496516e+05 8.639851e+05 2.198540e+06 1.428048e+06 2.301143e+06 3.216072e+06 1.022383e+06 1.786908e+06 2.154110e+06 9.363912e+05 1.494716e+06 1.703770e+06 1.782721e+06 1.012163e+06 1.197098e+06 9.215701e+05 1.638444e+06 1.331416e+06 1.459560e+06 1.315979e+06 1.520773e+06 1.404520e+06 1.366558e+06 1.404762e+06 9.383903e+05 1.266624e+06 1.982688e+06 2.144111e+06 1.780288e+06 1.497244e+06 1.820339e+06 1.440360e+06 7.288256e+05 1.412105e+06 2.143428e+06 2.002871e+06 1.920400e+06 1.808230e+06 1.600314e+06 1.797833e+06 1.400100e+06 1.297424e+06 1.276352e+06 1.847137e+06 1.184295e+06 1.983294e+06 2.360610e+06 1.004452e+06 1.555294e+06 1.089707e+06 2.339962e+06 2.074902e+06 1.979514e+06 8.881817e+05 6.674888e+05 1.621078e+06 4.199977e+06 9.439354e+05 1.558775e+06 1.305946e+06 1.495330e+06 1.095645e+06 1.066061e+06 1.150600e+06 1.134369e+06 1.426011e+06 1.063752e+06 1.976558e+06 4.512770e+05 2.132383e+06 1.573464e+06 1.236276e+06 1.554407e+06 1.437670e+06 1.955981e+06 1.220817e+06 1.801264e+06 2.159857e+06 5.920205e+05 8.153722e+05 1.338702e+06 8.851394e+05 1.049875e+06 9.725303e+05 1.795385e+06 1.401609e+06 1.097271e+06 1.217720e+06 1.101871e+06 2.255456e+06 1.391974e+06 9.538604e+05 2.035415e+06 1.475820e+06 9.075174e+05 3.101478e+06 1.475324e+06 9.056284e+05 1.160386e+06 7.778520e+05 1.162325e+06 1.386396e+06 1.611995e+06 1.682565e+06 1.435137e+06 6.991003e+05 1.691676e+06 1.230241e+06 2.031994e+06 1.345012e+06 1.325660e+06 1.819537e+06 6.486527e+05 9.323636e+05 2.365486e+06 7.970771e+05 1.210673e+06 2.384757e+06 1.332840e+06 8.940109e+05 1.543998e+06 1.094599e+06 1.759112e+06 1.452172e+06 1.240998e+06 1.724998e+06 1.130653e+06 9.786031e+05 1.942641e+06 1.011843e+06 1.927191e+06 1.057884e+06 1.267899e+06 1.289205e+06 2.024866e+06 1.848050e+06 Glutaronitrile (1)_14.486 2.517796e+07 1.488110e+07 1.466527e+07 1.473954e+07 6.406108e+04 1.539106e+07 1.601779e+07 1.610595e+07 55473.73 1.388060e+07 1.582703e+07 1.677955e+07 62149.96 1.382289e+07 1.376359e+07 1.628553e+07 5.469572e+04 1.487050e+07 1.501432e+07 1.648147e+07 4.359159e+04 1.406970e+07 1.129657e+07 2.035071e+07 53188.518 1.388629e+07 1.451388e+07 1.519633e+07 5.824183e+04 1.541677e+07 1.490444e+07 1.705866e+07 104600.69 1.478680e+07 1.593481e+07 7.378060e+06 8.197403e+04 1.678574e+07 1.739295e+07 1.685780e+07 8.085790e+04 1.443161e+07 1.620219e+07 1.577550e+07 7.529381e+04 1.381175e+07 1.397323e+07 1.590507e+07 1.000934e+07 1.495162e+07 1.690780e+07 2.951322e+07 2.794478e+07 2.729710e+07 2.398292e+07 2.603497e+07 1.711399e+07 3.523305e+07 3.764502e+07 1.800371e+07 2.941124e+07 2.772398e+07 1.488417e+07 2.131337e+07 1.786527e+07 9.131989e+06 2.244989e+07 1.678673e+07 1.314998e+07 1.511928e+07 2.525851e+07 1.628659e+07 1.335877e+07 1.962403e+07 2.717753e+07 1.651388e+07 2.511664e+07 1.931062e+07 2.573214e+07 1.968919e+07 1.241966e+07 1.267272e+07 1.209520e+07 1.626872e+07 2.095024e+07 1.757892e+07 1.219993e+07 2.633986e+07 1.246121e+07 1.158685e+07 2.307432e+07 1.976329e+07 1.382744e+07 2.334941e+07 2.127724e+07 2.344993e+07 2.284199e+07 1.934730e+07 6.334128e+06 1.505398e+07 1.880644e+07 8.764798e+06 1.432952e+07 1.686254e+07 1.527961e+07 1.460859e+07 1.751497e+07 2.698797e+07 1.039899e+07 9.216159e+06 1.450017e+07 9.781379e+06 6.528586e+06 1.605551e+07 1.303297e+07 2.618937e+07 1.792284e+07 1.606567e+07 2.631875e+07 1.656606e+07 1.835803e+07 1.605842e+07 1.363191e+07 4.650674e+06 1.384555e+07 1.057994e+07 9.750564e+06 8.557665e+06 2.411777e+07 1.698916e+07 2.358210e+07 3.851678e+07 1.187439e+07 1.421308e+07 2.259946e+07 1.014295e+07 1.904067e+07 2.023312e+07 1.784149e+07 8.501766e+06 1.475988e+07 1.016886e+07 1.783990e+07 1.554181e+07 1.610722e+07 1.608242e+07 1.653541e+07 1.437780e+07 1.493768e+07 1.495355e+07 1.173372e+07 1.533521e+07 2.217404e+07 2.695267e+07 2.183960e+07 1.768901e+07 1.957017e+07 1.509875e+07 8.918010e+06 1.583071e+07 2.378083e+07 2.606184e+07 2.236752e+07 2.172677e+07 1.707538e+07 2.004603e+07 1.618634e+07 1.421870e+07 1.398399e+07 1.929067e+07 1.242358e+07 2.350356e+07 2.881371e+07 1.146189e+07 1.688190e+07 1.250639e+07 2.551197e+07 2.272446e+07 2.052739e+07 1.117423e+07 7.577736e+06 1.545953e+07 2.593089e+07 1.150319e+07 1.833361e+07 1.462249e+07 1.801054e+07 1.395308e+07 1.138111e+07 1.374949e+07 1.282720e+07 1.677576e+07 1.313388e+07 2.303895e+07 6.487697e+06 1.875623e+07 2.010604e+07 1.403521e+07 1.645142e+07 1.762522e+07 1.969424e+07 1.297581e+07 2.016923e+07 2.272519e+07 5.000102e+06 9.859312e+06 1.580135e+07 1.084752e+07 1.056721e+07 1.146393e+07 2.029929e+07 1.745654e+07 8.974843e+06 1.557920e+07 1.312649e+07 2.391981e+07 1.599429e+07 1.337171e+07 2.230732e+07 1.923307e+07 1.243695e+07 3.045306e+07 2.451268e+07 1.135748e+07 1.565447e+07 1.095796e+07 1.324946e+07 1.671765e+07 1.694007e+07 2.015406e+07 1.846651e+07 8.482423e+06 1.656735e+07 1.400508e+07 2.201655e+07 1.491455e+07 1.983334e+07 2.023721e+07 7.144114e+06 1.369138e+07 2.676922e+07 8.835015e+06 1.279316e+07 2.496095e+07 1.705441e+07 9.689880e+06 2.320999e+07 1.103549e+07 2.005656e+07 1.608171e+07 1.517262e+07 1.975990e+07 1.332168e+07 1.197667e+07 2.162418e+07 1.430232e+07 2.097506e+07 1.068161e+07 1.504571e+07 1.536796e+07 2.389655e+07 2.083628e+07 Betazole_14.489 2.225607e+07 1.327175e+07 1.299851e+07 1.304221e+07 3.403003e+04 1.360219e+07 1.420424e+07 1.423898e+07 29556.21 1.235288e+07 1.400204e+07 1.491367e+07 27613.88 1.218743e+07 1.229599e+07 1.441003e+07 2.912104e+04 1.314067e+07 1.331307e+07 1.460212e+07 2.316180e+04 1.247317e+07 1.008096e+07 1.800013e+07 18331.327 1.237202e+07 1.285174e+07 1.342892e+07 2.267489e+04 1.363042e+07 1.326198e+07 1.516328e+07 34488.96 1.303718e+07 1.411285e+07 6.547576e+06 3.697793e+04 1.491544e+07 1.548590e+07 1.491970e+07 3.300086e+04 1.286508e+07 1.425684e+07 1.391052e+07 3.234052e+04 1.227203e+07 1.246372e+07 1.408422e+07 8.889268e+06 1.307996e+07 1.492825e+07 2.669356e+07 2.475674e+07 2.419089e+07 2.128030e+07 2.286576e+07 1.511090e+07 3.143220e+07 3.318381e+07 1.590497e+07 2.600526e+07 2.467279e+07 1.306825e+07 1.874154e+07 1.595187e+07 8.091103e+06 1.989946e+07 1.482905e+07 1.169712e+07 1.336950e+07 2.228771e+07 1.444417e+07 1.183486e+07 1.718718e+07 2.413158e+07 1.455092e+07 2.235049e+07 1.701611e+07 2.286269e+07 1.723185e+07 1.104326e+07 1.126398e+07 1.057663e+07 1.441307e+07 1.851135e+07 1.543717e+07 1.079555e+07 2.372374e+07 1.119317e+07 1.032307e+07 2.046497e+07 1.753479e+07 1.245734e+07 2.054653e+07 1.880541e+07 2.097459e+07 2.018273e+07 1.712043e+07 5.586405e+06 1.336581e+07 1.634964e+07 7.836863e+06 1.264046e+07 1.471516e+07 1.355675e+07 1.277257e+07 1.553500e+07 2.388612e+07 9.279922e+06 8.236693e+06 1.302293e+07 8.667920e+06 5.878538e+06 1.426787e+07 1.162923e+07 2.326428e+07 1.589762e+07 1.409869e+07 2.346243e+07 1.481499e+07 1.620786e+07 1.430796e+07 1.213256e+07 4.138349e+06 1.164101e+07 9.377652e+06 8.629595e+06 7.639373e+06 2.159465e+07 1.528021e+07 2.101164e+07 3.514683e+07 1.055741e+07 1.266499e+07 2.012053e+07 8.987903e+06 1.682248e+07 1.787270e+07 1.578513e+07 7.388963e+06 1.315044e+07 8.993176e+06 1.593205e+07 1.353428e+07 1.392612e+07 1.423521e+07 1.453865e+07 1.266727e+07 1.328571e+07 1.309095e+07 1.050052e+07 1.363055e+07 1.959227e+07 2.289279e+07 1.936611e+07 1.572238e+07 1.740793e+07 1.336292e+07 7.924271e+06 1.408398e+07 2.110760e+07 2.312436e+07 1.970555e+07 1.923306e+07 1.495148e+07 1.787909e+07 1.435172e+07 1.263706e+07 1.245398e+07 1.708040e+07 1.101669e+07 2.074610e+07 2.556259e+07 1.030604e+07 1.497775e+07 1.112301e+07 2.247652e+07 2.016762e+07 1.809541e+07 9.919127e+06 6.686316e+06 1.361890e+07 2.299197e+07 1.016055e+07 1.535812e+07 1.284128e+07 1.608811e+07 1.239413e+07 1.007087e+07 1.193576e+07 1.138825e+07 1.490460e+07 1.162388e+07 2.043739e+07 5.677739e+06 1.668608e+07 1.777314e+07 1.240883e+07 1.461798e+07 1.562720e+07 1.737393e+07 1.151060e+07 1.785337e+07 2.037098e+07 4.135547e+06 8.739808e+06 1.406284e+07 9.650473e+06 9.393500e+06 1.017973e+07 1.819920e+07 1.535148e+07 7.954065e+06 1.391266e+07 1.164691e+07 2.102742e+07 1.436176e+07 1.180159e+07 1.993065e+07 1.705886e+07 1.098828e+07 2.718153e+07 2.180682e+07 1.014853e+07 1.370382e+07 9.772421e+06 1.166733e+07 1.485285e+07 1.498519e+07 1.791121e+07 1.635410e+07 7.581947e+06 1.475703e+07 1.242028e+07 1.964171e+07 1.329812e+07 1.772387e+07 1.805920e+07 6.194760e+06 1.197797e+07 2.366466e+07 7.771148e+06 1.122047e+07 2.207115e+07 1.506170e+07 8.552940e+06 2.071938e+07 9.731332e+06 1.793616e+07 1.431954e+07 1.348445e+07 1.744242e+07 1.187170e+07 1.058091e+07 1.916924e+07 1.278157e+07 1.860194e+07 9.486795e+06 1.335583e+07 1.357744e+07 2.108821e+07 1.852886e+07 C4 H7 N_14.489 1.879788e+07 1.125045e+07 1.032831e+07 1.095574e+07 1.857447e+05 1.141243e+07 1.165334e+07 1.234834e+07 177284.55 9.779673e+06 1.205470e+07 1.271230e+07 171527.16 1.006992e+07 9.696122e+06 1.129009e+07 1.910341e+05 1.107698e+07 1.139333e+07 1.267973e+07 2.387501e+04 9.651931e+06 8.346884e+06 1.562238e+07 673808.760 1.014640e+07 1.130385e+07 1.063592e+07 1.459197e+06 1.032328e+07 1.112648e+07 1.267710e+07 1375728.55 1.197212e+07 1.149367e+07 5.241885e+06 1.460030e+06 1.247479e+07 1.227206e+07 1.212179e+07 1.345712e+06 1.123295e+07 1.195598e+07 1.130512e+07 1.084823e+06 1.044961e+07 1.011749e+07 1.188891e+07 7.626693e+06 1.050164e+07 1.327839e+07 2.123971e+07 1.987447e+07 2.019871e+07 1.917123e+07 1.672465e+07 1.124008e+07 2.653789e+07 2.646311e+07 1.347536e+07 2.415896e+07 1.736854e+07 1.087859e+07 1.590536e+07 1.340104e+07 7.013946e+06 1.541748e+07 1.314790e+07 1.186267e+07 1.096759e+07 1.847196e+07 1.244923e+07 9.798022e+06 1.358399e+07 2.030981e+07 1.210532e+07 1.877774e+07 1.366616e+07 1.911289e+07 1.477192e+07 8.813283e+06 9.342988e+06 9.592878e+06 1.203568e+07 1.551126e+07 1.381718e+07 9.135822e+06 2.000926e+07 8.486708e+06 6.791098e+06 1.627859e+07 1.421552e+07 8.638091e+06 1.693970e+07 1.449230e+07 1.695572e+07 1.660297e+07 1.482571e+07 4.490987e+06 1.079936e+07 1.354386e+07 8.302929e+06 1.009469e+07 1.336429e+07 1.208380e+07 1.176630e+07 1.230989e+07 1.996703e+07 7.931010e+06 6.170449e+06 1.079880e+07 7.453790e+06 4.761009e+06 1.185400e+07 9.106863e+06 1.988135e+07 1.303084e+07 1.183152e+07 1.866116e+07 1.133788e+07 1.444657e+07 1.288775e+07 1.017989e+07 3.443502e+06 1.139766e+07 7.928899e+06 7.762265e+06 5.227782e+06 1.970592e+07 1.380389e+07 1.547314e+07 2.687982e+07 9.004440e+06 1.078744e+07 1.838429e+07 7.115858e+06 1.323514e+07 1.412722e+07 1.294104e+07 6.396059e+06 1.091355e+07 7.154581e+06 1.380872e+07 1.116859e+07 1.273125e+07 1.147333e+07 1.202861e+07 1.046558e+07 1.082735e+07 1.179411e+07 8.179029e+06 1.170306e+07 1.619987e+07 1.842299e+07 1.460118e+07 1.468736e+07 1.512486e+07 1.135358e+07 6.290464e+06 1.153056e+07 1.817450e+07 1.816765e+07 1.613648e+07 1.560927e+07 1.518062e+07 1.473418e+07 1.266066e+07 1.068904e+07 1.091547e+07 1.361232e+07 1.010161e+07 1.594511e+07 2.199480e+07 8.474129e+06 1.186879e+07 8.896204e+06 1.825275e+07 1.676407e+07 1.507440e+07 8.140236e+06 6.369539e+06 1.031271e+07 1.871017e+07 8.088113e+06 1.212283e+07 1.144877e+07 1.168743e+07 9.971540e+06 8.232860e+06 1.036837e+07 9.045040e+06 1.237885e+07 1.026422e+07 1.707117e+07 5.066226e+06 1.340463e+07 1.509565e+07 1.120045e+07 1.258463e+07 1.403699e+07 2.169366e+06 9.901308e+06 1.563822e+07 1.678485e+07 4.505494e+06 7.450498e+06 1.115745e+07 7.883897e+06 7.229014e+06 8.193709e+06 1.422549e+07 1.259351e+07 6.387485e+06 1.083586e+07 9.543751e+06 1.840592e+07 1.255245e+07 1.070055e+07 1.774269e+07 1.488326e+07 9.337315e+06 2.307895e+07 1.693199e+07 8.213243e+06 1.236587e+07 8.180365e+06 1.019608e+07 1.237539e+07 1.258868e+07 1.479975e+07 1.277955e+07 6.602925e+06 1.265633e+07 1.049880e+07 1.502678e+07 1.048892e+07 1.349380e+07 1.577799e+07 5.875557e+06 9.717661e+06 1.923164e+07 6.662824e+06 1.003762e+07 1.807531e+07 1.314935e+07 7.547056e+06 1.529288e+07 9.143439e+06 1.539878e+07 1.212650e+07 1.061159e+07 1.428734e+07 9.865156e+06 8.885432e+06 1.484590e+07 1.058328e+07 1.821821e+07 8.579042e+06 1.030476e+07 1.130251e+07 1.806389e+07 1.602382e+07 107.56906_14.491 2.416196e+06 1.422729e+06 1.258766e+06 1.348590e+06 2.399176e+04 1.374510e+06 1.372285e+06 1.386534e+06 21510.87 1.179721e+06 1.404760e+06 1.515475e+06 21707.52 1.367698e+06 1.195757e+06 1.405704e+06 2.363351e+04 1.334265e+06 1.347924e+06 1.462554e+06 1.921978e+04 1.273266e+06 1.059244e+06 1.600918e+06 15080.539 1.281512e+06 1.336437e+06 1.504092e+06 1.627839e+04 1.396766e+06 1.203107e+06 1.360825e+06 27600.00 1.543515e+06 1.204527e+06 1.028380e+06 3.106409e+04 1.405774e+06 1.432077e+06 1.477129e+06 3.076958e+04 1.352818e+06 1.464375e+06 1.461679e+06 3.126662e+04 1.102037e+06 1.185039e+06 1.511580e+06 8.590932e+05 1.273274e+06 1.675543e+06 3.134842e+06 2.539734e+06 2.251999e+06 2.236955e+06 2.159508e+06 1.907402e+06 3.372301e+06 3.463028e+06 1.854112e+06 2.502170e+06 2.728732e+06 1.985190e+06 1.932684e+06 1.809544e+06 8.300146e+05 2.031154e+06 1.437055e+06 1.123440e+06 1.294321e+06 2.413886e+06 1.395046e+06 1.253965e+06 1.798692e+06 2.286937e+06 1.458679e+06 2.094529e+06 1.840658e+06 2.435068e+06 2.080478e+06 1.243887e+06 1.026376e+06 1.296141e+06 1.490938e+06 1.808978e+06 1.673177e+06 1.112584e+06 2.611851e+06 1.312865e+06 1.497201e+06 1.966632e+06 1.711920e+06 1.058764e+06 2.209080e+06 1.793899e+06 1.942963e+06 1.969595e+06 1.728760e+06 5.711848e+05 1.343040e+06 1.736014e+06 1.072090e+06 1.424481e+06 1.487297e+06 1.394010e+06 1.359312e+06 1.492979e+06 2.525354e+06 9.245621e+05 1.460330e+06 1.163962e+06 9.868731e+05 9.631566e+05 1.312785e+06 1.304068e+06 2.530976e+06 1.843784e+06 1.394767e+06 2.395236e+06 1.375746e+06 1.908139e+06 1.412846e+06 1.217643e+06 5.320609e+05 1.168219e+06 9.797095e+05 8.253925e+05 7.109852e+05 2.075407e+06 1.438516e+06 1.988461e+06 3.200426e+06 1.125429e+06 1.222843e+06 2.388062e+06 9.621110e+05 1.769438e+06 1.705446e+06 1.606073e+06 1.152310e+06 1.420472e+06 9.950627e+05 1.732822e+06 1.315407e+06 1.718232e+06 1.375782e+06 1.318066e+06 1.118287e+06 1.410680e+06 1.414926e+06 1.233179e+06 1.322494e+06 1.777699e+06 2.086159e+06 2.092635e+06 1.688801e+06 1.605676e+06 1.296575e+06 8.543787e+05 1.447192e+06 2.113285e+06 2.041640e+06 1.960893e+06 1.911042e+06 1.623789e+06 1.895600e+06 1.378450e+06 1.349866e+06 1.229346e+06 1.673878e+06 1.147295e+06 2.038094e+06 2.758415e+06 1.104077e+06 1.528769e+06 1.141431e+06 1.960084e+06 2.145491e+06 1.753819e+06 9.302281e+05 7.441885e+05 1.360106e+06 2.446294e+06 1.061883e+06 1.579342e+06 1.269489e+06 1.489220e+06 1.255631e+06 1.030988e+06 1.276155e+06 1.120976e+06 1.423691e+06 9.914222e+05 1.894033e+06 6.177020e+05 1.795418e+06 1.853390e+06 1.215186e+06 1.536275e+06 1.508271e+06 1.748624e+06 1.179658e+06 1.895151e+06 1.994613e+06 7.672485e+05 9.101685e+05 1.380332e+06 9.445170e+05 1.006527e+06 9.430607e+05 1.753069e+06 1.423329e+06 1.364711e+06 1.296383e+06 1.133532e+06 2.186691e+06 1.458983e+06 1.062674e+06 2.118008e+06 1.569945e+06 1.199524e+06 2.863387e+06 1.884485e+06 8.886775e+05 1.518677e+06 1.110625e+06 1.258247e+06 1.529207e+06 1.435268e+06 1.720353e+06 1.709608e+06 7.185286e+05 1.455291e+06 1.352188e+06 1.978939e+06 1.206074e+06 1.669696e+06 1.776568e+06 6.679157e+05 1.171538e+06 2.365052e+06 8.467888e+05 1.127522e+06 2.387568e+06 1.575557e+06 8.150408e+05 1.739953e+06 9.616954e+05 1.693388e+06 1.875082e+06 1.332348e+06 1.705110e+06 1.348220e+06 9.489944e+05 1.995582e+06 1.441361e+06 1.981241e+06 9.019344e+05 1.387521e+06 1.462403e+06 1.982183e+06 1.808468e+06 ARGININE 1.145071e+09 7.172027e+08 7.073174e+08 7.242220e+08 5.768805e+05 7.246641e+08 7.845774e+08 7.537288e+08 736517.89 7.333494e+08 7.477740e+08 7.989777e+08 730031.05 6.740936e+08 6.514073e+08 8.196606e+08 8.071438e+05 7.044207e+08 7.351208e+08 7.850200e+08 2.139549e+05 6.973106e+08 5.477430e+08 9.438896e+08 109869.532 6.952356e+08 7.184279e+08 7.323822e+08 2.862136e+05 7.206665e+08 7.155464e+08 8.609660e+08 244097.94 7.264651e+08 7.352450e+08 3.640351e+08 5.336043e+05 8.570594e+08 8.121819e+08 7.896334e+08 2.589436e+05 7.396613e+08 7.815158e+08 7.486391e+08 2.732117e+05 6.829232e+08 6.578755e+08 7.815298e+08 5.888397e+08 6.867497e+08 7.602960e+08 1.229968e+09 1.288335e+09 1.267122e+09 1.100418e+09 1.083997e+09 7.535185e+08 1.419543e+09 1.520538e+09 8.391763e+08 1.281085e+09 1.237620e+09 7.732371e+08 9.827655e+08 8.020432e+08 4.727025e+08 1.026704e+09 7.946240e+08 6.631722e+08 7.458896e+08 1.071709e+09 8.085482e+08 6.417927e+08 9.141315e+08 1.191953e+09 8.160955e+08 1.094140e+09 9.582650e+08 1.255006e+09 9.200195e+08 6.141492e+08 6.401200e+08 6.632175e+08 7.617346e+08 9.218705e+08 8.605501e+08 6.189561e+08 1.141788e+09 6.312465e+08 5.706464e+08 1.029682e+09 9.423283e+08 6.134584e+08 1.065829e+09 9.208807e+08 1.187069e+09 1.023615e+09 8.961282e+08 3.499389e+08 7.622224e+08 8.662900e+08 1.598447e+08 7.682491e+08 8.994083e+08 7.384793e+08 7.689917e+08 7.914451e+08 1.630174e+09 5.543730e+08 5.177313e+08 6.939277e+08 4.980117e+08 3.728168e+08 7.816526e+08 7.055910e+08 1.195461e+09 8.940346e+08 7.818878e+08 1.174901e+09 7.842053e+08 8.399800e+08 7.331606e+08 6.897577e+08 2.529589e+08 6.162639e+08 5.189370e+08 5.163157e+08 4.182319e+08 1.070873e+09 8.189179e+08 1.068464e+09 1.553108e+09 5.786067e+08 7.405566e+08 1.002563e+09 4.945787e+08 8.920894e+08 9.537824e+08 8.607602e+08 5.019303e+08 6.826200e+08 5.184125e+08 9.220403e+08 7.429713e+08 8.784217e+08 7.776173e+08 7.622462e+08 7.085544e+08 7.346274e+08 7.288571e+08 5.715803e+08 7.620593e+08 1.034874e+09 1.098356e+09 9.588883e+08 7.773583e+08 9.274687e+08 7.454742e+08 4.362537e+08 7.487233e+08 1.101335e+09 1.159493e+09 1.042083e+09 9.624803e+08 8.786691e+08 9.084527e+08 7.936746e+08 7.109002e+08 6.600671e+08 8.765447e+08 6.138109e+08 1.052114e+09 1.275287e+09 6.282138e+08 7.772356e+08 5.929354e+08 1.105757e+09 9.769062e+08 9.156380e+08 5.661451e+08 4.008804e+08 7.250014e+08 1.109213e+09 5.597302e+08 8.888692e+08 7.066683e+08 7.495759e+08 6.772450e+08 5.740897e+08 6.689427e+08 5.898822e+08 7.637744e+08 7.170548e+08 9.841789e+08 3.329084e+08 8.726928e+08 9.037864e+08 7.307829e+08 8.376670e+08 8.174731e+08 8.926645e+08 6.591280e+08 9.578651e+08 1.016001e+09 3.671768e+08 5.582946e+08 7.760149e+08 5.085650e+08 5.477041e+08 5.783643e+08 9.374287e+08 7.983134e+08 4.648004e+08 7.351789e+08 6.606925e+08 1.125542e+09 7.554153e+08 6.433711e+08 1.020803e+09 8.787383e+08 6.260289e+08 1.260912e+09 1.142562e+09 5.472307e+08 8.298365e+08 5.578605e+08 6.583901e+08 8.032289e+08 8.079791e+08 8.964698e+08 8.932407e+08 4.357152e+08 8.023716e+08 6.925280e+08 1.004794e+09 8.499671e+08 8.263563e+08 9.409484e+08 4.276836e+08 6.775313e+08 1.211297e+09 4.419099e+08 6.545301e+08 1.119336e+09 8.298848e+08 5.310345e+08 1.046693e+09 6.138912e+08 9.515138e+08 8.936940e+08 7.674105e+08 9.484842e+08 7.003110e+08 5.883607e+08 9.740940e+08 6.845086e+08 9.614371e+08 5.680294e+08 7.489630e+08 7.152088e+08 1.151195e+09 9.210879e+08 C12 H28 N8 O4_14.494 5.599501e+06 1.870922e+06 1.809877e+06 1.935256e+06 2.236578e+04 1.957281e+06 2.146872e+06 2.169537e+06 18957.15 1.922168e+06 2.121523e+06 2.088266e+06 21416.09 1.657321e+06 1.795337e+06 1.984697e+06 2.510054e+04 1.886832e+06 1.859841e+06 2.019197e+06 1.906773e+04 1.737261e+06 1.841931e+06 2.900519e+06 14394.423 1.721513e+06 1.620861e+06 1.827480e+06 1.670263e+04 2.046065e+06 1.892438e+06 2.417044e+06 27769.53 2.352960e+06 1.277809e+06 9.669700e+05 2.872597e+04 2.200668e+06 2.145238e+06 2.473212e+06 2.363729e+04 1.772806e+06 2.324753e+06 1.950963e+06 2.279906e+04 1.687038e+06 1.597222e+06 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5.422448e+06 2.147293e+04 5.153254e+06 5.156093e+06 3.577638e+05 2.196880e+04 4.952283e+06 3.813313e+06 8.132697e+06 17602.116 6.077018e+05 4.888091e+06 1.091750e+06 1.750616e+04 5.614432e+06 3.373396e+05 5.910994e+06 30113.91 9.358022e+05 5.634002e+06 8.425092e+05 2.987368e+04 6.277384e+06 3.853748e+06 4.428624e+06 2.673253e+04 1.299454e+05 6.274896e+06 6.465789e+06 3.537195e+04 8.383969e+05 2.200474e+06 3.215960e+06 1.418665e+06 1.979075e+05 2.570804e+06 1.529780e+06 1.080829e+07 8.285766e+06 6.637543e+06 2.159591e+07 2.075053e+06 4.054335e+05 1.271444e+07 1.690675e+05 9.395465e+06 5.116824e+06 1.358642e+06 1.598905e+06 7.684456e+05 6.379115e+05 7.786905e+05 1.009941e+06 5.215340e+06 6.423290e+06 1.386747e+05 8.729545e+06 3.067478e+06 4.594295e+06 8.377479e+06 1.950206e+06 6.529380e+06 6.483121e+05 1.112958e+07 6.746342e+06 6.195296e+05 3.659177e+06 2.033174e+05 7.309484e+04 7.970508e+05 2.697080e+06 7.707967e+05 5.773011e+06 6.250485e+06 3.050228e+06 9.058250e+05 3.773770e+06 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8.566570e+04 7.744574e+04 7.690273e+04 9.074641e+04 1.058389e+05 7.310224e+04 1.086306e+05 6.886726e+04 6.000535e+04 8.208662e+04 7.723346e+04 9.599959e+04 5.206781e+04 1.831398e+05 8.843423e+04 7.537757e+04 8.962918e+04 8.233702e+04 1.003902e+05 6.398066e+04 1.115877e+05 1.117621e+05 5.955990e+05 6.400969e+04 7.135166e+04 5.461748e+04 5.790245e+04 6.804563e+04 9.654260e+04 7.126396e+04 6.976116e+04 6.842108e+04 1.209587e+05 9.855521e+04 6.759994e+04 7.463181e+04 1.022826e+05 1.036431e+05 7.186803e+04 9.798083e+04 1.028694e+05 1.188593e+05 7.862767e+04 6.874370e+04 9.387387e+04 1.136624e+05 6.594588e+04 1.794551e+06 7.061001e+05 4.916355e+04 9.302724e+04 7.319002e+04 1.991826e+05 9.980540e+04 8.159410e+04 1.028901e+05 1.709763e+05 6.989196e+04 1.069321e+05 6.075763e+04 7.336364e+04 1.008876e+05 4.284350e+05 9.467344e+04 8.537481e+05 8.015816e+04 1.163239e+05 4.455645e+05 6.897050e+04 1.007290e+05 6.811285e+05 1.545616e+05 1.500835e+05 7.215986e+04 8.947924e+04 9.702939e+04 6.772659e+06 7.361644e+04 9.199959e+04 1.061133e+05 C6 H13 N O2 S_14.559 3.834288e+05 3.134552e+05 3.206318e+05 3.498614e+05 2.739421e+04 3.264845e+05 3.525684e+05 3.663317e+05 27115.24 3.033089e+05 3.479699e+05 3.787036e+05 25408.67 3.530279e+05 3.049451e+05 2.795470e+05 3.038853e+04 3.015017e+05 3.977524e+05 3.525831e+05 2.274347e+04 2.602503e+05 2.852194e+05 4.899711e+05 18403.727 3.127602e+05 3.058643e+05 3.115508e+05 1.962780e+04 3.250359e+05 3.189234e+05 3.991109e+05 32785.11 3.797952e+05 2.873804e+05 2.677828e+05 3.525495e+04 3.143240e+05 3.604115e+05 4.088231e+05 3.177124e+04 3.091996e+05 3.596797e+05 3.260660e+05 2.599891e+04 3.028438e+05 2.403325e+05 4.197215e+05 7.870409e+04 8.154344e+04 3.770469e+05 1.380120e+05 1.544537e+05 1.484118e+05 1.119644e+05 1.569319e+05 1.470086e+05 2.124767e+05 3.358433e+05 8.525073e+04 2.033675e+06 1.093782e+05 9.284078e+04 7.096555e+05 1.108027e+05 6.859666e+04 1.649794e+05 1.012428e+05 1.139138e+05 1.343229e+05 1.051756e+05 1.168766e+05 9.435432e+04 7.704740e+05 3.527507e+05 9.176042e+04 1.187313e+05 1.093291e+05 6.239217e+05 4.731043e+05 7.503399e+05 8.845598e+04 1.026001e+05 9.325039e+04 8.996195e+04 1.000258e+05 1.169510e+05 1.860296e+05 7.513203e+04 7.739234e+04 1.488406e+05 9.177731e+04 4.251404e+05 9.680580e+04 1.001688e+05 6.721779e+05 2.517545e+05 1.060823e+05 7.396670e+04 9.548423e+04 2.691138e+06 1.696734e+05 8.234743e+04 1.141703e+05 1.098329e+05 9.431681e+04 3.118961e+05 1.600735e+05 1.037843e+05 7.317069e+04 1.461379e+05 6.395554e+04 1.435724e+05 9.331553e+04 1.158796e+05 1.271249e+06 1.850452e+05 1.219160e+05 8.416617e+05 1.198360e+05 9.996721e+04 1.112384e+05 7.754836e+04 5.237947e+04 8.027700e+04 8.816591e+04 1.193353e+05 5.743857e+04 3.721754e+05 1.712915e+05 9.407775e+04 1.459376e+05 1.291208e+06 1.107734e+05 9.021637e+04 8.518266e+04 1.159042e+05 4.181777e+05 1.965168e+06 9.267202e+04 1.331498e+05 9.160588e+04 1.031307e+05 2.092596e+05 8.632057e+04 8.818645e+04 9.881146e+04 1.062222e+05 1.571701e+05 1.672727e+05 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9.437351e+04 8.579242e+05 1.416346e+05 1.078040e+05 6.162996e+04 1.120438e+06 9.669604e+04 1.176527e+05 1.028425e+05 7.357022e+04 8.710377e+05 5.270446e+04 8.199921e+05 1.926095e+05 6.035805e+04 1.311431e+05 1.916123e+05 8.976691e+04 1.379758e+06 1.048140e+05 9.049576e+04 1.549377e+05 1.760560e+05 7.437133e+04 9.476494e+05 2.061751e+05 2.359921e+07 1.019443e+05 8.213406e+04 1.266379e+05 5.192912e+06 5.117962e+05 1.436690e+05 3.484316e+05 1.164539e+06 C5 H7 N_14.58 3.493982e+06 2.098647e+06 2.299085e+06 2.068750e+06 3.387822e+04 2.345383e+06 2.177732e+06 2.198046e+06 31604.64 2.040217e+06 2.688499e+06 2.464052e+06 88829.21 1.961347e+06 1.790774e+06 2.397359e+06 1.976751e+05 2.211091e+06 2.278234e+06 2.455896e+06 2.219112e+04 1.970193e+06 1.619210e+06 2.856339e+06 17857.424 2.000367e+06 2.254450e+06 2.521355e+06 2.054326e+04 2.025035e+06 2.090908e+06 2.625197e+06 31021.55 2.285582e+06 2.060034e+06 1.078603e+06 3.081657e+04 2.384682e+06 2.556926e+06 2.281533e+06 1.471811e+06 2.205009e+06 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1.636809e+08 1.784702e+08 1.872020e+08 4818590.43 1.607644e+08 1.482751e+08 1.819070e+08 1.326915e+05 1.754641e+08 1.692065e+08 1.853667e+08 8.425100e+06 1.671871e+08 1.228011e+08 2.239076e+08 193236.554 1.583217e+08 1.633604e+08 1.808426e+08 3.087417e+07 1.646266e+08 1.755904e+08 1.893967e+08 497747.26 1.597641e+08 1.685618e+08 1.274062e+08 7.029251e+07 1.772020e+08 2.005070e+08 1.835544e+08 7.197650e+07 1.535400e+08 1.832612e+08 1.716619e+08 7.156383e+07 1.690553e+08 1.569799e+08 1.779637e+08 1.636621e+08 1.435488e+08 1.400392e+08 2.832556e+08 2.617202e+08 2.710387e+08 2.671664e+08 2.368002e+08 1.007007e+08 2.434277e+08 3.163139e+08 1.827526e+08 2.894862e+08 2.968012e+08 2.206242e+08 2.092297e+08 1.189440e+08 1.443304e+08 2.528337e+08 1.646678e+08 1.812900e+08 1.748369e+08 1.228022e+08 2.800932e+08 1.680340e+08 1.573379e+08 2.477219e+08 1.917280e+08 2.066494e+08 2.404231e+08 3.625793e+08 2.397392e+08 1.465243e+08 1.893408e+08 1.768799e+08 1.951809e+08 1.691064e+08 1.926559e+08 1.767613e+08 2.036742e+08 1.527518e+08 8.686834e+07 2.046966e+08 5.482542e+07 1.224564e+08 2.625556e+08 2.142764e+08 2.278413e+08 2.125757e+08 2.073184e+08 9.154777e+07 2.457355e+08 2.187996e+08 1.190977e+08 1.827738e+08 2.184862e+08 1.910721e+08 1.944623e+08 1.686741e+08 3.400907e+08 1.684302e+08 1.026715e+08 1.415672e+08 1.255139e+08 9.926424e+07 1.641148e+08 1.920613e+08 2.855473e+08 2.183323e+08 2.124627e+08 2.460235e+08 2.132033e+08 1.899973e+08 1.755474e+08 1.373879e+08 6.764202e+07 1.351680e+08 1.393399e+08 1.371704e+08 1.339083e+08 2.313200e+08 2.649793e+08 2.016885e+08 2.248270e+08 1.124330e+08 2.175017e+08 2.072458e+08 9.491511e+07 1.345268e+08 2.189546e+08 1.818868e+08 1.576454e+08 1.829749e+08 1.596004e+08 2.530591e+08 2.070704e+08 1.974385e+08 1.379183e+08 1.311167e+08 1.937037e+08 2.075390e+08 1.915148e+08 1.131478e+08 1.466295e+08 1.957772e+08 2.496477e+08 1.879540e+08 1.434079e+08 2.765630e+08 2.199888e+08 1.036930e+08 1.376081e+08 2.176053e+08 2.097974e+08 1.790056e+08 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3.053170e+08 1.344530e+08 1.549734e+08 2.428092e+08 2.232660e+08 1.829570e+08 2.157143e+08 1.698804e+08 2.197777e+08 3.724043e+07 1.528313e+08 3.607047e+08 1.831187e+08 1.871154e+08 2.262921e+08 1.665652e+08 2.040629e+08 1.438860e+08 2.065266e+08 1.510330e+08 2.378191e+08 2.007470e+08 C8 H17 N3 O2_14.581 1.070967e+07 6.093092e+05 6.140706e+06 7.231768e+06 2.670360e+04 6.636574e+06 5.680704e+06 5.563447e+06 30162.92 7.486423e+06 5.462092e+06 6.028883e+06 18672.68 3.774698e+06 5.026225e+06 6.023550e+06 2.069307e+04 5.870964e+06 5.385059e+06 5.726334e+06 1.705510e+04 4.027754e+06 5.430289e+06 7.601970e+06 16427.487 5.093770e+06 4.896947e+06 5.966848e+06 1.660621e+04 5.318565e+06 5.930488e+06 4.285099e+06 26392.90 5.629880e+06 5.382459e+06 6.143691e+06 2.432805e+04 5.159863e+06 5.976317e+06 7.097296e+06 2.503361e+04 4.093437e+06 5.984941e+06 4.993441e+06 2.576765e+04 5.060752e+06 4.911182e+06 6.368950e+06 3.626857e+06 4.908043e+06 4.055377e+06 1.156666e+07 1.017239e+07 5.622332e+06 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5.834945e+08 5.921873e+08 7.946797e+08 8.567710e+08 8.150317e+08 4.481996e+08 6.191726e+08 8.048432e+08 1.056653e+09 7.636731e+08 6.117263e+08 1.187467e+09 9.084148e+08 4.727207e+08 5.441965e+08 9.164636e+08 9.948364e+08 7.180778e+08 8.803048e+08 7.877101e+08 5.837203e+08 8.261080e+08 8.650983e+08 5.895740e+08 8.907501e+08 7.345914e+08 8.119463e+08 1.292564e+09 8.571817e+08 6.555531e+08 5.998106e+08 1.050459e+09 8.440824e+08 8.512446e+08 6.977254e+08 3.296396e+08 6.006651e+08 8.758419e+08 6.442849e+08 8.380199e+08 6.907229e+08 7.265421e+08 8.792052e+08 7.962618e+08 7.510499e+08 3.374976e+08 7.606028e+08 3.986998e+08 8.649278e+08 4.187831e+08 7.532905e+08 1.016779e+09 7.408413e+08 8.982457e+08 8.806374e+08 9.075254e+08 5.986168e+08 9.187538e+08 1.110227e+09 2.648975e+08 6.497626e+08 6.701910e+08 3.638004e+08 4.493584e+08 5.013291e+08 9.130870e+08 7.097129e+08 4.222756e+08 6.131103e+08 5.765664e+08 9.925334e+08 7.511650e+08 5.869729e+08 1.092175e+09 8.212070e+08 7.232780e+08 1.219196e+09 1.077025e+09 5.555680e+08 8.594274e+08 6.143199e+08 6.853022e+08 7.909334e+08 5.151099e+08 1.018615e+09 9.852548e+08 4.258559e+08 8.305192e+08 7.562404e+08 1.094078e+09 6.612655e+08 7.901486e+08 1.095088e+09 4.132072e+08 7.300117e+08 1.241581e+09 5.775490e+08 6.554777e+08 1.028216e+09 9.348871e+08 7.651344e+08 9.097791e+08 7.096954e+08 9.056925e+08 7.781478e+08 6.387437e+08 1.113839e+09 7.672063e+08 7.580923e+08 9.625258e+08 6.652631e+08 8.602807e+08 6.568992e+08 8.345674e+08 7.223896e+08 1.022959e+09 8.523026e+08 C6 H12 N2 O_14.587 7.126549e+06 4.751394e+06 3.946267e+06 4.541014e+06 2.978167e+04 4.518618e+06 4.962914e+06 4.694501e+06 27953.97 4.437044e+06 3.917227e+06 5.907397e+06 24749.62 4.318679e+06 3.797547e+06 5.002291e+06 2.574441e+04 4.215078e+06 4.609385e+06 5.014022e+06 3.040359e+04 3.621227e+06 3.625061e+06 6.295349e+06 29418.515 4.194868e+06 4.297714e+06 4.616832e+06 1.919873e+04 4.460148e+06 4.382409e+06 4.956110e+06 27418.63 4.658057e+06 4.728549e+06 2.717314e+06 2.719190e+04 4.775790e+06 5.127487e+06 4.960423e+06 3.259269e+04 4.620024e+06 4.401222e+06 4.706540e+06 3.507389e+04 4.424558e+06 4.067548e+06 4.825894e+06 4.796698e+06 3.497987e+06 3.805875e+06 9.041432e+06 7.712228e+06 7.968845e+06 6.121602e+06 6.330503e+06 2.747653e+06 6.439259e+06 8.574844e+06 4.883289e+06 7.972323e+06 8.816287e+06 5.946257e+06 5.748732e+06 4.169603e+06 4.161695e+06 6.744372e+06 4.699427e+06 4.789870e+06 4.549919e+06 3.056634e+06 8.463517e+06 4.299053e+06 4.129096e+06 5.134134e+06 5.511238e+06 5.375220e+06 7.055115e+06 1.002915e+07 6.687412e+06 3.731998e+06 5.147731e+06 4.785577e+06 4.667416e+06 4.638474e+06 6.048225e+06 4.700842e+06 5.172996e+06 4.051250e+06 2.262965e+06 6.342319e+06 7.709966e+06 2.571362e+06 7.075811e+06 6.188477e+06 6.421841e+06 4.870354e+06 5.151515e+06 2.468506e+06 6.134060e+06 4.675063e+06 3.400033e+06 4.180282e+06 5.913765e+06 5.958516e+06 4.107537e+06 4.682903e+06 7.789997e+06 3.968587e+06 3.126662e+06 3.752350e+06 3.048446e+06 3.011968e+06 4.436859e+06 4.759909e+06 7.892205e+06 5.914368e+06 6.360500e+06 6.621259e+06 6.447605e+06 4.412422e+06 4.662230e+06 3.403243e+06 2.070478e+06 3.769105e+06 3.679343e+06 3.748759e+06 3.824491e+06 5.994888e+06 7.830267e+06 6.139871e+06 6.477917e+06 2.810072e+06 5.706115e+06 5.508531e+06 2.583739e+06 3.588232e+06 6.049602e+06 4.792547e+06 5.020362e+06 5.404286e+06 3.695216e+06 5.866097e+06 5.633836e+06 4.826962e+06 3.831855e+06 3.867556e+06 5.292460e+06 5.186922e+06 5.083721e+06 2.696013e+06 3.943454e+06 5.637559e+06 6.946669e+06 5.115287e+06 3.949910e+06 8.302308e+06 6.014404e+06 3.080492e+06 3.312363e+06 5.514249e+06 5.774884e+06 4.411641e+06 5.321038e+06 4.628075e+06 3.777670e+06 5.206333e+06 5.820989e+06 3.811967e+06 5.613841e+06 4.644641e+06 4.619074e+06 8.173834e+06 5.787334e+06 3.893191e+06 3.759622e+06 7.270041e+06 5.462130e+06 5.753490e+06 5.039384e+06 2.075080e+06 4.410025e+06 5.781254e+06 3.955161e+06 4.974741e+06 3.953604e+06 3.200293e+06 5.814600e+06 4.535995e+06 4.740112e+06 2.119876e+06 4.734054e+06 2.512144e+06 5.506005e+06 2.506453e+06 4.586002e+06 6.721130e+06 4.521283e+06 5.551969e+06 6.404197e+06 5.426113e+06 3.550336e+06 5.756483e+06 7.189787e+06 2.661940e+06 4.042039e+06 4.179176e+06 2.173464e+06 3.217337e+06 3.521596e+06 5.589482e+06 4.433497e+06 2.813848e+06 3.852110e+06 3.529241e+06 6.332941e+06 4.808672e+06 3.891869e+06 6.219153e+06 5.153243e+06 4.440033e+06 6.843286e+06 6.888225e+06 3.510401e+06 5.970556e+06 4.374495e+06 4.247571e+06 5.080237e+06 3.177851e+06 6.414631e+06 6.624331e+06 2.700268e+06 5.325445e+06 4.844385e+06 7.562742e+06 4.029915e+06 4.933086e+06 7.202297e+06 2.575044e+06 4.346806e+06 8.622374e+06 3.565342e+06 3.784021e+06 6.881744e+06 5.957286e+06 5.515532e+06 5.785156e+06 4.603588e+06 6.501447e+06 5.937820e+06 3.982561e+06 7.062071e+06 4.864047e+06 4.741474e+06 5.903682e+06 4.162940e+06 5.343546e+06 4.269040e+06 5.689830e+06 4.070681e+06 6.251347e+06 5.873651e+06 C9 H20 N2 O3_14.588 4.296038e+06 2.553880e+06 2.540108e+06 2.406977e+06 2.842178e+04 2.756702e+06 3.225203e+06 2.809827e+06 27425.00 2.462876e+06 2.612438e+06 3.011641e+06 25948.91 2.544032e+06 2.253519e+06 2.790029e+06 2.712290e+04 2.554619e+06 2.659129e+06 2.792892e+06 2.164852e+04 2.698921e+06 2.197095e+06 3.511006e+06 17986.504 2.358014e+06 2.561518e+06 2.386068e+06 2.133666e+04 2.893485e+06 2.684634e+06 3.040347e+06 30759.48 2.538843e+06 2.820865e+06 1.639500e+06 3.105571e+04 2.789846e+06 2.869960e+06 2.972525e+06 2.882823e+04 2.593470e+06 2.899762e+06 2.795472e+06 2.826788e+04 2.427287e+06 2.361271e+06 2.858081e+06 2.845220e+06 3.048566e+06 2.741101e+06 3.077513e+06 3.198094e+06 2.901427e+06 4.230742e+06 3.523100e+06 2.629853e+06 4.031259e+06 5.545851e+06 3.738432e+06 5.850926e+06 4.900818e+06 5.285510e+06 3.188919e+06 2.126236e+06 1.826090e+06 3.073154e+06 3.250216e+06 3.458898e+06 3.109474e+06 3.009780e+06 2.099669e+06 2.857840e+06 4.446866e+06 3.565744e+06 3.703545e+06 2.715007e+06 2.993751e+06 5.530917e+06 2.958383e+06 3.166076e+06 2.571860e+06 2.504418e+06 2.807299e+06 2.459766e+06 2.156780e+06 3.545263e+06 5.013057e+06 2.566571e+06 1.388321e+06 3.132302e+06 2.641882e+06 3.023751e+06 2.781153e+06 3.008922e+06 5.550978e+06 3.480677e+06 2.351838e+06 1.702956e+06 3.320614e+06 2.540575e+06 2.727584e+06 2.223934e+06 3.737796e+06 2.706427e+06 3.222251e+06 1.931624e+06 2.549875e+06 3.432286e+06 2.074502e+06 1.515935e+06 3.499114e+05 3.371040e+06 2.436675e+06 2.263774e+06 2.482300e+06 3.683319e+06 5.949470e+06 2.578559e+06 4.277391e+06 1.483100e+06 2.097758e+06 1.318179e+06 1.273253e+06 2.122808e+06 1.884693e+06 1.834340e+06 2.525791e+06 2.623979e+06 3.695181e+06 4.257504e+06 3.308902e+06 1.510460e+06 3.092162e+06 2.852181e+06 2.467296e+06 2.013575e+06 2.968566e+06 2.412902e+06 2.092914e+06 3.042792e+06 2.405591e+06 3.307928e+06 2.636437e+06 4.998256e+05 2.407094e+06 1.896010e+06 2.620564e+06 1.690339e+06 2.046862e+06 1.646267e+06 2.620688e+06 3.255719e+06 4.266379e+06 3.629200e+06 2.674015e+06 2.621312e+06 2.046488e+06 1.243042e+06 2.791818e+06 2.562268e+06 2.914242e+06 2.171332e+06 3.575867e+06 4.096237e+06 3.056137e+06 3.216037e+06 3.381571e+06 2.424506e+06 2.481070e+06 4.100978e+06 3.707456e+06 2.438381e+06 2.740903e+06 2.967433e+06 2.222544e+06 3.657665e+06 6.608218e+06 3.667127e+06 1.976828e+06 3.843602e+06 2.390091e+06 4.189305e+06 2.437869e+06 3.745049e+06 2.215169e+06 2.363214e+06 2.006060e+06 3.439983e+06 2.743677e+06 2.251222e+06 2.885622e+06 1.129493e+06 2.230899e+06 1.495813e+06 2.262983e+06 2.843033e+06 3.368666e+06 2.899800e+06 4.862833e+06 2.290932e+06 6.633597e+06 2.918492e+06 2.809960e+06 1.144986e+06 2.029818e+06 1.828317e+06 1.848944e+06 2.724283e+06 1.337355e+06 3.074879e+06 2.077040e+06 1.547429e+06 2.514217e+06 2.621138e+06 3.385791e+06 2.362858e+06 2.116924e+06 2.142193e+06 2.922826e+06 1.916793e+06 2.120341e+06 3.559189e+06 3.038190e+06 4.698791e+06 2.876804e+06 2.231679e+06 1.900250e+06 2.815620e+06 1.938449e+06 3.271023e+06 1.655758e+06 2.270656e+06 3.201730e+06 2.154049e+06 3.118386e+06 2.521394e+06 2.351317e+06 1.834508e+06 2.387548e+06 3.607604e+06 2.903508e+06 1.862175e+06 3.309709e+06 2.749345e+06 1.905136e+06 3.778638e+06 2.572316e+06 3.354111e+06 2.457146e+06 2.557066e+06 2.737898e+06 1.536243e+06 2.465035e+06 3.130091e+06 1.656310e+06 2.876274e+06 3.688304e+06 3.844350e+06 1.776302e+06 3.743716e+06 3.709695e+06 C5 H12 N2_14.59 2.954051e+06 2.021874e+06 1.713575e+06 1.705079e+06 2.444694e+04 1.960702e+06 2.058243e+06 1.973760e+06 23654.34 1.712261e+06 1.821332e+06 2.190213e+06 20910.73 1.774014e+06 1.713075e+06 2.054063e+06 2.102849e+04 1.756861e+06 1.915947e+06 1.966266e+06 1.691772e+04 1.736668e+06 1.568172e+06 2.362523e+06 14337.788 1.814202e+06 1.765418e+06 1.983050e+06 1.713243e+04 1.824860e+06 1.854207e+06 2.020961e+06 24950.35 1.867155e+06 2.030545e+06 1.038581e+06 2.500574e+04 2.090805e+06 2.020358e+06 2.161389e+06 2.345367e+04 1.888431e+06 1.890462e+06 1.896307e+06 2.327951e+04 1.824256e+06 1.624028e+06 2.056036e+06 1.932629e+06 1.480578e+06 1.669377e+06 3.460414e+06 2.906581e+06 3.047771e+06 2.940089e+06 2.881092e+06 1.093823e+06 2.445533e+06 3.793592e+06 1.744634e+06 3.166336e+06 3.920925e+06 2.309527e+06 2.249473e+06 1.498412e+06 1.863654e+06 3.308154e+06 1.937665e+06 2.123374e+06 1.980832e+06 1.261349e+06 3.186593e+06 1.686178e+06 1.816819e+06 3.051083e+06 2.287734e+06 1.985531e+06 2.939069e+06 3.959340e+06 2.702453e+06 1.666532e+06 2.176762e+06 2.112534e+06 2.276846e+06 1.926395e+06 2.300148e+06 1.746578e+06 2.213980e+06 1.631522e+06 9.150152e+05 2.534782e+06 2.624635e+06 1.458088e+06 2.900838e+06 2.670997e+06 2.488823e+06 2.135350e+06 2.506453e+06 8.451814e+05 2.707019e+06 2.540806e+06 1.454798e+06 1.979609e+06 2.348872e+06 2.260972e+06 2.060897e+06 2.031056e+06 2.768339e+06 1.945262e+06 1.369674e+06 1.662628e+06 1.361575e+06 1.247189e+06 1.904473e+06 1.964847e+06 3.356320e+06 2.386674e+06 2.521370e+06 2.843426e+06 2.527634e+06 2.074461e+06 1.943348e+06 1.381277e+06 1.020614e+06 1.749830e+06 1.602221e+06 1.405764e+06 1.582362e+06 2.568360e+06 2.833569e+06 2.189040e+06 2.362360e+06 1.136105e+06 2.424813e+06 2.342215e+06 9.970051e+05 1.456161e+06 2.526125e+06 2.061392e+06 1.918985e+06 2.215053e+06 1.505831e+06 2.849437e+06 2.458005e+06 2.114619e+06 1.683687e+06 1.576402e+06 2.192152e+06 2.334037e+06 2.097667e+06 1.206771e+06 1.704190e+06 2.145609e+06 3.027119e+06 2.137986e+06 1.454090e+06 3.273772e+06 2.430684e+06 1.405583e+06 1.223772e+06 2.609992e+06 2.475340e+06 1.995895e+06 2.382731e+06 1.869722e+06 1.670759e+06 1.962107e+06 2.508810e+06 1.455012e+06 2.356345e+06 1.833282e+06 2.239887e+06 3.558108e+06 2.534529e+06 1.729630e+06 1.607965e+06 3.221758e+06 2.313552e+06 2.381310e+06 1.896071e+06 8.123852e+05 1.752881e+06 2.344054e+06 1.852280e+06 2.093395e+06 1.820973e+06 1.936484e+06 2.474664e+06 2.009935e+06 1.992264e+06 8.601835e+05 1.965087e+06 8.056953e+05 2.230422e+06 9.528298e+05 2.032017e+06 2.748303e+06 1.960191e+06 2.409907e+06 2.360758e+06 2.447092e+06 1.653851e+06 2.310028e+06 5.102175e+06 1.099509e+06 1.748430e+06 1.971844e+06 1.010367e+06 1.270645e+06 1.462626e+06 2.292485e+06 1.929531e+06 1.108730e+06 1.600344e+06 1.604748e+06 2.611051e+06 1.866662e+06 1.536672e+06 2.992753e+06 2.240246e+06 1.872232e+06 2.858164e+06 2.898892e+06 1.445799e+06 2.442304e+06 1.569385e+06 1.734374e+06 2.216130e+06 1.325987e+06 2.913292e+06 2.842604e+06 1.067737e+06 2.304195e+06 2.044386e+06 3.126185e+06 1.634392e+06 1.975882e+06 2.811298e+06 1.057895e+06 2.017429e+06 3.520790e+06 1.497408e+06 1.756788e+06 2.739467e+06 2.541727e+06 1.988914e+06 2.587632e+06 1.814365e+06 2.440853e+06 2.467796e+06 1.671392e+06 3.312300e+06 1.925252e+06 2.195178e+06 2.306964e+06 1.746723e+06 2.433088e+06 1.557594e+06 2.247378e+06 1.770049e+06 2.692179e+06 2.259432e+06 C4 H7 N_14.66 1.162277e+07 4.622070e+06 5.624890e+06 5.304169e+06 2.167584e+05 4.846022e+06 5.140181e+06 5.365304e+06 181547.66 4.359552e+06 5.612909e+06 5.920367e+06 192406.80 4.791523e+06 4.559862e+06 5.784264e+06 1.686225e+05 4.623417e+06 4.978897e+06 5.311294e+06 2.687285e+04 5.212541e+06 3.583701e+06 6.899755e+06 715580.496 4.849389e+06 4.499820e+06 4.706402e+06 1.396061e+06 5.872535e+06 5.024971e+06 5.910669e+06 1489939.03 5.566732e+06 4.664140e+06 2.791774e+06 1.366418e+06 5.353449e+06 5.400184e+06 5.962013e+06 1.225760e+06 5.079151e+06 5.357530e+06 5.503800e+06 2.871797e+04 4.845129e+06 4.244885e+06 5.567775e+06 5.288297e+06 3.799212e+06 4.803768e+06 5.934292e+06 6.269058e+06 6.610747e+06 5.621957e+06 6.844215e+06 4.157040e+06 9.891144e+06 8.487893e+06 4.087463e+06 6.906021e+06 9.308596e+06 6.697284e+06 5.272165e+06 3.186992e+06 4.782745e+06 1.437435e+07 4.357772e+06 7.688949e+06 6.249841e+06 5.630532e+06 9.208241e+06 4.782102e+06 4.800182e+06 7.386899e+06 4.507696e+06 5.320177e+06 7.041024e+06 1.294734e+07 7.835244e+06 4.397071e+06 6.059011e+06 5.902211e+06 5.541205e+06 5.117745e+06 7.179288e+06 4.771400e+06 7.682487e+06 5.421206e+06 4.498846e+06 6.684670e+06 7.461399e+06 3.079058e+06 9.386773e+06 7.224650e+06 8.749033e+06 7.452548e+06 7.770287e+06 3.399664e+06 7.032721e+06 7.324310e+06 3.139024e+06 8.023704e+06 7.078888e+06 7.445000e+06 6.261940e+06 8.855975e+06 7.167083e+06 4.724855e+06 3.480860e+06 5.442755e+06 4.649518e+06 3.187588e+06 5.950098e+06 7.418324e+06 7.218104e+06 8.551334e+06 8.764092e+06 1.033640e+07 7.060155e+06 5.726606e+06 5.398139e+06 6.284062e+06 1.732730e+06 4.767969e+06 6.039070e+06 4.911991e+06 2.893167e+06 7.143193e+06 6.198182e+06 7.790085e+06 7.969910e+06 4.112535e+06 6.695704e+06 5.737934e+06 2.885058e+06 5.192709e+06 7.200713e+06 4.469223e+06 3.923667e+06 7.996640e+06 5.464631e+06 7.097873e+06 6.911826e+06 1.057754e+07 3.507920e+06 4.582883e+06 7.823633e+06 6.433970e+06 5.097024e+06 4.250609e+06 4.234558e+06 7.551649e+06 6.997623e+06 1.007969e+07 5.145055e+06 5.594773e+06 4.776135e+06 3.270334e+06 4.980980e+06 8.823300e+06 7.188388e+06 6.982442e+06 4.836464e+06 5.150645e+06 5.015076e+06 5.053398e+06 4.836052e+06 4.565878e+06 7.220366e+06 4.564759e+06 7.928212e+06 7.760090e+06 5.050713e+06 4.191175e+06 2.624340e+06 8.633921e+06 6.274109e+06 6.047702e+06 3.584476e+06 3.309608e+06 5.071888e+06 5.600434e+06 5.695399e+06 4.430850e+06 6.957052e+06 4.725990e+06 5.761839e+06 5.364913e+06 2.948225e+06 4.200493e+06 4.973464e+06 2.768152e+06 5.323827e+06 1.424786e+06 5.701534e+06 6.091532e+06 4.811602e+06 5.535521e+06 4.357580e+06 8.220060e+06 5.322318e+06 5.120482e+06 1.100449e+07 3.301647e+06 5.274023e+06 6.385120e+06 2.675993e+06 3.345147e+06 2.838470e+06 3.755186e+06 4.009649e+06 1.858687e+06 4.560612e+06 2.325986e+06 6.175925e+06 3.644768e+06 2.796202e+06 6.625763e+06 6.144231e+06 2.638261e+06 8.188913e+06 6.174427e+06 3.155505e+06 5.752366e+06 3.573603e+06 4.920334e+06 4.460672e+06 4.730334e+06 6.126779e+06 6.815235e+06 2.791271e+06 6.497658e+06 4.041588e+06 7.928020e+06 3.926502e+06 4.184641e+06 7.247022e+06 2.639334e+06 3.417815e+06 8.948407e+06 2.583517e+06 5.356509e+06 6.903722e+06 6.257097e+06 4.683804e+06 7.891586e+06 4.744102e+06 9.871520e+06 5.957794e+06 5.020221e+06 1.133912e+07 6.896381e+06 5.111802e+06 6.512609e+06 4.733651e+06 5.803278e+06 7.334925e+06 8.336407e+06 3.243946e+06 6.647028e+06 5.085045e+06 L-ORNITHINE 7.959492e+08 4.083499e+08 3.998367e+08 3.923612e+08 1.238473e+06 4.189171e+08 4.356536e+08 4.330935e+08 1721727.01 3.880496e+08 4.153830e+08 4.653929e+08 1705800.07 3.844239e+08 3.560953e+08 4.256073e+08 1.224243e+06 4.106531e+08 4.362993e+08 4.339305e+08 2.157945e+06 3.776021e+08 3.137332e+08 5.420919e+08 509561.688 3.831998e+08 4.012236e+08 4.029330e+08 8.150494e+05 4.069742e+08 4.139200e+08 4.569355e+08 1617883.61 4.238752e+08 4.153665e+08 2.316479e+08 1.572837e+06 4.443881e+08 4.495273e+08 4.485243e+08 1.423902e+06 4.172465e+08 4.444289e+08 3.990998e+08 4.980960e+05 3.882940e+08 3.769353e+08 4.381861e+08 4.496150e+08 3.631280e+08 4.128029e+08 4.926311e+08 4.807546e+08 5.734907e+08 5.054145e+08 5.471260e+08 3.108319e+08 6.835714e+08 6.164196e+08 3.264968e+08 5.994858e+08 6.422151e+08 5.219534e+08 4.594990e+08 2.595488e+08 3.762065e+08 7.421744e+08 3.803008e+08 6.372956e+08 4.580317e+08 4.039169e+08 7.235479e+08 4.094797e+08 3.832725e+08 6.292115e+08 3.977992e+08 3.990338e+08 5.404712e+08 1.013898e+09 6.346374e+08 3.582873e+08 4.950370e+08 4.482458e+08 3.917661e+08 3.851871e+08 5.474728e+08 3.776477e+08 6.211726e+08 4.472220e+08 2.929806e+08 4.824126e+08 5.761455e+08 2.398895e+08 7.598882e+08 6.062437e+08 7.053463e+08 5.982289e+08 6.087329e+08 2.691753e+08 5.306253e+08 5.605545e+08 3.844109e+08 5.892455e+08 5.793662e+08 6.338374e+08 5.530936e+08 6.923128e+08 6.250977e+08 4.068068e+08 3.081507e+08 4.587908e+08 3.506928e+08 2.859060e+08 4.968949e+08 5.887169e+08 6.014758e+08 6.437377e+08 7.531229e+08 8.200970e+08 5.953575e+08 4.524503e+08 4.615933e+08 4.774827e+08 1.888811e+08 4.281032e+08 4.534745e+08 4.522112e+08 2.450188e+08 5.782543e+08 4.810295e+08 5.151108e+08 6.055546e+08 3.523799e+08 5.945427e+08 4.902594e+08 2.097051e+08 4.619564e+08 5.393443e+08 4.036377e+08 3.288939e+08 6.608545e+08 4.007483e+08 5.836615e+08 5.916043e+08 7.741191e+08 3.198157e+08 3.870182e+08 6.366297e+08 4.913304e+08 4.091248e+08 3.208516e+08 3.978972e+08 5.627472e+08 5.756383e+08 7.547417e+08 4.924099e+08 4.425639e+08 3.810401e+08 2.192535e+08 3.990461e+08 6.444705e+08 6.314652e+08 5.089104e+08 3.748649e+08 4.240690e+08 3.941329e+08 4.044850e+08 3.581075e+08 3.576679e+08 6.206976e+08 3.235160e+08 5.270186e+08 6.341013e+08 3.847602e+08 3.305793e+08 2.283207e+08 6.285767e+08 5.016674e+08 4.208142e+08 3.146667e+08 2.638402e+08 3.690550e+08 4.781888e+08 3.733435e+08 3.351462e+08 5.213399e+08 3.588665e+08 4.905094e+08 4.275716e+08 2.527828e+08 3.370439e+08 3.699068e+08 2.420537e+08 4.588035e+08 1.569511e+08 4.474005e+08 5.046530e+08 3.656635e+08 4.838656e+08 2.755976e+08 6.073961e+08 4.204886e+08 4.320537e+08 8.983780e+08 1.745176e+08 4.584832e+08 4.654972e+08 2.140933e+08 2.585122e+08 2.259605e+08 3.108412e+08 3.432843e+08 1.698202e+08 3.962747e+08 2.128212e+08 4.615595e+08 3.482909e+08 2.286266e+08 5.846266e+08 4.363007e+08 2.458473e+08 5.812194e+08 5.049886e+08 2.490954e+08 4.170963e+08 2.976710e+08 4.300691e+08 4.126245e+08 3.692422e+08 4.532057e+08 5.421757e+08 2.393908e+08 5.660539e+08 3.605977e+08 6.679130e+08 3.207751e+08 3.589123e+08 5.626149e+08 2.070043e+08 2.573175e+08 7.296315e+08 2.326426e+08 4.579045e+08 4.858218e+08 4.842824e+08 4.220773e+08 5.990804e+08 3.752994e+08 4.584877e+08 4.739587e+08 3.795696e+08 8.002383e+08 5.370191e+08 3.505436e+08 4.597573e+08 3.785547e+08 5.844853e+08 5.339855e+08 5.858355e+08 2.521964e+08 5.409927e+08 4.124083e+08 "N,N,N-TRIMETHYLLYSINE" 1.292447e+07 6.574319e+06 6.787236e+06 6.745253e+06 3.647672e+04 7.157943e+06 5.982494e+06 7.476150e+06 34849.98 6.275823e+06 6.914294e+06 7.790098e+06 32112.14 6.629462e+06 6.498904e+06 7.451537e+06 3.150521e+04 5.863469e+06 7.104430e+06 5.596910e+06 2.624896e+04 6.079593e+06 7.282410e+06 9.046553e+06 24041.035 5.708777e+06 5.701065e+06 7.564111e+06 2.417312e+04 6.379190e+06 7.279153e+06 8.028616e+06 37888.79 7.101746e+06 5.152406e+06 5.063180e+06 4.443966e+04 6.349813e+06 6.589386e+06 8.764725e+06 3.682364e+04 6.293370e+06 7.946959e+06 6.337497e+06 3.369001e+04 6.237026e+06 6.054087e+06 7.329458e+06 6.207873e+06 6.939861e+06 4.505904e+06 1.873300e+07 9.925570e+06 5.874835e+06 1.296133e+07 7.857688e+06 6.696856e+06 1.089521e+07 7.521409e+06 8.124384e+06 1.482669e+07 2.220882e+07 1.238287e+07 7.989243e+06 5.536979e+06 3.375878e+06 7.463604e+06 6.343462e+06 7.685573e+06 1.132516e+07 8.579144e+06 4.975880e+06 5.769650e+06 8.209515e+06 1.082167e+07 6.430904e+06 1.007258e+07 8.685317e+06 1.783013e+07 9.886577e+06 5.612933e+06 8.025609e+06 1.002507e+07 5.964105e+06 4.733458e+06 5.677722e+06 6.651145e+06 1.185497e+07 1.220772e+07 4.923572e+06 6.707018e+06 7.454225e+06 3.818140e+06 5.420269e+06 6.291638e+06 1.753242e+07 1.274255e+07 7.668878e+06 3.732627e+06 7.228071e+06 7.783544e+06 8.446536e+06 5.110815e+06 1.284457e+07 7.540763e+06 8.867803e+06 4.780622e+06 6.621177e+06 1.024916e+07 7.602232e+06 5.426495e+06 2.122155e+07 1.207355e+07 6.618402e+06 6.075716e+06 6.015013e+06 1.169512e+07 1.595054e+07 6.667866e+06 1.436743e+07 5.890251e+06 6.661870e+06 4.209801e+06 6.041263e+06 4.275474e+06 6.846015e+06 5.534925e+06 6.824093e+06 2.066943e+07 1.060423e+07 8.177989e+06 7.014967e+06 4.515767e+06 7.661154e+06 9.542044e+06 5.083137e+06 4.532533e+06 5.196440e+06 3.998365e+06 4.344110e+06 1.822600e+07 5.270749e+06 9.022586e+06 4.379759e+06 2.586565e+07 6.409281e+06 3.314446e+06 5.079196e+06 4.355243e+06 7.546544e+06 3.383973e+06 4.355129e+06 1.806064e+07 1.075314e+07 9.354283e+06 3.785860e+06 4.181119e+06 6.171836e+06 3.225595e+06 5.861973e+06 7.179037e+06 8.902450e+06 1.286182e+07 7.762856e+06 7.019988e+06 5.753553e+06 8.984155e+06 8.033527e+06 4.968592e+06 6.448766e+06 1.360786e+07 8.574446e+06 9.635798e+06 6.985954e+06 5.869071e+06 4.330421e+06 7.721041e+06 1.278486e+07 9.341684e+06 6.853145e+06 5.150442e+06 5.817003e+06 1.028208e+07 7.702302e+06 1.061891e+07 8.533406e+06 3.447246e+06 8.004908e+06 7.643801e+06 6.638450e+06 7.231369e+06 9.653778e+06 8.551967e+06 6.674191e+06 5.632065e+06 7.288042e+06 1.026327e+07 7.756244e+06 4.632914e+06 1.369735e+07 5.280845e+06 2.777825e+07 7.191185e+06 1.060761e+07 3.778069e+06 5.298663e+06 5.122782e+06 6.977672e+06 7.140968e+06 3.591139e+06 5.381624e+06 3.714865e+06 6.140232e+06 8.615030e+06 5.461016e+06 7.836182e+06 5.615659e+06 5.362377e+06 6.855738e+06 1.048214e+07 5.156272e+06 6.925542e+06 8.007764e+06 7.131381e+06 1.110644e+07 6.843696e+06 5.811328e+06 4.510981e+06 7.820469e+06 5.054821e+06 1.176903e+07 3.869153e+06 7.206896e+06 9.765237e+06 8.528868e+06 6.980758e+06 1.508780e+07 9.321142e+06 4.420207e+06 6.850874e+06 1.064889e+07 6.943028e+06 6.019982e+06 9.651874e+06 9.743390e+06 5.839741e+06 1.022770e+07 4.974367e+06 1.094470e+07 5.866612e+06 5.220270e+06 7.216892e+06 3.200776e+06 9.040101e+06 7.653564e+06 4.616702e+06 7.892228e+06 1.329588e+07 1.027082e+07 7.637571e+06 9.480352e+06 1.034181e+07 C4 H9 N_14.832 2.224347e+06 1.357670e+06 1.425437e+06 1.243070e+06 7.132396e+05 1.452148e+06 1.358558e+06 1.470562e+06 740437.13 1.363040e+06 1.327012e+06 1.665917e+06 601955.58 1.210436e+06 1.136764e+06 1.455628e+06 5.828453e+05 1.477910e+06 1.360076e+06 1.585935e+06 5.244841e+05 1.191098e+06 9.399310e+05 1.861352e+06 628537.737 1.308941e+06 1.400110e+06 1.398206e+06 7.119479e+05 1.247925e+06 1.453261e+06 1.595195e+06 718168.68 1.337715e+06 1.451746e+06 6.210204e+05 6.912090e+05 1.463704e+06 1.566476e+06 1.442379e+06 4.883975e+05 1.289012e+06 1.664580e+06 1.321379e+06 5.106463e+05 1.407520e+06 1.141328e+06 1.488021e+06 9.361603e+05 1.449121e+06 7.805914e+05 3.659439e+06 1.505510e+06 1.235939e+06 1.904586e+06 1.366366e+06 7.050085e+05 1.717062e+06 2.589415e+06 1.718348e+06 3.378123e+06 3.735963e+06 2.052833e+06 1.232184e+06 1.112081e+06 6.822844e+05 1.137505e+06 1.538435e+06 1.464736e+06 1.454476e+06 1.761084e+06 8.550950e+05 1.081267e+06 1.591208e+06 1.868360e+06 1.529628e+06 2.368951e+06 1.588947e+06 2.605693e+06 1.960521e+06 1.031152e+06 1.453074e+06 1.909272e+06 1.390275e+06 1.003365e+06 9.300551e+05 1.062100e+06 2.036733e+06 9.857712e+05 4.139220e+05 1.357578e+06 1.175414e+06 9.230596e+05 9.175080e+05 9.313276e+05 2.982210e+06 1.791009e+06 1.092930e+06 3.760912e+05 1.420759e+06 1.507733e+06 7.745478e+05 8.414024e+05 2.047948e+06 1.091734e+06 1.417779e+06 8.937505e+05 1.113648e+06 2.528952e+06 9.725452e+05 6.410680e+05 4.716259e+06 1.458301e+06 1.046234e+06 1.125698e+06 1.099555e+06 2.157235e+06 2.740321e+06 1.168875e+06 2.755278e+06 9.977933e+05 1.094956e+06 6.895009e+05 5.143913e+05 9.138658e+05 1.217043e+06 6.740436e+05 1.247202e+06 4.412230e+06 1.828428e+06 2.032818e+06 1.412939e+06 8.066829e+05 1.289967e+06 1.523950e+06 9.993971e+05 6.732658e+05 1.067117e+06 6.299439e+05 6.498537e+05 3.148775e+06 1.081921e+06 1.752442e+06 8.460502e+05 4.181863e+06 1.138147e+06 6.473924e+05 8.690506e+05 7.632855e+05 1.487658e+06 5.516183e+05 7.691130e+05 3.228907e+06 2.134686e+06 1.974285e+06 8.517841e+05 8.353477e+05 1.380187e+06 2.953765e+05 1.517609e+06 1.038961e+06 1.340373e+06 2.840534e+06 1.519389e+06 1.523153e+06 1.108714e+06 1.715683e+06 1.454864e+06 9.383140e+05 1.149137e+06 2.941484e+06 1.622645e+06 1.269944e+06 1.438618e+06 1.259435e+06 9.091381e+05 1.270049e+06 2.390828e+06 1.579135e+06 1.321579e+06 1.013877e+06 1.024688e+06 1.788301e+06 1.459619e+06 2.686869e+06 1.353996e+06 5.610971e+05 1.126167e+06 1.683004e+06 1.225837e+06 1.495604e+06 2.128204e+06 7.460149e+05 1.336582e+06 1.035717e+06 1.184189e+06 1.598122e+06 1.584786e+06 1.101369e+06 2.828888e+06 9.340856e+05 6.278905e+06 1.513530e+06 1.585442e+06 4.083705e+05 1.016867e+06 8.709713e+05 1.328352e+06 9.035950e+05 6.230365e+05 1.193429e+06 8.473597e+05 4.638654e+05 1.628717e+06 1.265654e+06 1.191121e+06 1.067595e+06 1.012112e+06 1.098148e+06 2.050997e+06 8.134569e+05 1.166879e+06 1.660512e+06 1.532282e+06 2.254291e+06 1.513970e+06 1.001611e+06 6.285048e+05 1.437131e+06 8.186609e+05 2.140108e+06 6.132660e+05 1.460985e+06 1.840859e+06 1.184739e+06 1.215998e+06 1.692803e+06 1.565131e+06 8.477348e+05 8.640611e+05 1.963320e+06 1.678390e+06 1.129568e+06 1.641180e+06 1.945259e+06 9.788068e+05 1.985536e+06 9.922942e+05 2.173811e+06 1.051289e+06 1.173216e+06 1.319685e+06 1.529207e+06 1.761034e+06 1.609056e+06 8.265760e+05 1.217739e+06 2.854119e+06 2.082292e+06 1.280047e+06 1.620814e+06 1.700012e+06 5-HYDROXYLYSINE 2.486956e+06 2.250209e+06 2.072878e+06 2.180500e+06 3.260812e+04 2.243602e+06 2.324350e+06 2.410358e+06 28849.92 2.172597e+06 2.174403e+06 2.472247e+06 41579.12 2.153456e+06 1.856727e+06 2.419062e+06 3.978651e+04 2.270166e+06 2.261001e+06 2.403180e+06 2.094261e+04 1.936874e+06 1.573086e+06 3.051671e+06 19249.097 2.131951e+06 2.271233e+06 2.193399e+06 2.186640e+04 2.114804e+06 2.241180e+06 2.454002e+06 31289.53 2.230737e+06 2.359851e+06 1.228579e+06 3.751053e+04 2.353150e+06 2.496407e+06 2.249748e+06 3.081637e+04 2.333719e+06 2.485138e+06 2.245638e+06 2.872918e+04 2.004038e+06 2.082790e+06 2.343200e+06 1.406930e+06 2.204645e+06 2.686318e+06 3.001080e+06 2.010382e+06 7.200926e+06 4.437893e+06 2.285344e+06 1.131230e+06 2.872696e+06 3.818038e+06 2.556390e+06 2.364664e+06 3.182020e+06 1.574968e+06 3.023286e+06 2.600673e+06 1.959065e+06 6.467791e+06 1.335490e+06 1.792356e+06 2.215034e+06 2.100810e+06 2.749775e+06 1.684338e+06 1.630959e+06 5.380230e+06 2.221059e+06 2.092211e+06 1.781166e+06 2.276758e+06 2.337309e+06 1.531851e+06 2.908244e+06 1.515605e+06 2.114499e+06 5.122349e+06 4.907308e+06 7.950201e+05 4.849981e+06 2.583717e+06 5.235701e+05 3.782231e+06 3.233624e+06 1.285322e+06 4.655325e+06 1.985191e+06 6.171915e+06 3.905325e+06 2.046650e+06 1.284451e+06 1.371152e+06 5.841114e+06 1.595672e+06 3.506699e+06 2.504644e+06 3.459413e+06 2.616075e+06 3.150469e+06 8.697684e+06 1.589868e+06 1.983448e+06 1.751277e+06 2.071629e+06 3.041643e+06 2.028116e+06 2.756837e+06 5.366512e+06 4.226360e+06 1.979547e+06 3.278904e+06 3.025455e+06 2.024842e+06 2.419891e+06 3.311390e+06 7.203953e+05 1.341679e+06 2.962815e+06 1.763048e+06 7.672784e+05 2.632826e+06 1.435522e+06 1.095365e+06 3.733672e+06 1.435861e+06 3.084997e+06 3.786871e+06 1.611285e+06 1.788688e+06 2.682740e+06 3.179906e+06 2.984121e+06 3.797353e+06 2.166647e+06 2.773485e+06 3.216573e+06 5.331447e+06 1.195183e+06 1.721678e+06 2.152301e+06 2.165580e+06 1.593838e+06 1.572330e+06 2.049132e+06 2.999122e+06 4.728069e+06 4.335834e+06 2.151098e+06 3.042433e+06 1.333668e+06 1.709179e+06 2.179349e+06 3.151460e+06 3.410528e+06 4.747834e+06 1.937334e+06 2.537398e+06 6.754370e+06 1.613377e+06 2.457946e+06 3.976087e+06 4.370604e+06 3.895116e+06 3.761066e+06 2.907356e+06 2.179741e+06 2.061544e+06 1.914383e+06 6.739939e+06 3.163461e+06 3.163710e+06 1.996228e+06 5.756199e+05 3.301573e+06 1.292474e+06 1.178012e+06 1.649959e+06 1.066599e+06 1.976409e+06 3.586321e+06 1.739511e+06 3.023481e+06 2.245696e+06 1.889811e+06 8.944749e+05 3.797425e+06 5.688226e+05 3.048624e+06 2.959150e+06 1.835656e+06 1.246981e+06 3.476839e+06 4.027584e+06 4.045908e+06 2.748894e+06 4.735460e+06 1.508565e+06 1.364922e+06 2.861660e+06 1.702665e+06 9.768255e+05 1.425994e+06 4.079225e+06 2.666631e+06 7.537980e+05 5.194450e+06 1.748042e+06 4.290216e+06 3.207984e+06 1.664645e+06 2.338080e+06 1.981079e+06 2.152516e+06 3.280086e+06 4.119776e+06 2.438751e+06 1.383521e+06 2.022565e+06 1.297398e+06 2.428882e+06 2.645089e+06 3.407827e+06 2.833296e+06 1.566233e+06 2.787872e+06 2.048220e+06 5.496685e+06 3.140036e+06 1.693793e+06 2.538466e+06 2.356571e+06 2.168607e+06 2.892095e+06 6.103986e+05 2.197510e+06 3.480850e+06 2.252847e+06 3.026263e+06 3.246902e+06 3.147065e+06 2.641462e+06 1.772840e+06 4.368485e+06 2.980252e+06 2.854096e+06 1.953700e+06 2.983342e+06 2.573396e+06 8.971319e+05 2.599320e+06 1.270971e+06 2.080816e+06 3.585079e+06 1.835822e+06 ANSERINE 1.012626e+05 2.261003e+05 2.103513e+05 1.882613e+05 3.436782e+04 2.077798e+05 2.192172e+05 2.350169e+05 31490.37 1.842986e+05 2.457110e+05 2.331171e+05 29661.47 1.695975e+05 1.614223e+05 2.540861e+05 2.809912e+04 2.429650e+05 1.875091e+05 2.539364e+05 2.159535e+04 1.408087e+05 1.487711e+05 2.704261e+05 18966.912 2.812833e+05 1.805026e+05 2.017193e+05 2.452209e+04 2.065851e+05 1.954724e+05 2.092278e+05 34077.28 1.833495e+05 3.318952e+05 1.033791e+05 3.863980e+04 1.911571e+05 2.227664e+05 2.271545e+05 3.236969e+04 2.213821e+05 2.166976e+05 2.709471e+05 3.199770e+04 1.648101e+05 1.663969e+05 2.385870e+05 3.536908e+04 2.465664e+05 3.925507e+05 1.479250e+05 4.501864e+04 1.758502e+05 1.104709e+06 3.435294e+04 2.141252e+04 3.038882e+04 1.797497e+06 4.044930e+05 5.712513e+04 2.128901e+06 5.798346e+04 1.398499e+05 2.733940e+05 1.245463e+05 2.466301e+05 4.353168e+04 2.957768e+04 5.876838e+04 3.001898e+04 3.116731e+05 2.199670e+05 2.716853e+04 1.939828e+05 1.110105e+06 7.561144e+04 2.855880e+04 8.673067e+05 1.847707e+06 2.866575e+04 3.062922e+04 2.052750e+05 1.657255e+05 1.263273e+05 3.354278e+05 7.354939e+04 3.060099e+05 4.821134e+04 1.978880e+05 3.552409e+04 1.630049e+05 9.196437e+04 2.867616e+06 3.338218e+04 6.136541e+04 8.963357e+05 4.186426e+05 2.405660e+04 2.942654e+05 3.174568e+04 1.492178e+05 2.063639e+05 6.217771e+05 3.784095e+04 8.080175e+04 6.033583e+05 8.768894e+05 3.463793e+04 7.400175e+04 1.639638e+05 8.709511e+04 4.310183e+04 4.432895e+04 1.107643e+05 6.527543e+05 1.031552e+05 2.614853e+06 2.254459e+05 4.690214e+05 2.235170e+05 3.762111e+04 5.426380e+04 2.405348e+04 3.365736e+04 2.639113e+05 1.806348e+05 3.337452e+04 4.538833e+04 3.208484e+04 2.783305e+04 1.187108e+05 8.508171e+04 5.321942e+04 2.562894e+05 3.433716e+04 3.568569e+04 4.449259e+04 3.306684e+04 2.660168e+06 9.231256e+04 2.657508e+04 1.061872e+05 4.388143e+04 1.761344e+05 1.360916e+05 6.674824e+04 9.093521e+04 2.892439e+04 1.937530e+05 3.219581e+04 1.833046e+05 7.197775e+06 7.363281e+05 4.415047e+04 4.555791e+05 2.807330e+05 5.094193e+04 2.145477e+04 1.065383e+06 4.016941e+05 4.036219e+04 1.650936e+05 8.632180e+04 4.793104e+04 5.479461e+05 6.633777e+04 1.034427e+05 1.364670e+05 3.817225e+04 3.200885e+04 1.077552e+05 7.406156e+04 2.670651e+04 3.538278e+04 7.980590e+05 2.907793e+05 1.681852e+05 1.574620e+05 3.051842e+04 1.230330e+05 4.782650e+04 6.436125e+04 4.080972e+04 2.792371e+04 6.994514e+04 1.246782e+05 3.613534e+04 5.389402e+04 3.563796e+04 3.182927e+04 3.060079e+04 4.243235e+04 4.102857e+05 4.067663e+04 7.303048e+04 1.371661e+05 1.842380e+05 3.962918e+04 2.995448e+04 2.926504e+04 4.707970e+05 1.400618e+05 6.980703e+06 3.810458e+04 5.326868e+04 2.801647e+04 2.844439e+05 1.076169e+05 2.988359e+04 4.207976e+04 1.413410e+05 4.492145e+04 1.568170e+05 3.471335e+04 2.812355e+04 5.502501e+04 7.224939e+04 1.853145e+05 2.610452e+04 9.796391e+05 1.742341e+06 3.471432e+05 1.199439e+05 5.986884e+05 4.361150e+05 5.234892e+04 1.873617e+06 7.090170e+04 3.019441e+04 1.096707e+05 8.431458e+04 1.503072e+05 3.072090e+04 1.881847e+05 5.354699e+04 8.625137e+05 4.163900e+04 2.870109e+04 2.796223e+05 2.868451e+04 6.316169e+04 9.664645e+04 3.651479e+05 1.706100e+05 1.306344e+06 3.609157e+04 3.587561e+04 2.896690e+05 2.957162e+04 3.029469e+05 1.823233e+05 3.027558e+04 3.703244e+05 1.358023e+06 3.062550e+04 3.051805e+04 3.000240e+05 6.786626e+04 9.677957e+05 3.215091e+04 2.088865e+05 170.57428_15.163 4.135349e+06 4.236072e+06 4.225944e+06 3.998965e+06 6.865334e+04 4.384363e+06 4.186795e+06 5.018020e+06 73623.83 3.901698e+06 4.023842e+06 4.912651e+06 59111.83 4.360525e+06 3.402166e+06 4.455699e+06 6.145742e+04 4.381021e+06 4.680856e+06 4.628655e+06 4.603526e+04 3.444216e+06 2.935142e+06 5.934311e+06 47258.072 4.052280e+06 4.171418e+06 4.359267e+06 5.539380e+04 4.130411e+06 4.250139e+06 4.924903e+06 73782.05 4.293958e+06 4.300020e+06 2.050100e+06 8.573898e+04 4.591032e+06 4.981281e+06 4.626427e+06 7.243424e+04 4.284604e+06 4.654485e+06 4.207648e+06 6.986961e+04 3.979817e+06 3.812472e+06 4.623010e+06 1.956762e+06 9.355878e+06 8.693584e+06 2.233238e+06 5.848938e+06 3.966156e+06 7.641017e+06 3.743165e+06 4.540454e+06 9.694881e+06 2.309148e+07 3.077146e+06 5.464136e+06 3.327481e+06 4.585643e+06 1.263274e+07 3.197249e+06 1.566799e+06 2.883127e+06 2.430265e+06 4.922253e+06 4.307906e+06 2.542845e+06 4.857137e+06 3.667574e+06 8.747458e+05 7.364428e+06 8.978751e+05 9.279607e+06 3.268253e+06 9.163088e+06 2.779097e+06 2.887266e+06 3.917109e+06 3.571982e+06 4.020707e+06 1.566849e+06 3.671610e+06 2.509604e+06 3.012750e+06 3.576724e+06 2.276448e+06 9.283518e+06 1.098193e+06 1.982763e+06 1.595326e+06 4.506147e+06 1.181281e+06 1.540611e+06 1.403843e+06 3.341368e+05 1.147792e+06 2.119133e+06 7.727652e+05 1.041349e+06 7.975524e+05 2.994260e+06 3.586833e+06 2.547998e+06 5.957914e+06 1.687630e+06 1.027806e+06 2.186778e+06 5.684292e+06 3.237198e+06 9.548714e+05 8.123744e+05 2.067818e+06 4.523933e+06 5.540192e+05 5.822039e+06 8.594811e+06 4.484243e+06 2.362709e+06 1.078822e+06 6.996669e+04 1.684539e+06 5.351246e+06 1.417557e+06 3.957557e+06 4.984166e+06 6.190649e+06 5.417607e+06 3.814472e+07 5.792077e+06 4.131084e+06 5.257629e+06 2.505448e+06 8.505369e+06 2.208640e+06 4.625314e+06 2.007333e+06 9.623392e+06 1.475625e+05 6.458357e+06 3.940257e+06 3.249414e+06 5.482385e+06 1.840306e+06 3.290770e+06 1.116754e+05 5.392631e+06 4.547861e+06 4.048331e+06 9.482962e+06 3.360741e+06 6.055339e+06 1.017479e+06 2.732723e+06 1.087519e+06 2.482494e+06 6.119172e+06 4.692481e+06 7.689228e+06 2.814423e+06 6.363970e+06 4.001415e+06 2.801810e+06 4.812672e+06 4.694432e+06 3.797528e+06 7.393949e+06 3.129532e+06 4.508920e+06 2.797903e+06 3.305730e+06 1.403262e+06 2.672642e+06 7.619186e+06 4.312865e+06 6.003555e+06 1.169124e+06 2.977244e+05 1.067777e+05 6.475510e+06 3.124728e+06 2.083803e+05 2.425021e+06 4.529553e+06 8.601843e+06 1.360486e+07 8.196192e+06 5.317557e+06 7.517397e+04 4.201943e+05 1.028117e+07 1.216054e+05 3.724517e+06 7.783372e+05 7.009296e+05 5.586484e+06 7.911740e+06 1.515115e+07 5.323644e+06 9.175923e+06 8.427075e+06 3.762029e+06 7.972646e+05 3.938037e+06 3.838742e+06 6.836474e+06 7.163156e+06 8.193825e+06 1.124251e+07 9.870399e+06 4.495701e+06 1.293243e+05 5.200257e+06 1.439361e+07 1.355704e+07 7.905799e+04 3.490521e+06 1.245957e+07 9.868746e+06 9.831118e+06 8.903018e+06 4.725746e+06 4.248444e+06 6.698033e+06 1.221930e+06 6.320412e+06 6.195335e+06 9.499422e+06 2.592152e+05 2.160637e+05 8.211135e+06 1.161450e+07 6.213943e+06 2.868532e+06 1.701823e+05 4.653031e+06 5.170256e+06 9.716870e+06 1.027281e+06 1.728846e+06 1.525970e+07 2.192196e+06 2.239411e+06 5.156471e+06 1.323417e+07 6.775655e+06 3.043042e+06 1.260126e+06 1.100695e+07 3.261452e+06 5.991650e+06 2.393781e+06 2.726276e+06 9.848132e+06 2.879807e+06 1.237260e+05 1.012813e+05 9.403541e+06 6.132800e+06 C17 H19 N5 O3_15.164 4.191241e+06 4.237730e+06 4.235960e+06 4.016439e+06 7.439770e+04 4.382422e+06 4.121727e+06 4.960274e+06 67078.68 4.142553e+06 4.004784e+06 4.974564e+06 64091.98 4.230854e+06 3.401685e+06 4.457657e+06 6.705284e+04 4.478087e+06 4.608433e+06 4.668957e+06 4.979809e+04 3.436131e+06 2.937056e+06 5.932534e+06 50930.549 4.135605e+06 4.152615e+06 4.449824e+06 6.013038e+04 4.087434e+06 4.180121e+06 4.945257e+06 80465.80 4.295666e+06 4.303592e+06 2.181537e+06 9.350679e+04 4.618873e+06 4.846876e+06 4.642152e+06 7.903885e+04 4.328183e+06 4.680675e+06 4.178686e+06 7.599906e+04 4.032158e+06 3.805247e+06 4.635487e+06 1.961127e+06 9.328228e+06 8.706980e+06 2.230255e+06 5.737400e+06 3.950459e+06 7.669747e+06 3.748696e+06 4.518450e+06 9.694103e+06 2.549320e+07 3.062503e+06 5.486570e+06 3.085455e+06 4.595332e+06 1.265529e+07 3.198765e+06 1.584139e+06 2.854093e+06 2.453159e+06 4.878188e+06 4.363691e+06 2.519556e+06 4.730065e+06 3.774337e+06 8.646487e+05 7.268131e+06 9.028833e+05 9.385621e+06 3.342150e+06 9.090566e+06 2.771715e+06 2.972199e+06 3.949564e+06 3.595005e+06 4.030634e+06 1.564549e+06 3.623704e+06 2.498381e+06 3.052366e+06 3.595834e+06 2.275093e+06 9.308240e+06 1.141121e+06 1.977826e+06 1.611224e+06 4.505290e+06 1.181518e+06 1.583593e+06 1.407983e+06 3.341823e+05 1.082658e+06 2.063343e+06 7.772965e+05 9.987833e+05 8.203481e+05 3.007442e+06 3.671885e+06 2.559081e+06 5.959025e+06 1.682380e+06 1.033403e+06 2.227031e+06 5.615923e+06 3.226832e+06 9.694632e+05 8.127619e+05 2.079055e+06 4.484508e+06 5.579101e+05 5.812761e+06 8.615034e+06 4.546470e+06 2.382664e+06 1.083144e+06 7.562108e+04 1.765860e+06 5.417174e+06 1.415848e+06 3.993035e+06 4.981290e+06 6.176420e+06 5.357865e+06 3.790031e+07 5.754721e+06 4.188702e+06 5.199672e+06 2.518523e+06 8.380161e+06 2.337150e+06 4.576826e+06 2.040304e+06 9.547449e+06 1.656036e+05 6.459998e+06 3.914249e+06 3.145105e+06 5.548080e+06 1.849741e+06 3.313399e+06 1.210888e+05 5.416403e+06 4.481972e+06 4.094626e+06 9.323398e+06 3.391512e+06 6.242444e+06 8.130338e+05 2.814312e+06 1.079365e+06 2.476599e+06 6.130870e+06 4.722658e+06 7.732407e+06 2.809092e+06 6.566627e+06 4.006366e+06 2.779855e+06 4.700226e+06 4.689090e+06 3.762300e+06 7.793195e+06 3.292184e+06 4.475742e+06 2.813621e+06 3.336423e+06 1.405858e+06 2.684224e+06 7.637538e+06 4.356249e+06 6.010148e+06 1.169476e+06 2.998410e+05 1.128865e+05 6.504383e+06 3.324795e+06 2.074112e+05 2.425714e+06 4.507167e+06 9.235114e+06 1.336975e+07 8.246774e+06 5.349816e+06 7.968243e+04 4.468140e+05 1.168847e+07 1.333313e+05 3.578473e+06 7.810282e+05 7.006255e+05 5.626281e+06 7.913072e+06 1.629242e+07 5.423779e+06 9.644690e+06 8.320344e+06 3.772686e+06 8.155609e+05 3.913974e+06 3.826051e+06 6.828825e+06 7.188271e+06 8.196047e+06 1.108858e+07 9.503205e+06 4.507237e+06 1.295251e+05 5.188372e+06 1.668945e+07 1.462324e+07 1.046968e+05 3.478221e+06 1.218591e+07 9.844825e+06 9.725474e+06 8.804110e+06 4.868308e+06 4.244402e+06 6.772005e+06 1.216607e+06 6.682988e+06 6.145832e+06 9.589757e+06 3.197325e+05 2.172180e+05 8.247836e+06 1.245487e+07 6.322103e+06 2.900975e+06 1.710455e+05 4.664830e+06 5.177574e+06 9.821281e+06 1.041134e+06 1.707262e+06 1.430775e+07 2.211044e+06 2.264650e+06 5.136444e+06 1.331944e+07 6.735560e+06 3.043543e+06 1.290421e+06 1.100124e+07 3.242106e+06 5.969239e+06 2.352106e+06 2.727478e+06 9.785576e+06 2.900102e+06 1.367702e+05 1.123262e+05 9.344442e+06 6.219989e+06 C11 H26 O2 P2 S_15.576 1.067854e+06 3.383211e+05 3.209923e+05 3.260499e+05 3.237895e+04 3.679611e+05 3.022200e+05 3.319043e+05 29501.53 3.258513e+05 3.250293e+05 4.586778e+05 24957.63 2.895054e+05 2.984549e+05 3.686457e+05 2.309391e+04 3.151809e+05 3.588258e+05 3.191893e+05 1.791212e+04 2.309238e+05 2.387758e+05 4.889876e+05 17745.953 4.060502e+05 2.952922e+05 3.469257e+05 2.116703e+04 3.167778e+05 2.448464e+05 4.263387e+05 31510.37 3.391140e+05 3.557846e+05 1.271840e+05 3.342811e+04 3.727216e+05 3.795311e+05 4.058003e+05 2.807192e+04 3.162222e+05 3.509489e+05 3.426283e+05 2.722025e+04 3.047723e+05 3.023575e+05 3.595695e+05 5.666315e+04 3.128115e+04 7.274235e+05 4.998986e+05 1.424498e+06 2.238312e+05 4.574656e+04 1.271493e+05 6.985821e+05 4.246554e+06 6.569047e+06 3.477920e+05 1.394056e+06 1.512176e+05 1.006144e+05 2.732086e+05 2.449149e+06 9.887097e+04 1.909099e+05 1.373217e+05 1.682968e+05 2.085019e+06 3.325090e+06 2.294502e+05 7.174516e+04 2.667876e+05 1.976148e+05 1.914758e+05 3.142807e+06 2.194306e+05 1.307561e+06 1.425401e+05 3.876256e+04 2.797308e+05 7.795631e+05 4.707032e+05 4.741421e+04 6.108871e+05 2.703116e+04 8.022391e+05 1.361229e+05 6.929621e+04 2.940271e+06 2.853602e+05 3.005803e+04 4.623444e+04 1.447420e+06 2.738899e+05 6.884223e+05 1.067805e+05 9.565838e+04 2.511153e+04 3.013257e+05 6.343648e+04 2.286555e+04 1.346565e+05 5.390320e+04 5.512632e+04 4.454440e+04 5.304018e+04 2.404196e+04 4.132380e+04 5.389472e+04 3.537474e+04 1.703942e+05 1.898174e+05 2.915568e+05 4.669524e+04 3.824134e+05 3.065614e+04 3.234751e+04 7.396681e+04 4.790254e+05 2.768158e+04 2.303028e+05 3.250297e+04 4.716792e+04 4.545186e+04 9.969157e+04 3.247881e+04 2.537080e+04 3.231044e+04 2.542751e+04 2.635343e+06 2.870077e+04 6.364644e+05 9.719740e+05 3.450679e+04 1.838493e+06 3.559003e+04 3.048998e+04 4.272305e+04 1.087259e+05 2.072981e+04 1.287222e+05 5.519699e+04 6.608003e+04 1.088423e+06 2.979877e+04 6.162049e+04 2.425223e+04 9.331946e+04 1.203766e+06 9.097009e+04 9.090245e+04 9.359746e+04 1.101270e+06 2.727907e+04 4.548338e+04 1.654710e+05 6.136615e+04 3.143637e+05 5.057048e+04 3.643710e+05 2.375198e+04 3.645336e+04 4.014519e+04 8.643682e+04 4.637779e+04 5.324780e+04 9.568447e+04 2.586323e+05 7.878889e+04 4.604968e+04 8.406930e+04 6.627911e+04 2.662932e+04 9.310940e+04 1.788513e+05 1.173628e+05 1.122615e+05 1.099175e+05 3.139597e+04 3.674304e+04 1.231775e+06 6.775434e+04 2.019539e+05 1.761938e+06 6.580403e+04 1.106129e+06 2.595946e+04 6.589852e+04 2.717950e+04 1.258185e+05 3.972671e+04 1.620347e+05 5.330785e+04 4.937406e+04 8.793819e+04 2.438557e+04 2.479078e+05 5.323290e+04 5.440538e+04 2.529705e+04 2.883302e+06 8.137106e+05 4.435325e+04 2.944089e+05 2.274573e+04 7.566432e+05 1.117701e+05 5.440790e+05 2.106669e+06 1.950735e+04 2.400674e+05 2.555313e+05 1.406974e+05 1.718745e+05 2.517123e+04 4.514947e+04 4.506545e+05 1.324065e+05 2.959915e+04 9.620725e+05 4.119451e+04 4.649795e+04 9.717609e+04 1.057408e+05 1.060894e+05 7.939033e+04 1.043552e+06 1.181459e+05 3.091250e+05 6.838467e+04 3.602166e+04 1.958216e+05 7.411583e+04 3.428432e+04 3.171248e+04 3.587843e+04 2.751138e+04 7.529203e+04 1.494752e+06 4.178417e+04 6.271444e+04 1.838348e+06 3.044879e+05 2.291010e+05 1.534518e+05 7.917980e+04 1.398450e+05 3.097622e+05 1.134976e+05 8.404017e+05 1.240553e+05 2.107247e+05 4.314261e+05 4.692241e+05 1.156660e+06 7.172163e+04 7.219788e+04 7.096551e+04 1.195208e+06 3.276980e+06 CARNOSINE 7.359501e+05 8.498690e+05 8.226645e+05 8.026806e+05 3.733558e+04 7.950113e+05 8.868536e+05 8.624775e+05 30764.85 7.007603e+05 7.738463e+05 1.209830e+06 25334.88 7.993584e+05 5.148619e+05 9.310595e+05 2.553636e+04 8.435727e+05 9.128172e+05 8.881315e+05 1.978510e+04 6.048142e+05 5.935148e+05 1.160619e+06 18891.420 8.308609e+05 7.315872e+05 9.181962e+05 2.249062e+04 8.654886e+05 7.694204e+05 1.049310e+06 33007.04 6.489066e+05 7.703365e+05 5.300587e+05 3.677755e+04 9.360304e+05 9.429652e+05 8.488843e+05 2.983019e+04 8.446630e+05 9.017931e+05 8.205680e+05 2.903518e+04 7.845598e+05 7.494351e+05 8.877122e+05 2.141399e+05 7.948056e+05 6.303041e+05 6.768972e+05 5.178258e+05 1.137876e+06 4.531313e+05 4.424733e+05 1.069656e+06 3.099053e+06 6.353255e+06 5.853925e+05 2.077817e+06 3.622089e+05 3.777725e+05 2.383243e+06 1.708046e+06 2.046879e+05 3.942585e+05 7.267236e+05 4.108635e+05 2.834071e+06 1.797068e+06 7.854091e+05 4.278545e+05 2.709145e+05 1.147503e+06 4.187921e+05 8.250760e+06 6.222624e+05 1.213369e+06 7.550835e+05 3.336056e+05 5.659201e+05 2.947557e+06 4.952586e+05 8.687154e+04 8.294305e+05 2.924075e+05 2.912939e+06 2.921325e+05 2.203747e+05 5.015652e+06 2.358592e+05 1.018795e+06 3.642093e+05 1.181192e+06 4.357126e+05 8.773491e+05 2.311472e+05 5.457409e+05 3.177675e+05 2.091696e+06 1.220612e+05 7.242146e+04 4.589481e+05 2.579438e+05 2.174444e+05 2.966262e+05 5.019134e+05 3.273105e+05 4.912977e+05 2.714445e+05 1.640935e+05 8.149685e+05 2.186822e+05 6.126248e+05 5.456366e+05 3.939867e+06 9.597778e+04 8.855621e+05 5.025422e+05 1.571525e+06 4.790264e+05 1.131354e+06 2.780425e+04 6.949205e+04 4.290530e+05 4.462163e+05 2.485646e+05 7.308061e+05 3.222987e+05 3.882088e+05 3.328889e+06 9.486162e+05 1.350558e+06 1.160373e+06 2.485898e+05 1.969680e+06 2.029725e+05 3.063131e+05 2.198313e+05 1.398739e+06 2.263959e+04 4.397781e+05 3.357484e+05 9.912886e+04 2.351296e+06 1.923208e+05 4.826526e+05 3.205460e+04 2.644610e+05 2.674448e+06 5.202777e+05 1.391449e+06 5.649877e+05 2.445578e+06 1.723904e+05 8.348100e+05 9.542394e+05 1.430284e+06 1.034609e+06 3.296378e+05 9.447622e+05 1.480173e+05 2.887084e+05 2.444260e+05 3.044870e+05 2.325753e+05 6.838966e+05 3.390730e+05 6.074153e+05 2.720599e+05 4.860718e+05 5.840578e+05 2.512872e+05 4.171075e+05 2.082522e+05 8.783330e+05 3.619879e+05 8.882741e+05 6.324799e+05 5.804167e+05 7.627548e+04 2.491524e+06 3.213383e+05 1.801946e+05 1.230689e+06 4.706974e+05 3.422831e+06 7.039868e+05 1.107221e+06 1.059378e+06 1.372037e+05 5.182892e+05 1.589509e+06 3.310189e+04 5.675866e+05 8.838809e+04 5.730446e+04 9.032158e+05 1.462202e+06 1.946771e+06 5.121998e+05 9.830971e+06 3.848153e+06 6.816711e+05 5.731229e+05 8.713984e+05 6.373054e+05 5.656246e+05 2.481435e+06 1.699004e+06 1.983626e+06 3.226018e+06 1.420706e+06 1.942307e+05 8.029444e+05 5.999915e+05 1.580941e+06 1.285751e+05 3.651801e+05 1.520118e+06 3.928139e+06 1.073889e+06 3.975321e+05 1.617775e+06 1.147206e+06 1.444191e+06 5.855489e+05 2.047565e+06 1.089980e+06 1.887431e+06 7.926779e+04 3.971323e+04 1.518612e+06 7.329297e+05 9.527464e+05 7.015942e+05 1.360329e+05 6.152950e+05 8.017784e+05 1.322346e+06 1.165031e+05 3.807934e+05 6.513280e+06 4.722477e+05 1.052171e+06 8.799075e+05 7.550920e+05 7.311258e+05 6.974468e+05 3.164976e+05 8.766938e+05 8.445605e+05 3.999611e+05 2.552535e+06 3.662331e+05 2.088477e+06 2.386463e+05 7.413592e+04 5.512526e+04 1.942594e+06 2.203977e+06 C9 H14 N4 O4_15.872 1.012916e+05 1.405318e+05 1.675282e+05 2.630782e+05 2.170731e+04 1.588550e+05 1.909500e+05 1.953599e+05 23317.96 1.448224e+05 1.844085e+05 2.491821e+05 26887.87 1.815283e+05 1.189441e+05 2.039757e+05 2.360533e+04 1.786631e+05 1.701282e+05 2.117069e+05 1.838530e+04 1.546380e+05 1.605754e+05 2.299333e+05 18100.396 1.723330e+05 1.486949e+05 2.140927e+05 1.890560e+04 2.095211e+05 1.371921e+05 2.433002e+05 27596.60 1.403294e+05 1.948070e+05 1.225378e+05 2.727267e+04 1.914296e+05 1.895178e+05 2.423848e+05 2.363554e+04 1.731296e+05 2.074420e+05 1.342415e+05 2.674555e+04 1.474674e+05 2.079508e+05 1.895413e+05 1.036559e+05 2.135892e+05 1.802714e+05 2.263848e+05 4.510688e+05 1.923523e+05 1.498657e+05 1.635691e+05 2.370937e+05 7.433036e+05 3.209090e+06 3.003849e+05 5.831168e+05 1.466842e+05 8.422330e+04 1.735615e+05 4.284812e+05 1.125770e+05 1.898885e+05 9.592294e+04 1.062082e+05 1.383887e+06 7.806023e+05 1.958008e+05 1.022787e+05 2.476386e+05 1.882814e+05 1.699221e+05 2.235710e+06 2.509943e+05 3.551303e+05 1.200253e+05 6.919629e+04 2.245618e+05 1.071207e+06 2.042043e+05 2.107519e+04 3.203825e+05 4.703283e+04 6.087053e+05 7.930191e+04 1.130499e+05 7.556507e+05 2.020061e+05 4.026262e+04 2.187329e+04 5.765067e+05 2.628293e+05 2.862695e+05 4.598553e+04 1.013158e+05 5.912201e+04 1.366198e+05 4.023779e+04 4.478478e+04 1.090061e+05 2.759514e+04 5.915271e+04 2.986712e+04 1.148265e+05 4.857813e+04 6.865040e+04 2.611935e+04 4.939557e+04 2.577943e+05 1.598771e+05 1.599848e+05 3.552244e+04 2.207379e+05 2.495124e+04 3.492753e+05 7.419373e+04 3.571235e+05 3.852188e+04 5.909779e+04 3.554577e+04 2.403961e+04 2.707757e+04 2.107204e+04 2.448276e+04 7.273711e+04 3.678096e+04 7.715812e+04 6.110822e+05 1.015842e+05 3.896576e+05 3.947633e+05 2.624142e+04 6.691615e+05 7.883755e+04 8.184087e+04 4.871484e+04 1.794947e+05 4.326749e+04 1.252585e+05 9.580335e+04 3.062281e+04 3.543317e+05 2.591154e+04 2.964902e+04 4.272728e+04 2.769114e+04 5.532069e+05 9.036037e+04 2.011406e+05 1.140172e+05 4.633602e+05 4.406875e+04 8.951184e+04 1.568832e+05 2.078630e+05 1.729205e+05 1.083576e+05 1.340236e+05 2.997040e+04 7.656213e+04 6.878904e+04 1.377816e+05 9.377123e+04 1.721135e+05 1.011861e+05 2.052238e+05 7.762899e+04 1.689744e+05 1.168545e+05 7.934455e+04 1.027079e+05 1.010939e+05 2.381557e+05 1.584499e+05 1.517681e+05 1.526466e+05 1.069155e+05 2.647365e+04 9.075661e+05 4.400980e+04 2.032863e+05 2.485939e+05 1.272920e+05 5.113366e+05 1.858489e+05 2.251170e+05 9.362061e+04 8.473350e+04 3.022498e+04 2.421252e+05 4.641746e+04 2.146939e+05 5.021058e+04 6.491269e+04 1.941158e+05 1.431195e+05 3.311859e+05 4.959697e+04 9.116255e+05 5.240908e+05 3.011758e+04 1.457476e+05 6.839017e+04 1.360896e+05 1.697581e+05 4.886015e+05 2.380729e+05 4.427075e+05 4.132583e+05 2.216845e+05 6.447587e+04 2.911850e+05 1.265828e+05 1.992481e+05 6.850216e+04 1.077966e+05 2.951500e+05 5.806352e+05 2.969923e+05 1.343771e+05 2.164146e+05 1.310231e+05 1.792647e+05 6.240473e+04 5.330924e+05 1.351595e+05 3.028953e+05 3.197234e+04 3.474768e+04 1.607135e+05 2.207088e+05 1.131115e+05 8.346823e+04 5.232570e+04 6.258271e+04 9.059576e+04 3.758810e+05 1.961550e+04 2.972795e+04 8.819367e+05 1.352220e+05 2.090229e+05 9.906684e+04 2.098080e+05 1.231377e+05 1.608738e+05 1.064144e+05 2.711410e+05 7.311768e+04 1.140970e+05 1.824945e+05 3.136177e+05 3.741330e+05 6.024953e+04 3.003097e+04 2.524406e+04 3.620338e+05 4.784949e+05 C51 H84 N9 O9 P3_17.118 5.876545e+04 6.457675e+05 6.900219e+05 7.101974e+05 5.624349e+04 7.010371e+05 4.540197e+05 6.648896e+05 48963.25 6.813896e+05 6.610789e+05 7.743274e+05 40135.71 6.396172e+05 5.871891e+05 7.182134e+05 4.041590e+04 6.817762e+05 6.570361e+05 6.960918e+05 3.872593e+04 4.774183e+05 6.654957e+05 7.891532e+05 48531.378 5.647977e+05 7.828672e+05 5.921046e+05 3.884169e+04 6.958803e+05 6.617312e+05 6.105247e+05 56977.39 6.492490e+05 5.438105e+05 6.989771e+05 5.627322e+04 6.684353e+05 6.537118e+05 6.808770e+05 5.987090e+04 6.517896e+05 8.446451e+05 4.872060e+05 6.393042e+04 7.475094e+05 5.069472e+05 7.316828e+05 5.965320e+04 5.120758e+04 3.870557e+05 5.387686e+04 9.746098e+04 5.095862e+04 4.226843e+04 8.005303e+04 4.197214e+04 3.923603e+04 5.613384e+04 8.418477e+04 7.802423e+04 2.575191e+05 1.378786e+06 1.341648e+05 5.344236e+04 6.060263e+06 5.088259e+06 4.065388e+06 4.266709e+05 3.884046e+04 5.147908e+04 4.448879e+04 9.283621e+04 1.002479e+06 3.302342e+06 8.604652e+04 4.012034e+04 4.108939e+04 2.572639e+05 9.390402e+04 4.312191e+05 1.700419e+06 5.762602e+04 5.168250e+05 1.004898e+05 5.116690e+04 1.113377e+07 4.084995e+04 4.439680e+04 4.234365e+04 7.323491e+04 5.104352e+04 7.050384e+04 7.780104e+04 7.527441e+04 5.746095e+04 9.861629e+04 2.300285e+06 6.775861e+06 4.513974e+04 4.555169e+06 3.726967e+06 2.763199e+05 1.721555e+05 3.152372e+06 1.726851e+05 1.238123e+05 7.474149e+06 1.608134e+05 1.109848e+07 9.878231e+05 4.715289e+04 4.333577e+04 5.220922e+04 8.410238e+04 1.226370e+07 7.352762e+06 7.542296e+06 1.224815e+07 2.186127e+05 9.893788e+04 8.940630e+04 3.982591e+05 6.079633e+04 5.790815e+04 6.145391e+06 4.831485e+04 1.135436e+05 2.138534e+07 4.410698e+04 4.120963e+04 5.463305e+04 1.186576e+05 4.821529e+04 4.134826e+04 1.900464e+05 7.242551e+04 4.873266e+04 4.051664e+04 4.700273e+04 1.257832e+05 7.259272e+04 6.227516e+04 1.059989e+05 6.263103e+04 7.622708e+05 7.366803e+04 4.672425e+04 8.061352e+04 9.194844e+04 4.444510e+04 6.039006e+04 4.108987e+04 6.037619e+04 2.003419e+06 6.385783e+04 8.584325e+04 5.759932e+04 6.172495e+04 6.873557e+05 3.522083e+05 1.518945e+06 2.646220e+05 1.616435e+05 5.014502e+04 6.316351e+04 1.206010e+05 1.065092e+05 6.063167e+04 1.060265e+07 8.033674e+04 8.293017e+04 1.611813e+05 1.972338e+05 6.932010e+04 5.845001e+05 1.978648e+05 2.041417e+05 1.446973e+05 4.642975e+05 5.537866e+04 7.216490e+04 3.940221e+04 6.592211e+04 8.168395e+04 5.698197e+04 5.479946e+04 7.325467e+04 5.576650e+04 8.467714e+04 7.090657e+04 5.008800e+04 5.936304e+04 6.893926e+04 5.366258e+04 5.573545e+04 7.996898e+04 4.378700e+04 4.781152e+04 5.988761e+04 7.381094e+04 9.478007e+04 6.665074e+04 5.677113e+04 3.478991e+06 4.477801e+04 4.436089e+04 5.580980e+04 4.464036e+04 5.026466e+04 6.404079e+04 4.025316e+04 8.548726e+04 4.912963e+04 1.550237e+05 7.438781e+04 5.632943e+04 5.813675e+04 6.948248e+04 9.037041e+04 5.486730e+04 5.038481e+04 4.081000e+04 5.709763e+04 7.315692e+04 5.980165e+04 8.390797e+04 5.841418e+04 8.726482e+04 2.013541e+06 7.265026e+05 6.279551e+04 7.871247e+04 8.042922e+04 1.314599e+05 5.608665e+04 5.162154e+04 4.261204e+05 5.071617e+04 8.382422e+04 3.786663e+04 7.385093e+04 8.951484e+04 6.154165e+04 1.814269e+06 1.402063e+05 2.697184e+06 6.623046e+04 4.132306e+04 4.929901e+05 1.061361e+05 7.664924e+04 2.754858e+05 5.576894e+04 7.512580e+04 5.682710e+04 5.341623e+04 9.059413e+04 5.016558e+06 1.175339e+05 4.582577e+04 5.112012e+04 C9 H21 N3 O_17.132 1.944385e+06 1.063246e+06 1.002144e+06 1.066291e+06 2.301724e+04 1.135952e+06 1.056718e+06 1.172307e+06 22897.72 1.031828e+06 1.183670e+06 1.095745e+06 22613.40 1.030824e+06 8.980305e+05 1.081072e+06 2.474225e+04 1.052302e+06 1.066059e+06 9.665950e+05 2.212425e+04 1.293696e+06 9.414116e+05 1.352367e+06 29110.763 9.645334e+05 1.031856e+06 1.052671e+06 2.362527e+04 1.166784e+06 9.106412e+05 1.298972e+06 35748.71 1.140602e+06 6.046269e+05 2.497069e+05 3.395722e+04 1.061307e+06 1.074216e+06 1.489872e+06 3.346762e+04 1.099061e+06 1.241055e+06 3.816471e+05 3.683700e+04 1.187525e+06 1.075621e+06 1.212446e+06 1.810580e+06 1.822923e+06 2.460211e+06 1.197877e+06 9.836080e+05 8.732896e+05 1.299853e+06 2.430113e+05 1.447967e+06 2.144675e+06 1.600500e+06 1.103698e+06 2.407789e+06 1.767495e+06 2.633919e+06 1.729347e+06 6.337355e+05 9.875218e+05 1.212041e+06 9.751947e+05 5.940616e+05 8.070918e+05 8.561122e+05 8.402698e+05 2.384081e+06 6.867804e+05 1.137642e+06 8.905062e+05 8.785526e+05 1.099820e+06 2.210581e+06 8.899253e+05 1.388869e+06 1.295369e+06 1.039275e+06 8.647282e+05 9.462701e+05 1.159756e+06 8.912065e+05 8.133020e+05 1.071589e+06 8.099805e+05 1.421131e+06 5.755175e+05 8.394262e+05 1.104764e+06 1.261086e+06 7.790741e+05 9.384047e+05 1.734580e+06 1.201989e+06 8.773620e+05 8.657322e+05 6.229070e+05 8.949436e+05 1.050861e+06 1.293227e+06 1.215459e+06 5.840920e+05 1.034142e+06 4.131029e+06 1.183816e+06 1.908989e+06 9.670051e+05 6.354418e+05 8.822778e+05 7.640702e+05 1.049001e+06 1.231058e+06 7.053627e+05 1.457280e+06 2.894112e+06 1.418741e+06 8.723924e+05 6.057587e+05 5.565006e+05 7.533038e+05 1.266957e+06 2.016429e+06 4.877574e+05 1.602865e+06 1.494343e+06 1.166650e+06 1.721744e+06 4.939000e+05 1.861043e+06 7.465962e+05 7.188328e+05 7.767716e+05 7.466751e+05 5.556995e+05 1.515595e+06 6.296586e+05 9.573832e+05 1.538149e+06 7.537681e+05 7.712196e+05 7.834722e+05 1.039258e+06 7.881408e+04 1.638519e+06 8.859298e+05 8.028980e+05 8.304316e+05 1.360917e+06 7.426797e+05 8.317771e+05 8.933617e+05 1.339951e+06 3.018051e+06 5.659598e+05 7.091132e+05 2.870433e+06 2.264560e+06 1.028800e+06 5.833517e+05 8.152989e+05 1.465338e+06 1.283585e+06 1.339485e+06 1.009056e+06 7.403867e+05 1.110213e+06 7.970930e+05 1.790005e+06 1.718467e+06 2.426214e+06 7.005165e+05 1.777618e+06 8.647967e+05 6.574927e+05 7.779068e+05 9.990460e+05 4.332019e+05 4.759967e+05 1.298425e+06 1.095392e+06 7.503654e+05 1.461585e+06 9.222209e+05 1.141186e+06 9.885635e+05 6.590368e+05 1.120588e+06 2.926712e+05 5.522167e+05 5.081206e+05 9.957438e+05 5.522839e+04 9.266268e+05 1.020170e+06 1.062810e+06 1.760481e+06 1.051096e+06 4.070534e+05 1.273333e+06 9.379528e+05 1.036549e+06 1.305996e+06 1.578161e+06 9.119005e+05 4.568088e+05 1.140359e+06 2.215534e+06 4.965435e+05 7.409459e+05 1.713136e+06 7.943250e+05 1.551303e+05 1.006850e+06 1.292835e+05 1.163722e+06 1.136211e+06 1.371659e+06 1.402776e+06 5.999561e+04 5.985854e+05 6.457088e+05 1.903836e+06 7.566309e+05 4.639864e+05 7.721484e+05 1.024517e+06 6.535021e+04 1.478308e+06 8.157068e+05 1.111436e+06 1.306093e+06 7.270470e+05 1.207989e+06 1.765062e+06 1.036421e+06 1.461827e+06 9.454620e+05 1.977045e+06 8.001129e+05 3.783312e+05 1.039673e+06 1.130968e+06 7.485100e+04 6.965784e+05 8.801003e+05 2.275459e+06 1.350319e+06 9.511021e+05 1.375601e+06 5.626139e+04 6.409433e+05 7.821734e+05 2.596311e+06 1.548498e+06 1.583807e+06 1.346753e+06 1.523163e+06 C9 H20 N2_17.208 7.137657e+05 1.085251e+05 1.125399e+05 1.181310e+05 3.220795e+04 1.020837e+05 1.233109e+05 1.343859e+05 35875.66 7.905967e+04 1.207740e+05 1.115915e+05 31751.93 1.128849e+05 1.134103e+05 1.137476e+05 2.989460e+04 1.101896e+05 1.167176e+05 1.105988e+05 2.865030e+04 8.670361e+04 1.054464e+05 1.547280e+05 35515.734 1.026248e+05 1.038937e+05 1.110556e+05 3.096081e+04 1.281751e+05 1.101147e+05 1.241755e+05 60641.57 9.712621e+04 7.574570e+04 1.104826e+05 6.854584e+04 1.082107e+05 1.020696e+05 1.391812e+05 4.368063e+04 1.086617e+05 1.209009e+05 1.344343e+05 4.389566e+04 1.143216e+05 7.027783e+04 1.211333e+05 4.051233e+04 3.598458e+04 7.852129e+04 1.671728e+05 8.273709e+04 4.613175e+04 1.941405e+05 5.063203e+04 4.685713e+04 3.408668e+04 3.652380e+05 4.907842e+04 1.350440e+05 8.294997e+04 1.907851e+05 6.363330e+04 3.473028e+05 4.810882e+04 1.389143e+05 1.671255e+05 1.870245e+05 1.066515e+05 5.577866e+06 1.379537e+05 4.613760e+05 3.341683e+05 7.795115e+04 3.327641e+04 2.273346e+05 1.101803e+05 1.456462e+05 5.923140e+05 2.609617e+04 2.303587e+05 7.502075e+04 2.529138e+05 1.485978e+05 7.350827e+04 2.771519e+05 1.021727e+05 3.350408e+05 6.043567e+04 1.264272e+05 2.004160e+05 1.214124e+05 1.350538e+05 2.949792e+05 4.627670e+05 5.022325e+04 6.897109e+04 3.480882e+05 2.709181e+05 5.581926e+04 3.772077e+04 2.316700e+05 1.188681e+05 1.884653e+05 9.415617e+04 8.000521e+04 5.431310e+04 2.009406e+05 1.330480e+05 2.570911e+05 6.241588e+04 7.675567e+04 3.951329e+04 3.656869e+04 1.448870e+05 7.152595e+04 4.637743e+05 2.475379e+05 1.319511e+05 1.117797e+05 9.185246e+04 2.439713e+05 2.724231e+05 6.499090e+05 2.615821e+05 3.148322e+05 1.126343e+05 1.815379e+06 6.757683e+05 6.620754e+04 5.090982e+04 1.061562e+05 1.793176e+05 1.396415e+05 3.204588e+05 4.704173e+04 3.814276e+05 1.722655e+05 2.458432e+05 1.148326e+05 1.931506e+05 3.469583e+05 1.533561e+06 2.147045e+05 4.800986e+04 8.951404e+04 1.533406e+05 3.072426e+04 1.535943e+05 1.913856e+05 3.884211e+04 4.406974e+05 5.406403e+04 3.343612e+04 3.248941e+04 6.342306e+04 1.623894e+05 2.941579e+04 3.051070e+04 5.002330e+04 6.985251e+04 3.078014e+04 4.509287e+04 4.525500e+04 3.481487e+04 5.741110e+04 4.004302e+04 3.851160e+04 4.567326e+04 3.198774e+04 2.918878e+04 4.410251e+04 2.826688e+04 1.414626e+05 5.674974e+05 4.791302e+05 2.250626e+05 2.826410e+05 3.749077e+05 4.438475e+04 4.533822e+04 2.954406e+04 2.919053e+04 3.078107e+04 5.178302e+04 5.138617e+04 6.196536e+04 3.415332e+04 4.019691e+04 3.844983e+04 3.071334e+04 5.564230e+04 4.822545e+04 4.260606e+04 3.156226e+04 4.660397e+04 3.435078e+04 2.451728e+05 2.853095e+04 3.033235e+04 6.618881e+04 5.969083e+04 3.161541e+04 3.164582e+04 3.515350e+04 3.326422e+04 2.623958e+04 2.917584e+04 2.737681e+04 5.796573e+04 2.983309e+04 2.818841e+04 3.988540e+04 5.463445e+04 2.891532e+04 5.843254e+04 4.179083e+04 2.993071e+04 2.737117e+04 3.095613e+04 2.633920e+04 3.355670e+04 4.210748e+04 2.775305e+04 3.658559e+04 4.105537e+04 3.944847e+04 2.939618e+04 3.388203e+04 2.914588e+04 4.537883e+04 8.361620e+04 4.092867e+04 7.096226e+05 4.794960e+04 3.873187e+04 5.727563e+04 2.862938e+04 3.334621e+04 2.778575e+04 4.434839e+04 3.131503e+04 4.460494e+04 3.187887e+04 4.423957e+04 3.562549e+04 3.992926e+04 3.290720e+04 2.756095e+05 4.908421e+04 4.638513e+04 2.929099e+04 3.417701e+04 4.156452e+04 2.998190e+04 3.062388e+04 4.693581e+04 2.795396e+04 4.606765e+04 3.983725e+04 3.121842e+04 Glutaronitrile (2)_17.79 1.434854e+05 7.264682e+05 8.398127e+05 7.264503e+05 8.785682e+04 7.159769e+05 7.470522e+05 8.019535e+05 62689.80 7.935963e+05 8.269391e+05 7.033047e+05 61577.07 6.608307e+05 6.932941e+05 1.064343e+06 6.630065e+04 6.569515e+05 6.486801e+05 7.061370e+05 7.180558e+04 7.892689e+05 7.460932e+05 9.565676e+05 116842.281 7.082993e+05 7.194339e+05 7.419922e+05 1.192120e+05 7.708533e+05 6.113759e+05 7.230860e+05 123797.64 1.043001e+06 5.269743e+05 7.690054e+05 1.767176e+05 7.548455e+05 7.715744e+05 7.103580e+05 1.307516e+05 8.395304e+05 9.183961e+05 6.930522e+05 1.334907e+05 7.975885e+05 5.153971e+05 8.924436e+05 3.474254e+05 1.154179e+05 2.313901e+05 1.330796e+06 8.359990e+05 4.965498e+05 1.598192e+05 3.653347e+06 1.548111e+05 6.393947e+04 4.606607e+05 4.676831e+06 2.478621e+05 7.332192e+05 3.293680e+05 3.361609e+05 1.468610e+05 1.004571e+06 1.404681e+05 1.908197e+05 7.781585e+04 3.586827e+05 1.414420e+06 9.201366e+04 3.093599e+05 1.287534e+06 1.646797e+05 3.806491e+05 7.953728e+04 6.646364e+06 1.057352e+05 2.323656e+05 1.350029e+05 5.460643e+06 2.917306e+05 8.360605e+05 1.770346e+05 3.941388e+06 3.500827e+05 1.718174e+05 1.092737e+05 7.069860e+04 3.689380e+05 6.292637e+06 9.252642e+04 3.860817e+05 2.815303e+05 6.694503e+05 2.998040e+06 1.806571e+05 5.368863e+05 1.449511e+05 7.166401e+04 1.590615e+06 8.176919e+04 1.788680e+06 2.248498e+05 1.199730e+05 1.750497e+05 1.212077e+05 1.286884e+05 1.952023e+05 2.099008e+05 9.634549e+04 1.534423e+05 2.607857e+05 1.458454e+06 1.076540e+05 8.358004e+06 3.886683e+05 1.122412e+05 1.446231e+05 2.144169e+05 1.200188e+05 1.819193e+05 1.367727e+05 1.158095e+05 2.286834e+05 1.640695e+05 1.640166e+05 8.693195e+04 1.380949e+05 1.077806e+05 9.075701e+04 1.143788e+05 1.246714e+05 6.168057e+04 6.203536e+04 1.557212e+05 1.738335e+05 9.428732e+04 6.405282e+04 3.576172e+05 1.489997e+05 7.940594e+04 4.498050e+05 6.023994e+04 2.861134e+05 1.524988e+05 2.319677e+05 5.064175e+05 3.795605e+05 2.174057e+05 5.599925e+05 2.232949e+05 2.629545e+05 1.706670e+05 1.947735e+05 3.802370e+05 1.048964e+05 1.819325e+05 3.487614e+05 1.470407e+05 6.591709e+05 2.648753e+05 6.009642e+05 1.861926e+05 2.607093e+05 1.774848e+06 1.165770e+06 2.881313e+05 1.224917e+06 6.863271e+05 2.880648e+05 1.844576e+05 2.539672e+05 2.340069e+05 3.296724e+06 2.680654e+05 1.560407e+06 1.357983e+05 1.619532e+06 3.022594e+05 3.885791e+05 1.823666e+05 4.971350e+05 3.326399e+06 1.808695e+05 4.548700e+05 2.520749e+05 7.728055e+04 1.621586e+05 1.827926e+05 1.420374e+06 1.462492e+05 7.025385e+05 4.603470e+05 5.424485e+05 1.113839e+05 1.104515e+05 1.817443e+05 8.876792e+04 6.875384e+04 1.967136e+05 4.142610e+05 1.677145e+05 1.100539e+05 1.140802e+07 1.326706e+05 2.090873e+05 1.705694e+05 2.761953e+05 3.165754e+05 2.034488e+05 1.061451e+05 2.879135e+05 3.379639e+06 4.318108e+05 1.742424e+05 1.689012e+05 4.860841e+07 3.535796e+05 1.071352e+05 1.648799e+05 2.612892e+05 3.061484e+05 2.182716e+05 2.020008e+05 2.876737e+05 2.778060e+05 1.456826e+06 1.334903e+05 8.529870e+05 3.861538e+06 2.388769e+05 4.957230e+05 4.339894e+05 2.206577e+05 1.738332e+05 1.036786e+05 6.284810e+04 1.209810e+05 3.743002e+05 2.178883e+05 1.525523e+05 9.925651e+04 1.236254e+05 4.319814e+05 1.091355e+05 2.682575e+05 1.373328e+05 8.893051e+04 8.819690e+04 3.346245e+05 1.024057e+05 6.986708e+05 1.404945e+05 3.289531e+06 1.577505e+05 3.834865e+05 2.724227e+05 5.053464e+05 1.680741e+05 8.109332e+04 HISTAMINE 1.119169e+05 5.879239e+05 7.073491e+05 6.022955e+05 2.621610e+04 5.520148e+05 6.041586e+05 6.877716e+05 24582.51 6.477790e+05 6.729843e+05 5.718809e+05 22818.63 5.310489e+05 5.600722e+05 9.018711e+05 2.392916e+04 5.312333e+05 5.017487e+05 5.774834e+05 2.414318e+04 6.659827e+05 5.991383e+05 8.064719e+05 37230.318 5.739297e+05 5.656710e+05 6.223823e+05 3.138323e+04 6.237180e+05 4.893519e+05 5.688033e+05 41753.39 8.745446e+05 4.305950e+05 6.500532e+05 5.706420e+04 5.624748e+05 6.605483e+05 6.346864e+05 4.222394e+04 7.601343e+05 8.866261e+05 8.509812e+04 6.298292e+04 7.435644e+05 3.890880e+05 8.751422e+05 2.309106e+05 8.529614e+04 1.393231e+05 1.157449e+06 6.988356e+05 4.037209e+05 1.243567e+05 3.502848e+06 1.130210e+05 3.288346e+04 4.038651e+05 3.968275e+06 1.169342e+05 7.720095e+05 2.584353e+05 2.905671e+05 6.973317e+04 1.071653e+06 1.098577e+05 5.319529e+04 4.410413e+04 2.949521e+05 1.158353e+06 6.246702e+04 2.194060e+05 1.111538e+06 7.958896e+04 3.181738e+05 5.008353e+04 5.769574e+06 7.436542e+04 1.923972e+05 1.050426e+05 4.548658e+06 1.620118e+05 6.833868e+05 1.453022e+05 4.023981e+06 2.494792e+05 1.385895e+05 7.604319e+04 3.966747e+04 3.269773e+05 5.363219e+06 5.255090e+04 3.122093e+05 1.749816e+05 5.185063e+05 2.704578e+06 9.292424e+04 4.299948e+05 1.074231e+05 4.148533e+04 1.384969e+06 4.934014e+04 1.474231e+06 1.366422e+05 6.461635e+04 7.142794e+04 8.159929e+04 6.884566e+04 1.525675e+05 1.289388e+05 5.728194e+04 1.036848e+05 1.857101e+05 1.136318e+06 3.408747e+04 7.141627e+06 2.736549e+05 6.813108e+04 7.032920e+04 1.276579e+05 3.761614e+04 1.001002e+05 9.705932e+04 5.446043e+04 1.184318e+05 1.201043e+05 6.769247e+04 5.567365e+04 1.043341e+05 2.983695e+04 3.669017e+04 4.927538e+04 3.549476e+04 2.402183e+04 2.427396e+04 4.702842e+04 8.041718e+04 6.806559e+04 2.915819e+04 2.718080e+05 1.061589e+05 4.957040e+04 3.861693e+05 2.303085e+04 1.844629e+05 1.164863e+05 1.244863e+05 3.838629e+05 3.075203e+05 1.669925e+05 4.698040e+05 1.691154e+05 2.043424e+05 1.291419e+05 1.590175e+05 2.025677e+05 7.227313e+04 1.486202e+05 2.707805e+05 5.964527e+04 4.805807e+05 2.319681e+05 5.831722e+05 9.450030e+04 2.085368e+05 1.494349e+06 9.230747e+05 1.840251e+05 1.055036e+06 5.388372e+05 1.390053e+05 9.142356e+04 2.232606e+05 1.215251e+05 2.767794e+06 1.473233e+05 1.292401e+06 8.444933e+04 1.252584e+06 1.603264e+05 7.964483e+04 1.282334e+05 4.106858e+05 2.816993e+06 1.298024e+05 3.879214e+05 1.142013e+05 2.453899e+04 1.097384e+05 7.642426e+04 1.130091e+06 4.232287e+04 5.486595e+05 4.238515e+05 4.383514e+05 4.831339e+04 5.367024e+04 1.432947e+05 5.791741e+04 3.171292e+04 1.647379e+05 2.802376e+05 1.312217e+05 7.663560e+04 9.701040e+06 3.097826e+04 1.722121e+05 1.354384e+05 2.272894e+05 2.218766e+05 1.597884e+05 5.982494e+04 1.775000e+05 3.229078e+06 3.276434e+05 1.237985e+05 1.427302e+05 4.098262e+07 3.083439e+05 7.242854e+04 1.266062e+05 1.452059e+05 2.657530e+05 1.671596e+05 1.535687e+05 2.354708e+05 2.410678e+05 1.180297e+06 9.385874e+04 6.819962e+05 3.674031e+06 7.855268e+04 4.240867e+05 3.814593e+05 1.062990e+05 1.424787e+05 3.935543e+04 2.478150e+04 6.386958e+04 2.751728e+05 1.823341e+05 6.329748e+04 6.297558e+04 4.280585e+04 3.058023e+05 3.359999e+04 3.745446e+04 1.025277e+05 2.509651e+04 5.636519e+04 2.913461e+05 6.899559e+04 5.265737e+05 1.101587e+05 2.784371e+06 1.246096e+05 3.003176e+05 2.377579e+05 4.606538e+05 6.402701e+04 5.111466e+04 221.02838_18.247 7.303494e+06 5.069917e+06 9.292846e+06 1.075681e+07 1.369968e+07 9.170993e+06 9.581746e+06 7.560559e+06 7331332.81 7.477054e+06 9.821435e+06 3.217669e+05 6479486.03 8.288217e+06 9.258162e+06 7.466257e+06 2.275892e+05 7.524240e+06 1.029254e+07 3.902524e+05 6.345930e+06 8.498124e+06 8.482532e+06 9.138658e+06 266781.452 6.348658e+06 1.054111e+07 9.484784e+06 4.138587e+06 6.785908e+06 8.295251e+06 7.844367e+06 10070802.15 2.688786e+05 1.083019e+07 9.870269e+06 1.003645e+07 5.584903e+06 5.285664e+05 8.368926e+06 6.305409e+06 7.769500e+06 7.015598e+06 1.402154e+07 1.168398e+07 9.342897e+06 3.059047e+05 1.218677e+06 8.477924e+06 1.068330e+07 9.978225e+06 6.459011e+06 7.228254e+05 6.092523e+06 7.373366e+06 2.717198e+07 4.748780e+05 4.558173e+05 6.910942e+06 3.857031e+05 1.364311e+07 2.861608e+05 1.105154e+07 6.269412e+06 2.157188e+06 6.639976e+05 3.078202e+05 4.149691e+06 4.349681e+05 2.116736e+05 6.542974e+05 4.661695e+06 4.897873e+05 8.587021e+06 1.040811e+07 1.538119e+05 8.214095e+05 5.625286e+06 9.657398e+06 4.258192e+06 6.029424e+05 8.945272e+06 7.187387e+06 9.075257e+06 7.211287e+06 8.783424e+06 1.747874e+07 2.229659e+05 3.204493e+05 8.894294e+06 2.341691e+05 1.733715e+07 6.686082e+06 3.722352e+05 9.338044e+06 7.432569e+06 6.477969e+06 1.780776e+07 5.165734e+06 1.603828e+07 7.251838e+06 8.604379e+06 1.444284e+07 1.473341e+07 3.619332e+05 2.478124e+05 3.043203e+05 6.429458e+06 2.707671e+05 6.971708e+05 1.663739e+05 2.999531e+05 1.740323e+07 8.409571e+06 6.807243e+06 4.129328e+05 6.855347e+05 9.225850e+06 8.728786e+06 3.480793e+05 8.669347e+06 6.036011e+06 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4.718063e+05 8.993205e+05 4.835191e+05 2.554898e+05 1.041107e+07 6.666186e+05 1.289646e+07 7.225968e+06 1.006134e+07 2.661453e+05 7.306314e+06 6.872379e+06 8.007954e+06 2.861794e+06 8.351179e+06 2.890511e+06 4.691468e+06 1.063492e+07 5.354873e+05 8.518203e+06 5.904343e+05 6.628668e+06 7.256109e+06 5.495224e+06 1.473270e+07 3.983428e+05 4.763231e+06 1.057442e+07 2.276422e+07 9.364111e+06 4.164787e+05 6.220357e+06 8.641416e+06 7.779514e+06 6.794320e+06 1.600916e+07 2.120682e+06 1.052109e+07 5.099793e+06 1.108773e+07 9.266048e+06 6.333692e+06 4.422734e+06 5.518958e+06 9.994938e+06 1.636593e+05 6.972038e+05 2.791140e+06 8.579300e+06 5.562135e+05 6.435477e+05 8.605885e+06 3.927188e+06 7.838395e+06 7.382172e+06 8.928862e+06 1.245998e+07 8.906882e+06 1.538181e+07 3.733209e+05 7.953993e+06 7.230604e+06 7.790027e+06 107.51017_18.496 6.928313e+07 2.493974e+07 2.935171e+07 4.715311e+07 3.134807e+07 4.961592e+07 4.088752e+07 1.852434e+07 6170675.99 3.641137e+07 1.628173e+07 7.897389e+07 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2.741844e+07 5.709398e+07 1.213939e+08 2.177208e+07 4.528248e+07 3.574329e+07 2.055045e+07 1.623758e+07 2.391517e+07 1.127282e+07 2.962754e+07 6.012502e+07 4.259000e+07 1.483095e+07 3.784541e+07 2.935657e+07 4.556472e+07 3.861207e+07 1.992199e+07 145.02249_18.594 7.037501e+05 2.463302e+05 2.242509e+05 2.126707e+05 9.572687e+04 2.216883e+05 1.842541e+05 2.192956e+05 182785.45 2.437810e+05 3.144408e+05 1.914183e+05 147174.37 1.578939e+05 1.659812e+05 1.922553e+05 5.129593e+05 2.670961e+05 1.845674e+05 2.121355e+05 2.467455e+05 2.855630e+05 2.032405e+05 2.159366e+05 164608.210 2.466103e+05 2.234611e+05 2.427590e+05 1.720501e+05 1.915830e+05 1.555666e+05 1.597556e+05 150995.83 2.367502e+05 1.685323e+05 2.402126e+05 1.520246e+05 2.006401e+05 1.845199e+05 1.880028e+05 1.517242e+05 2.888195e+05 2.442255e+05 2.373465e+05 1.612120e+05 2.094060e+05 2.196318e+05 2.096097e+05 2.039479e+05 1.672897e+05 2.262818e+05 1.495803e+05 1.646855e+05 1.702947e+05 2.661222e+05 2.467124e+05 1.478293e+05 2.197836e+05 1.982234e+05 1.719604e+05 1.684611e+05 2.617550e+05 1.766549e+05 2.044345e+05 1.649913e+05 1.947077e+05 2.084456e+05 2.058650e+05 1.653761e+05 1.781265e+05 1.328518e+05 1.683032e+05 2.032789e+05 1.580936e+05 2.014682e+05 2.535968e+05 1.895349e+05 1.719006e+05 6.555488e+05 2.580819e+05 2.023553e+05 1.666215e+05 1.810828e+05 1.923708e+05 1.768201e+05 1.852685e+05 1.585406e+05 1.930960e+05 1.647279e+05 2.611722e+05 1.761988e+05 1.788217e+05 1.537757e+05 2.090296e+05 2.388813e+05 1.489711e+05 1.563848e+05 1.794155e+05 1.581541e+05 1.770050e+05 1.794434e+05 1.578029e+05 1.544963e+05 2.145498e+05 1.597874e+05 1.806067e+05 1.596756e+05 1.621388e+05 1.496874e+05 2.066455e+05 1.529030e+05 1.520891e+05 1.969657e+05 2.742073e+05 2.005949e+05 1.723924e+05 1.751512e+05 1.978697e+05 1.925256e+05 2.479323e+05 1.808437e+05 1.801409e+05 2.020495e+05 1.663514e+05 1.797021e+05 1.808605e+05 1.393022e+05 2.006730e+05 2.733269e+05 2.645586e+05 1.838483e+05 6.707498e+05 2.346579e+05 2.112336e+05 1.916132e+05 1.796446e+05 1.903854e+05 2.605416e+05 3.210320e+05 2.645085e+05 2.402591e+05 1.419897e+05 1.702397e+05 1.835797e+05 1.527515e+05 2.204537e+05 2.105169e+05 1.588949e+05 2.535971e+05 1.978660e+05 1.870398e+05 1.661829e+05 1.687373e+05 1.507271e+05 2.614655e+05 1.518796e+05 1.681415e+05 1.402500e+05 1.418701e+05 1.653964e+05 1.731332e+05 1.682156e+05 1.612706e+05 2.509679e+05 1.770020e+05 2.016805e+05 1.548682e+05 1.829117e+05 2.122251e+05 2.066119e+05 2.888451e+05 2.417290e+05 1.597242e+05 2.238256e+05 1.961538e+05 2.166257e+05 1.645442e+05 1.805846e+05 1.637258e+05 1.582733e+05 1.884529e+05 1.679230e+05 1.689244e+05 1.812100e+05 1.649851e+05 1.595954e+05 1.878338e+05 2.107501e+05 1.323263e+05 1.757382e+05 1.371064e+05 3.137252e+05 6.576864e+06 1.494702e+05 1.491130e+05 1.202070e+05 1.843454e+05 2.193284e+05 2.091513e+05 3.085514e+05 2.957499e+05 2.002909e+05 1.848359e+05 2.161685e+05 1.987915e+05 1.948737e+05 2.446791e+05 1.792509e+05 1.637065e+05 1.810721e+05 1.891414e+05 2.003538e+05 1.719328e+05 1.466887e+05 2.112060e+05 1.651093e+05 2.310226e+05 1.606780e+05 1.897499e+05 1.496832e+05 2.192365e+05 2.212229e+05 1.787086e+05 2.981771e+05 1.585626e+05 1.846290e+05 2.547359e+05 1.529385e+05 1.523461e+05 1.868657e+05 1.459902e+05 1.508421e+05 1.461505e+05 1.692413e+05 1.558318e+05 2.078196e+05 1.843430e+05 2.248971e+05 2.538561e+05 9.956863e+04 2.151945e+05 1.282723e+05 1.771448e+05 1.624910e+05 1.706804e+05 2.081773e+05 1.733386e+05 1.553470e+05 2.488738e+05 1.767201e+05 2.921506e+05 1.640858e+05 1.978837e+05 1.759843e+05 1.766579e+05 2.522545e+05 1.591957e+05 1.656469e+05 2.710606e+05 1.773737e+05 1.515435e+05 2.509813e+05 C H3 N O5_18.596 4.544193e+07 1.935922e+07 1.844456e+07 4.929836e+06 1.433553e+07 1.764114e+07 6.239288e+06 1.748546e+07 15056137.81 1.684671e+07 2.225841e+07 1.481727e+07 12121304.40 5.360267e+06 1.473241e+07 1.618479e+07 3.225254e+07 1.446784e+07 1.394908e+07 1.401413e+07 1.371419e+07 1.539723e+07 1.482541e+07 1.552572e+07 8574854.646 1.422936e+07 1.443245e+07 1.462216e+07 1.071526e+07 1.402815e+07 1.481863e+07 1.633887e+07 9869324.42 1.392695e+07 1.260283e+07 1.333298e+07 1.041375e+07 1.618428e+07 1.519605e+07 1.512000e+07 9.587735e+06 1.320573e+07 1.434447e+07 1.593540e+07 1.092597e+07 1.482322e+07 1.386727e+07 1.449773e+07 1.173617e+07 1.258863e+07 4.255383e+06 1.158979e+07 1.363532e+07 4.197332e+06 1.363515e+07 1.374112e+07 4.249490e+06 1.417106e+07 1.313117e+07 1.093705e+07 1.178122e+07 1.089191e+07 1.297208e+07 1.333329e+07 1.416411e+07 1.127308e+07 1.358811e+07 1.109298e+07 3.800330e+06 1.051317e+07 1.513515e+07 1.088020e+07 1.329247e+07 1.164262e+07 1.466591e+07 1.440021e+07 1.086553e+07 1.350939e+07 3.830103e+07 1.210352e+07 4.600450e+06 1.135455e+07 1.310218e+07 1.194810e+07 1.222787e+07 1.282769e+07 1.239450e+07 1.635957e+07 1.378045e+07 1.262467e+07 1.154763e+07 1.560260e+07 4.216361e+06 1.634875e+07 4.551703e+06 1.276429e+07 1.142372e+07 1.411053e+07 1.337999e+07 1.289785e+07 1.235719e+07 1.137286e+07 1.167544e+07 1.405545e+07 1.329619e+07 1.160259e+07 1.213111e+07 1.097220e+07 1.103260e+07 1.408037e+07 1.350947e+07 1.151502e+07 5.700178e+06 1.599499e+07 1.535624e+07 1.639349e+07 1.239714e+07 1.462579e+07 1.288399e+07 1.548173e+07 1.199108e+07 1.464949e+07 1.647528e+07 1.260502e+07 1.337702e+07 1.439642e+07 1.349887e+07 4.400058e+06 1.964970e+07 1.807541e+07 1.194750e+07 5.110681e+07 1.425005e+07 1.212765e+07 1.471962e+07 1.462540e+07 1.167226e+07 1.186517e+07 1.432468e+07 1.275878e+07 1.199113e+07 1.108248e+07 1.220670e+07 3.504947e+06 1.351015e+07 1.383010e+07 1.378141e+07 1.476803e+07 1.721152e+07 1.302313e+07 1.396232e+07 1.119133e+07 1.013020e+07 1.193440e+07 1.737356e+07 1.488953e+07 1.125556e+07 1.403714e+07 1.117356e+07 1.263062e+07 1.491817e+07 1.460308e+07 4.653834e+06 1.321442e+07 1.440808e+07 1.615795e+07 1.335011e+07 1.400464e+07 1.599110e+07 1.761789e+07 2.264940e+07 1.659121e+07 1.315400e+07 1.300812e+07 1.212715e+07 1.599552e+07 1.230697e+07 1.384950e+07 1.203241e+07 1.177623e+07 1.229229e+07 1.430836e+07 1.316995e+07 1.393000e+07 1.141042e+07 1.068076e+07 1.678221e+07 1.345516e+07 1.497166e+07 8.699320e+06 1.059855e+07 2.010740e+07 4.516008e+08 1.167156e+07 1.032443e+07 1.357130e+07 1.458481e+07 4.089273e+06 1.203047e+07 2.033309e+07 2.067428e+07 1.407185e+07 4.494471e+06 1.574099e+07 1.460377e+07 1.113181e+07 1.854059e+07 1.588154e+07 1.011770e+07 1.373321e+07 1.530561e+07 1.734013e+07 1.177663e+07 1.130583e+07 1.048414e+07 1.207930e+07 1.001967e+07 1.012429e+07 1.361013e+07 1.210896e+07 1.592721e+07 1.490627e+07 1.338851e+07 1.323384e+07 1.267831e+07 1.458204e+07 1.276743e+07 1.159716e+07 1.035089e+07 1.586923e+07 1.244943e+07 1.127522e+07 1.375428e+07 1.026268e+07 1.287406e+07 1.510302e+07 1.472859e+07 1.432256e+07 1.360219e+07 1.663413e+07 1.153656e+07 1.543976e+07 1.079151e+07 1.701737e+07 1.329907e+07 1.283843e+07 1.434675e+07 1.528128e+07 1.700198e+07 1.326007e+07 6.942210e+06 1.326598e+07 1.450732e+07 1.572017e+07 1.595180e+07 1.360747e+07 1.428832e+07 1.436024e+07 1.406893e+07 1.206744e+07 1.086005e+07 1.375756e+07 C3 H7 N6 O4 P_18.638 3.485200e+06 1.499191e+07 1.902316e+07 1.821670e+07 9.536730e+06 9.085414e+06 2.394664e+07 1.339301e+07 4296961.48 1.422524e+07 2.008613e+07 1.013428e+07 19882793.84 2.312952e+07 1.209817e+07 1.381792e+07 9.893833e+06 1.450189e+07 1.333327e+07 1.655604e+07 8.189553e+06 9.838717e+06 1.745252e+07 1.264349e+07 7211257.994 1.579179e+07 3.092518e+07 9.174461e+06 2.295783e+06 1.685807e+07 1.463179e+07 1.464284e+07 33205766.62 1.262632e+07 1.346397e+07 2.475200e+07 8.256045e+06 7.802825e+06 1.720663e+07 1.723282e+07 1.561319e+07 2.496692e+07 1.503267e+07 1.150312e+07 1.257281e+07 1.311445e+07 3.848513e+07 1.799316e+07 4.428176e+07 1.816695e+07 3.148577e+07 1.161374e+07 1.536800e+07 2.928848e+07 9.489228e+06 6.077954e+07 1.770374e+07 2.258289e+07 2.415994e+07 1.565777e+07 1.016446e+07 1.350182e+07 1.305978e+07 1.451040e+07 1.549498e+07 3.543303e+07 1.161841e+07 2.204075e+07 1.318622e+07 6.741701e+06 2.043602e+07 3.552610e+07 3.002122e+07 1.790449e+07 1.270987e+07 4.696459e+06 1.670531e+07 9.622729e+06 1.110074e+07 2.489429e+07 1.612499e+07 1.832666e+07 2.430623e+07 1.486174e+07 2.483163e+07 3.107554e+07 1.743756e+07 9.027723e+06 2.268514e+07 1.138266e+07 5.521280e+07 2.755506e+07 9.027552e+06 6.913218e+06 1.788451e+07 9.870863e+06 2.058455e+07 1.488501e+07 9.766015e+06 1.182141e+07 7.240317e+06 9.965910e+06 1.201640e+07 1.589769e+07 1.424103e+07 2.742744e+07 2.597805e+07 8.484663e+06 1.307060e+08 3.721613e+07 3.311560e+07 6.023386e+06 2.201608e+07 2.183560e+07 1.172387e+07 8.956037e+06 1.293068e+07 1.409333e+08 2.759419e+07 1.324932e+07 1.924121e+07 2.749978e+07 2.562698e+07 1.251993e+07 1.429559e+07 2.372522e+07 1.185767e+08 2.867473e+07 1.048580e+07 2.848552e+07 1.533602e+07 1.881454e+07 2.628785e+07 1.529088e+07 1.878161e+07 9.927157e+06 2.872045e+07 8.721663e+06 1.874704e+07 1.720159e+07 1.095939e+07 1.178343e+07 1.405282e+07 1.863236e+07 1.529377e+07 2.634118e+07 2.115194e+07 1.471528e+07 8.446315e+06 2.664490e+07 9.182403e+06 1.875341e+07 9.790456e+06 1.950046e+07 7.065095e+06 1.022625e+08 2.372066e+07 2.008530e+07 1.914283e+07 2.046631e+07 6.078549e+07 1.125665e+07 1.249620e+07 5.324782e+07 1.091856e+07 1.066924e+07 1.690792e+07 2.764318e+07 1.563191e+07 2.241968e+07 2.350793e+07 6.452972e+06 1.044815e+07 1.465011e+07 2.648658e+07 1.478208e+07 2.302004e+07 9.983461e+06 1.096577e+07 2.054443e+07 2.315835e+07 5.509513e+07 1.993165e+07 2.182021e+07 2.232699e+07 1.437816e+07 2.395373e+07 3.934885e+07 2.205362e+07 6.420951e+06 1.161731e+07 1.513627e+07 6.350669e+06 2.288095e+07 3.051163e+07 7.469901e+06 3.637626e+07 1.763343e+07 2.809183e+07 1.921098e+07 1.564918e+07 1.341170e+07 1.605402e+07 1.309239e+07 2.060379e+07 7.554442e+06 1.846562e+07 6.925872e+06 9.760751e+06 1.816792e+07 1.776159e+07 8.058922e+06 1.490144e+07 1.104736e+07 8.388912e+07 1.889696e+07 2.502501e+07 7.888159e+06 1.036158e+07 1.127594e+07 5.782182e+06 1.655521e+07 2.020064e+07 1.272193e+07 1.119401e+07 1.385660e+07 1.273847e+07 1.625984e+07 3.009377e+07 1.199908e+07 5.869885e+06 9.423623e+06 1.496726e+07 1.081052e+07 2.150960e+07 1.155944e+07 9.614940e+06 2.099567e+08 1.483437e+07 7.171183e+06 6.939257e+06 2.518900e+06 9.483644e+06 6.859259e+06 1.167314e+07 4.263538e+07 1.443421e+07 1.418781e+07 2.362833e+07 1.968397e+07 1.598147e+07 2.132167e+07 1.056230e+07 2.987497e+07 2.186206e+07 1.243077e+07 2.337780e+07 8.163457e+06 1.985972e+07 1.928026e+07 1.225613e+07 9.680033e+06 127.01189_18.683 1.446295e+07 2.160462e+06 4.830405e+06 4.503075e+06 2.026052e+05 4.979710e+06 6.297679e+05 5.137347e+06 3168766.79 1.276810e+06 7.323174e+06 2.733409e+06 4432877.73 3.831285e+06 3.046457e+06 4.866989e+06 1.047500e+07 1.133515e+06 4.537327e+06 3.555063e+06 2.889341e+06 4.658317e+06 3.559902e+06 3.551255e+06 358799.889 2.622347e+06 4.297774e+06 4.860821e+06 1.209868e+06 3.391768e+06 3.510392e+06 5.706306e+06 350085.90 1.754622e+06 1.455906e+06 5.834488e+06 4.262298e+05 1.366235e+06 4.949578e+06 4.980910e+06 7.704382e+05 2.920161e+05 3.569969e+06 2.057535e+06 3.194674e+06 3.948832e+06 3.446492e+06 4.306076e+06 3.179232e+06 4.289986e+06 2.922151e+06 1.992656e+05 3.532739e+06 5.207660e+06 2.443944e+06 2.834372e+06 2.188434e+06 2.763375e+06 5.273978e+06 3.412631e+06 1.321424e+06 3.788803e+06 9.535833e+05 4.712196e+06 1.448020e+06 1.310431e+06 3.362416e+06 3.941378e+06 2.031010e+06 2.748070e+06 3.931049e+06 3.388216e+06 3.805654e+06 2.976971e+06 4.180476e+06 1.285874e+06 1.164203e+06 4.120542e+06 1.111472e+07 2.227772e+06 4.653471e+06 2.109120e+05 4.852094e+06 3.684374e+06 2.986205e+06 2.625496e+06 3.636323e+06 4.178941e+06 1.017200e+06 3.474812e+06 4.153450e+06 2.799839e+06 2.180704e+06 5.359832e+06 2.276208e+05 3.910753e+06 2.101637e+06 3.380744e+06 2.121676e+06 3.745283e+06 3.615210e+06 1.354552e+06 2.627211e+06 4.753140e+06 2.753796e+05 2.011347e+06 2.443546e+06 2.779233e+06 1.738378e+06 4.550900e+06 3.178186e+06 3.491462e+06 1.935225e+06 2.947199e+06 4.280308e+06 4.590331e+06 2.191220e+05 2.636155e+06 4.691774e+06 3.066152e+06 3.669943e+06 1.408709e+06 2.993260e+06 2.264388e+06 4.829997e+06 4.867828e+06 4.055799e+06 3.697435e+06 3.033943e+06 6.271437e+06 3.583929e+06 1.700830e+07 3.393506e+06 3.989332e+06 3.501163e+06 3.722059e+06 1.991176e+06 2.918590e+06 3.666477e+06 3.371591e+06 3.807975e+06 3.170276e+06 3.725218e+06 1.709190e+06 4.732257e+06 3.318341e+06 2.643600e+05 4.335888e+06 1.392681e+06 1.092192e+06 9.779334e+05 2.376217e+06 1.689562e+06 2.383523e+06 3.999601e+06 5.455059e+06 2.496744e+06 5.127430e+06 2.479183e+06 4.324172e+06 2.671506e+06 3.689603e+06 8.730036e+05 2.478458e+06 4.165354e+06 3.837532e+06 1.111901e+06 2.561634e+06 2.709580e+06 6.060368e+06 7.801415e+06 3.534129e+06 5.427722e+05 2.946158e+06 8.103560e+05 1.764135e+06 4.938063e+06 4.384035e+06 8.529227e+05 3.031496e+06 3.353338e+06 3.985282e+06 2.295041e+06 5.310241e+06 1.883135e+06 3.596196e+06 3.257315e+06 4.052503e+06 4.033752e+06 1.621868e+06 2.834666e+06 4.032674e+06 1.527942e+08 2.120147e+06 3.530890e+06 2.957443e+06 3.621336e+06 2.018174e+06 2.340714e+06 5.255880e+06 3.032120e+06 2.669975e+05 3.482980e+06 2.652637e+05 1.468171e+06 3.530914e+06 5.099298e+06 4.586997e+06 1.055897e+06 2.639192e+06 5.035912e+06 3.709116e+06 2.222014e+06 2.603772e+06 3.481259e+06 2.770094e+05 1.087505e+06 2.943049e+06 2.601010e+06 3.778740e+06 3.154572e+06 3.296433e+06 3.100491e+06 3.530441e+06 9.793517e+05 2.967516e+06 1.229489e+06 2.971957e+06 1.211709e+06 1.862120e+06 3.668657e+06 8.935152e+05 2.877104e+06 2.797468e+06 2.030606e+06 3.013439e+06 1.137772e+06 6.029915e+06 5.176922e+06 2.707131e+06 3.860473e+06 3.160187e+06 2.782091e+06 5.683208e+06 4.685725e+06 2.940390e+06 2.962568e+06 2.335124e+05 5.411777e+06 2.312568e+06 1.466606e+06 4.057660e+06 5.599651e+06 3.928331e+06 4.782355e+06 4.701038e+06 8.955463e+05 5.165037e+06 4.938846e+06 3.184248e+06 2.551458e+06 4.141661e+06 C4 H9 N3 O4_18.729 1.583440e+08 7.275834e+07 6.496769e+07 1.767466e+07 4.752326e+07 6.435850e+07 6.760593e+07 5.763112e+07 47522251.02 6.129042e+07 6.705175e+07 5.437344e+07 42894873.01 5.645171e+07 5.343148e+07 5.663730e+07 1.079345e+08 5.840991e+07 5.316223e+07 6.892152e+07 1.431267e+07 8.042680e+07 1.845350e+07 8.634156e+07 46333630.086 1.701518e+07 7.766924e+07 6.021719e+07 5.572065e+07 5.736892e+07 5.994055e+07 6.505879e+07 36655246.51 5.377439e+07 5.296442e+07 5.925370e+07 3.783766e+07 5.987422e+07 6.179716e+07 6.883626e+07 4.073886e+07 6.479941e+07 6.723774e+06 7.809503e+07 4.558992e+07 6.351738e+07 6.093535e+07 5.723809e+07 5.538863e+07 4.689871e+07 5.496256e+07 5.826695e+07 4.984363e+07 5.514220e+07 5.929756e+07 5.353104e+07 8.292060e+07 8.099638e+07 5.564376e+07 4.189272e+07 4.497057e+07 5.384327e+07 4.728788e+07 5.536457e+07 6.010949e+07 5.289466e+07 6.312469e+07 5.191338e+07 5.956591e+07 6.362392e+07 6.160218e+07 5.796884e+07 5.139681e+07 6.859139e+07 6.010893e+07 6.039356e+07 1.350397e+07 6.750202e+07 1.284250e+08 3.493301e+06 1.369277e+07 4.485108e+07 5.697964e+07 4.684204e+07 6.235771e+07 6.634474e+07 5.609605e+07 4.144956e+07 8.203115e+07 7.090885e+07 5.474638e+07 5.358618e+07 5.546187e+07 1.314628e+07 5.641073e+06 5.871959e+07 5.851644e+07 6.613240e+07 5.906140e+07 4.707212e+07 5.309426e+07 5.680518e+07 6.162064e+07 5.370163e+06 5.252565e+07 4.543977e+07 4.858918e+07 4.892030e+07 5.919324e+07 5.107793e+07 5.740087e+07 7.644958e+07 6.522218e+07 7.628563e+07 5.034274e+07 5.967226e+07 7.309593e+07 6.511180e+07 5.169064e+07 5.966361e+07 6.871684e+07 7.555868e+07 7.199763e+07 5.323245e+07 7.069583e+07 5.916006e+07 4.856702e+07 4.863483e+07 6.101412e+07 6.073321e+07 6.621821e+07 1.614502e+08 6.416173e+06 5.392942e+07 4.901945e+07 6.573667e+07 5.143283e+07 7.581151e+07 8.341543e+07 2.018540e+07 6.377542e+07 5.478727e+07 4.248106e+07 6.629997e+07 4.221875e+07 6.013787e+07 7.689028e+07 6.814735e+07 6.082680e+07 3.765622e+06 4.741060e+07 4.264958e+07 6.364785e+07 4.826911e+07 8.349322e+07 4.852929e+07 5.362936e+07 4.362876e+07 6.768878e+07 5.546328e+07 5.462745e+07 5.604716e+07 6.202194e+07 5.903766e+07 6.031072e+07 5.370475e+07 5.702013e+07 6.649130e+07 7.603692e+07 6.760142e+07 7.480713e+07 7.981764e+07 6.048053e+07 7.760711e+07 5.220225e+07 6.425772e+07 6.090719e+07 5.538165e+07 5.982759e+07 5.546815e+07 3.671483e+06 5.119788e+07 6.027763e+07 5.143145e+07 7.082319e+07 4.826746e+07 6.295366e+07 3.751699e+06 5.439254e+07 6.225806e+07 5.290272e+07 1.568427e+07 1.164166e+09 5.022690e+07 5.320866e+07 4.951955e+07 6.674516e+07 6.357813e+07 5.689096e+07 8.740773e+07 6.848645e+07 1.640657e+07 3.558030e+06 5.649843e+07 6.222804e+07 5.070402e+07 8.836248e+07 1.573024e+07 6.580543e+07 1.481730e+07 5.949026e+07 9.180372e+07 6.672247e+07 5.593084e+07 4.264354e+06 5.647326e+07 8.888017e+05 6.357430e+06 4.781465e+07 1.973872e+07 5.531006e+07 5.946476e+07 6.624034e+07 6.297426e+07 7.810744e+07 5.609488e+07 4.354478e+06 6.047657e+06 5.791564e+07 6.543278e+07 7.210542e+07 5.832008e+07 5.426136e+07 5.529028e+07 6.745921e+07 4.758415e+06 6.107559e+07 6.453259e+07 4.888514e+07 6.074122e+07 6.704468e+07 4.966142e+07 5.653385e+07 6.050187e+07 5.341245e+07 5.282656e+07 5.917229e+07 6.252310e+07 6.965071e+07 4.606207e+07 5.715398e+07 5.799438e+07 5.187894e+07 4.759538e+07 5.422509e+07 6.208796e+07 5.442933e+07 6.407238e+07 5.969023e+07 5.347217e+07 5.582953e+07 6.177998e+07 C4 H7 N3 O3_18.742 1.605955e+07 5.830627e+06 5.876273e+06 5.604932e+06 4.849473e+06 6.110670e+06 5.230437e+06 5.838523e+06 4741621.05 5.927124e+06 8.422666e+06 5.200688e+06 4002216.26 4.893691e+06 5.532829e+06 6.267095e+06 1.302549e+07 5.833497e+06 4.741867e+06 5.955214e+06 4.831266e+06 6.082267e+06 6.410382e+06 5.967977e+06 3695275.676 6.567767e+06 4.747468e+06 6.208735e+06 4.187924e+06 5.300918e+06 6.558011e+06 6.852232e+06 3416219.85 5.070034e+06 5.487115e+06 5.990507e+06 3.441372e+06 5.893514e+06 6.354154e+06 5.223718e+06 3.819877e+06 5.290376e+06 6.344186e+06 6.510862e+06 3.892947e+06 5.854864e+06 5.519762e+06 5.909527e+06 5.306266e+06 3.998103e+06 4.941652e+06 5.314471e+06 5.347119e+06 5.965432e+06 5.476776e+06 5.292430e+06 6.565466e+06 6.813182e+06 5.157485e+06 4.132816e+06 5.118170e+06 4.389557e+06 4.919298e+06 5.711856e+06 5.145381e+06 4.355973e+06 6.353135e+06 5.466107e+06 6.194596e+06 4.789290e+06 5.055766e+06 5.397816e+06 5.043033e+06 5.644683e+06 6.250160e+06 6.039785e+06 4.965442e+06 5.410382e+06 1.561170e+07 4.682879e+06 5.245560e+06 4.404998e+06 5.921247e+06 5.019458e+06 5.681024e+06 5.020550e+06 4.395171e+06 4.730409e+06 3.775559e+06 5.730843e+06 5.462619e+06 4.991273e+06 5.187366e+06 4.952743e+06 6.123965e+06 5.350023e+06 5.309205e+06 5.446629e+06 5.258587e+06 4.398715e+06 5.130999e+06 4.973723e+06 4.833262e+06 5.568579e+06 5.904172e+06 4.599080e+06 4.079806e+06 4.797901e+06 5.294644e+06 5.545695e+06 5.551189e+06 5.062734e+06 5.736560e+06 8.103336e+06 4.621074e+06 7.867792e+05 4.717642e+06 5.466926e+06 5.732576e+06 4.663330e+06 5.656369e+06 5.831685e+06 6.419840e+06 5.431951e+06 5.022744e+06 5.534140e+06 3.997457e+06 4.775409e+06 6.180970e+06 5.623331e+06 5.494578e+06 2.109880e+07 5.933947e+06 4.780860e+06 5.250141e+06 6.323551e+06 4.736066e+06 5.539870e+06 7.089800e+06 5.731042e+06 5.306388e+06 4.677244e+06 4.455202e+06 5.166308e+06 1.726683e+05 5.705108e+06 5.759661e+06 6.112157e+06 5.142772e+06 4.622380e+06 4.220989e+06 4.423964e+06 4.530027e+06 4.576956e+06 6.502968e+06 4.404803e+06 4.757609e+06 4.312920e+06 5.243294e+06 4.600065e+06 5.380629e+06 5.106107e+06 5.544803e+06 4.775578e+06 5.901614e+06 5.797094e+06 5.748809e+06 5.248101e+06 6.187310e+06 6.902975e+06 7.455362e+06 5.860624e+06 5.413641e+06 5.303379e+06 3.166740e+06 5.412791e+06 5.449655e+06 5.428246e+06 4.665217e+06 4.856538e+06 5.625221e+06 4.439349e+06 5.675068e+06 5.089331e+06 5.158610e+06 5.372235e+06 5.737953e+06 5.267292e+06 4.802093e+06 5.456050e+06 4.350044e+06 6.720857e+06 1.665940e+08 5.632648e+06 4.990082e+06 4.865165e+06 6.037071e+06 5.230908e+06 4.313984e+06 7.866480e+06 6.356178e+06 6.646455e+06 5.956738e+06 5.538185e+06 4.328418e+06 4.638803e+06 7.625089e+06 5.476277e+06 4.760129e+06 3.933713e+06 5.333941e+06 6.216517e+06 5.413147e+06 4.670734e+06 1.655789e+05 5.789424e+06 1.030269e+05 4.541083e+06 4.580467e+06 5.566736e+06 5.535012e+06 5.886971e+06 5.264788e+06 5.233966e+06 6.036061e+06 5.364579e+06 4.524034e+06 4.988552e+06 4.611250e+06 1.751007e+05 5.331856e+06 4.489676e+06 6.173757e+06 4.809988e+06 5.419520e+06 6.260243e+06 4.981952e+06 6.397672e+06 1.049159e+06 5.165899e+06 5.351310e+06 4.790709e+06 4.913190e+06 5.280351e+06 4.986929e+06 5.152934e+06 6.685333e+06 6.160859e+06 6.566061e+06 4.771060e+06 6.477501e+06 5.422242e+06 5.087892e+06 4.773475e+06 5.125285e+06 5.716902e+06 4.738577e+06 6.474910e+06 5.469199e+06 5.009006e+06 4.740882e+06 5.347942e+06 C3 H8 N2 O6_18.744 4.986445e+07 1.990830e+07 1.877173e+07 6.473079e+06 1.500442e+07 1.820135e+07 6.726372e+06 1.799384e+07 15683544.00 1.742932e+07 2.290676e+07 1.600561e+07 12322246.35 5.789123e+06 1.565344e+07 1.633314e+07 3.280744e+07 1.577418e+07 1.435064e+07 1.413244e+07 1.515169e+07 1.680561e+07 1.518362e+07 1.598577e+07 8848681.176 1.570125e+07 1.487217e+07 1.555509e+07 1.158948e+07 1.429324e+07 1.515105e+07 1.672125e+07 10916767.05 1.532284e+07 1.344889e+07 1.456182e+07 1.116132e+07 1.634032e+07 1.560419e+07 1.542632e+07 1.050994e+07 1.445813e+07 1.448870e+07 1.717358e+07 1.164749e+07 1.582021e+07 1.383133e+07 1.547584e+07 1.266395e+07 1.272617e+07 4.377360e+06 1.245057e+07 1.402135e+07 5.164167e+06 1.470204e+07 1.468866e+07 4.535714e+06 1.580013e+07 1.359020e+07 1.203636e+07 1.180437e+07 1.179251e+07 1.305657e+07 1.359011e+07 1.535139e+07 1.219001e+07 1.465015e+07 1.225962e+07 4.696043e+06 1.112910e+07 1.652571e+07 1.189078e+07 1.351436e+07 1.286510e+07 1.543357e+07 1.492742e+07 1.181916e+07 1.394495e+07 3.986482e+07 1.319806e+07 5.945557e+06 1.230553e+07 1.408734e+07 1.306979e+07 1.312510e+07 1.375524e+07 1.256097e+07 1.665693e+07 1.403311e+07 1.402645e+07 1.267524e+07 1.619092e+07 4.432505e+06 1.677988e+07 5.706144e+06 1.277499e+07 1.251483e+07 1.423914e+07 1.360991e+07 1.410919e+07 1.317490e+07 1.270064e+07 1.273474e+07 1.435987e+07 1.444792e+07 1.198005e+07 1.227419e+07 1.221573e+07 1.176569e+07 1.447246e+07 1.376445e+07 1.261682e+07 5.982232e+06 1.624124e+07 1.566636e+07 1.717383e+07 1.340480e+07 1.496657e+07 1.425757e+07 1.585112e+07 1.319100e+07 1.589340e+07 1.650237e+07 1.401131e+07 1.450446e+07 1.459690e+07 1.470228e+07 4.485510e+06 1.999487e+07 1.979051e+07 1.239499e+07 5.124562e+07 1.449400e+07 1.332162e+07 1.480019e+07 1.587485e+07 1.259836e+07 1.329340e+07 1.578707e+07 1.337766e+07 1.321636e+07 1.131278e+07 1.316671e+07 4.588377e+06 1.473108e+07 1.417927e+07 1.509655e+07 1.595954e+07 1.881806e+07 1.330451e+07 1.425193e+07 1.181546e+07 1.099131e+07 1.286184e+07 1.775022e+07 1.524950e+07 1.225610e+07 1.457867e+07 1.144647e+07 1.371605e+07 1.509159e+07 1.474158e+07 4.965323e+06 1.408542e+07 1.542772e+07 1.667868e+07 1.364007e+07 1.513909e+07 1.717119e+07 1.795473e+07 2.325577e+07 1.696100e+07 1.325315e+07 1.359055e+07 1.213836e+07 1.643420e+07 1.361584e+07 1.509603e+07 1.299632e+07 1.200312e+07 1.226527e+07 1.439647e+07 1.323868e+07 1.455429e+07 1.153717e+07 1.159732e+07 1.854699e+07 1.355312e+07 1.536544e+07 9.788126e+06 1.152482e+07 2.064813e+07 4.439235e+08 1.262842e+07 1.112165e+07 1.464538e+07 1.450160e+07 4.629840e+06 1.275208e+07 2.068916e+07 2.248887e+07 1.534166e+07 4.736433e+06 1.704727e+07 1.585441e+07 1.211930e+07 1.871679e+07 1.724346e+07 1.100409e+07 1.499879e+07 1.565535e+07 1.862723e+07 1.306502e+07 1.153074e+07 1.129224e+07 1.291260e+07 1.012785e+07 1.106235e+07 1.471416e+07 1.320963e+07 1.631936e+07 1.635092e+07 1.398213e+07 1.335429e+07 1.319036e+07 1.583151e+07 1.358531e+07 1.165751e+07 1.122941e+07 1.750061e+07 1.286339e+07 1.210121e+07 1.492738e+07 1.109500e+07 1.344144e+07 1.520063e+07 1.604801e+07 1.562524e+07 1.490587e+07 1.699646e+07 1.297113e+07 1.687822e+07 1.109853e+07 1.712112e+07 1.433775e+07 1.370134e+07 1.466382e+07 1.652606e+07 1.725038e+07 1.396794e+07 8.539221e+06 1.388267e+07 1.619641e+07 1.720283e+07 1.658596e+07 1.387303e+07 1.571920e+07 1.558871e+07 1.521115e+07 1.302624e+07 1.186579e+07 1.500221e+07 C6 H13 O3 P_18.746 2.133460e+07 1.179626e+07 8.643624e+06 2.191115e+07 1.576119e+07 8.844414e+06 2.052893e+07 1.019922e+07 19562080.01 8.098044e+06 1.055279e+07 1.497200e+07 12829780.93 1.451373e+07 1.382498e+07 1.527103e+07 1.317806e+07 1.405891e+07 6.391607e+06 1.616435e+07 1.308721e+07 1.817825e+07 7.949338e+06 1.873950e+07 10027022.394 8.980174e+06 7.075673e+06 1.720314e+07 1.045547e+07 1.354175e+07 1.426607e+07 1.442971e+07 7683952.28 1.219823e+07 1.216654e+07 1.313594e+07 7.748004e+06 1.247990e+07 1.413762e+07 1.335647e+07 7.764791e+06 1.173529e+07 1.350970e+07 1.523018e+07 8.095582e+06 1.166356e+07 1.330644e+07 1.282811e+07 1.315927e+07 1.330730e+07 1.208976e+07 1.351768e+07 1.112652e+07 1.348301e+07 1.338417e+07 1.294233e+07 1.617551e+07 7.010324e+06 1.167103e+07 1.270868e+07 1.136511e+07 1.065626e+07 1.267141e+07 1.179924e+07 1.260057e+07 1.175967e+07 1.465384e+07 1.161561e+07 1.282244e+07 1.429019e+07 1.829867e+07 1.203246e+07 1.226099e+07 1.461305e+07 6.690247e+06 1.558790e+07 1.300077e+07 1.432402e+07 1.474781e+07 1.164458e+07 1.914643e+07 1.051732e+07 1.236342e+07 1.189780e+07 1.346711e+07 1.237607e+07 1.154417e+07 1.534397e+07 7.325290e+06 1.535588e+07 1.266476e+07 1.880700e+07 1.285481e+07 1.957686e+07 1.331120e+07 1.253083e+07 1.114500e+07 1.185780e+07 1.442033e+07 1.234363e+07 1.397795e+07 1.469709e+07 1.347976e+07 1.408510e+07 1.228743e+07 1.257701e+07 1.166011e+07 1.085711e+07 1.325953e+07 1.333961e+07 1.254291e+07 1.501631e+07 1.427022e+07 1.452497e+07 1.539931e+07 1.825578e+07 1.455608e+07 1.302402e+07 5.096718e+06 1.377815e+07 1.121008e+07 1.372528e+07 1.417098e+07 1.339312e+07 1.229123e+07 1.268647e+07 1.800091e+07 1.171801e+07 1.927703e+07 8.445548e+06 1.494816e+07 1.783098e+07 1.269737e+07 1.115496e+07 1.445757e+07 1.537289e+07 1.152951e+07 1.567339e+07 7.944456e+06 1.595882e+07 1.295784e+07 1.266984e+07 1.206594e+07 1.379274e+07 1.596346e+07 1.268687e+07 1.513822e+07 1.569728e+07 8.926244e+06 1.022100e+07 1.314584e+07 1.169250e+07 1.319430e+07 1.111220e+07 1.771616e+07 1.653858e+07 1.243337e+07 1.587318e+07 1.313068e+07 1.386667e+07 1.371916e+07 1.149872e+07 1.270767e+07 1.261982e+07 1.383058e+07 1.413203e+07 1.223779e+07 1.308248e+07 1.507231e+07 1.557702e+07 2.613155e+07 1.604274e+07 1.140853e+07 7.514769e+06 1.055044e+07 1.852450e+07 1.298595e+07 1.176509e+07 1.317943e+07 1.290803e+07 1.438216e+07 1.318183e+07 1.213785e+07 1.758443e+07 1.348387e+07 1.009868e+07 9.401349e+06 1.339269e+07 1.894742e+07 1.153943e+07 1.184987e+07 1.121719e+07 2.703713e+08 1.177857e+07 1.011564e+07 1.637251e+07 1.370179e+07 1.393901e+07 1.212512e+07 8.149017e+06 2.161560e+07 7.338958e+06 1.169243e+07 1.719523e+07 1.674251e+07 1.175839e+07 2.231955e+07 1.823532e+07 1.278335e+07 1.601910e+07 1.345846e+07 8.662714e+06 1.400510e+07 1.123736e+07 1.097058e+07 1.287419e+07 3.862753e+05 1.110668e+07 1.181128e+07 1.421275e+07 1.887864e+07 8.677370e+06 1.459008e+07 1.248889e+07 1.447142e+07 1.828027e+07 5.099893e+05 1.300201e+07 1.216865e+07 2.092626e+07 1.434059e+07 1.165362e+07 1.336974e+07 1.277999e+07 6.195223e+05 1.455899e+07 1.878937e+07 1.449547e+07 1.757866e+07 1.834955e+07 1.474490e+07 1.918260e+07 1.393069e+07 1.910504e+07 1.307823e+07 1.254198e+07 1.541796e+07 1.423971e+07 7.470148e+06 1.250439e+07 8.549267e+06 1.301498e+07 1.948045e+07 1.692030e+07 2.035836e+07 1.336553e+07 1.762906e+07 1.418081e+07 1.383270e+07 1.093692e+07 1.212691e+07 1.480319e+07 C12 H7 N_18.749 1.772369e+07 7.951039e+06 6.458156e+06 7.971918e+06 7.108066e+06 8.472821e+06 8.708603e+06 9.253728e+06 7874004.50 9.815126e+06 2.002664e+06 8.532074e+06 7192075.77 8.081271e+06 8.239840e+06 8.331044e+06 1.559040e+07 7.816343e+06 7.440356e+06 7.476862e+06 5.929975e+06 8.521058e+06 7.903745e+06 8.672313e+06 4580500.376 7.754248e+06 7.739835e+06 7.169857e+06 6.771962e+06 7.745023e+06 8.172363e+06 8.273936e+06 5236599.65 7.093842e+06 7.500736e+06 8.394014e+06 4.363402e+06 7.728494e+06 8.227066e+06 7.812781e+06 4.379066e+06 6.976567e+06 8.218006e+06 9.335160e+06 5.031330e+06 6.926553e+06 7.523300e+06 7.871529e+06 6.405863e+06 7.584270e+06 6.689065e+06 7.278965e+06 6.989111e+06 8.149202e+06 7.809948e+06 7.514761e+06 7.240477e+06 7.703111e+06 6.606808e+06 6.499934e+06 6.677715e+06 5.978549e+06 7.164968e+06 7.062561e+06 7.647289e+06 6.721207e+06 6.977274e+06 7.443006e+06 7.662389e+06 7.125934e+06 7.511398e+06 6.476767e+06 6.015277e+06 6.430875e+06 7.212887e+06 7.096011e+06 5.161839e+06 7.546587e+06 2.018020e+07 6.262490e+06 7.030958e+06 5.968891e+06 6.974142e+06 7.218654e+06 6.361050e+06 6.861705e+06 6.777443e+06 9.139391e+06 6.886146e+06 6.354951e+06 6.843905e+06 8.571597e+06 6.106955e+06 7.959860e+06 7.931651e+06 7.266893e+06 6.985122e+06 7.584011e+06 6.275175e+06 7.560591e+06 7.317872e+06 7.845510e+06 6.077247e+06 7.861670e+06 6.985052e+06 6.909923e+06 6.778708e+06 5.304064e+06 6.275147e+06 7.604200e+06 7.465550e+06 6.161737e+06 7.797535e+06 8.612171e+06 8.463765e+06 7.503270e+06 6.225672e+06 7.493296e+06 7.328042e+06 8.367703e+06 6.637773e+06 7.358250e+06 8.397149e+06 7.431895e+06 7.143405e+06 8.320689e+06 7.365790e+06 6.597509e+06 1.013217e+07 1.021215e+07 6.697033e+06 2.096954e+07 7.101939e+06 7.974690e+06 7.633885e+06 7.940565e+06 6.510563e+06 7.281186e+06 8.326969e+06 6.698635e+06 6.237295e+06 6.876371e+06 6.550287e+06 6.158081e+06 7.065585e+06 8.618119e+06 8.582097e+06 9.208277e+06 1.073421e+07 6.858839e+06 7.628076e+06 6.590290e+06 5.865497e+06 6.408048e+06 8.508842e+06 7.396222e+06 7.110604e+06 6.863769e+06 6.393849e+06 7.387896e+06 7.871270e+06 7.436537e+06 6.396160e+06 7.294778e+06 8.232388e+06 9.512942e+06 6.883451e+06 7.722170e+06 8.433402e+06 8.621823e+06 1.291480e+07 7.415924e+06 6.884874e+06 7.509728e+06 6.271071e+06 1.117307e+07 8.039352e+06 6.863860e+06 6.125254e+06 6.604464e+06 2.274703e+05 8.137617e+06 6.396660e+06 8.496835e+06 5.571215e+06 6.423872e+06 9.373854e+06 7.510051e+06 7.324644e+06 6.799504e+06 6.751533e+06 1.893873e+06 1.670568e+08 6.727837e+06 6.105016e+06 8.503193e+06 7.829396e+06 6.355084e+06 7.164485e+06 1.008271e+07 2.056824e+06 6.824751e+06 9.882778e+05 8.866054e+06 8.286343e+06 6.849552e+06 9.156617e+06 7.343002e+06 5.131554e+06 5.955781e+06 8.240325e+06 1.507026e+06 7.144030e+06 7.327527e+06 6.071823e+06 6.943553e+06 1.203885e+05 5.806135e+06 6.333556e+06 5.448138e+06 9.074320e+06 9.775872e+06 7.412865e+06 7.440247e+06 6.492571e+06 1.022693e+07 2.692516e+05 6.661298e+06 6.779504e+06 7.347653e+06 5.971483e+06 6.581761e+06 8.273107e+06 5.823662e+06 7.424211e+06 8.689755e+06 7.121385e+06 8.597455e+06 7.406504e+06 7.530250e+06 6.797785e+06 8.970495e+06 5.825742e+06 7.949440e+06 8.884288e+06 6.755439e+06 8.136181e+06 7.939556e+06 8.603649e+06 7.116568e+06 1.030663e+07 7.553505e+06 9.537755e+06 7.496695e+06 7.649522e+06 7.746050e+06 8.247529e+06 8.347909e+06 7.139878e+06 6.654622e+06 6.982797e+06 8.390293e+06 C2 H8 N2 O2 S_18.765 2.742450e+07 1.126436e+07 9.627996e+06 1.140104e+07 9.884329e+06 1.175302e+07 1.153076e+07 1.259342e+07 10775131.26 1.320349e+07 7.115307e+06 1.097123e+07 9791807.56 1.103118e+07 1.149886e+07 1.145591e+07 2.187257e+07 1.119401e+07 1.070327e+07 1.057772e+07 8.768903e+06 1.203209e+07 1.126954e+07 1.202731e+07 6401725.512 1.121615e+07 1.097575e+07 1.047270e+07 9.033701e+06 1.118105e+07 1.130345e+07 1.168488e+07 7326279.22 1.018564e+07 1.056394e+07 1.185207e+07 6.866285e+06 1.123074e+07 1.162016e+07 1.094475e+07 6.429606e+06 1.034283e+07 1.141510e+07 1.287674e+07 7.241462e+06 1.005815e+07 1.081191e+07 1.120707e+07 9.733581e+06 1.009304e+07 9.662814e+06 1.024661e+07 1.002230e+07 1.138445e+07 1.071342e+07 1.059940e+07 1.059983e+07 1.099566e+07 9.315850e+06 9.060703e+06 9.654271e+06 8.605893e+06 9.800253e+06 9.944800e+06 1.078145e+07 9.745685e+06 1.033852e+07 1.072147e+07 1.056814e+07 8.278351e+06 1.033940e+07 9.125051e+06 8.890544e+06 9.257953e+06 1.091606e+07 1.005675e+07 7.707879e+06 1.056067e+07 2.802258e+07 8.892596e+06 1.045628e+07 8.273460e+06 1.070381e+07 9.911961e+06 9.135958e+06 9.708848e+06 9.574219e+06 1.176394e+07 1.026585e+07 9.225150e+06 9.503526e+06 1.124653e+07 8.602696e+06 1.082287e+07 1.171462e+07 1.016346e+07 1.019256e+07 9.935458e+06 9.022539e+06 1.017898e+07 1.001977e+07 1.078778e+07 8.675738e+06 1.110085e+07 1.044336e+07 9.954753e+06 9.614582e+06 7.972970e+06 9.082574e+06 1.114889e+07 1.076973e+07 8.847820e+06 1.084824e+07 1.292677e+07 1.154009e+07 1.058383e+07 9.118292e+06 1.086860e+07 1.030600e+07 1.166079e+07 9.696970e+06 1.116083e+07 1.192149e+07 1.060219e+07 1.141544e+07 1.119166e+07 1.009378e+07 9.051619e+06 1.382267e+07 1.361261e+07 9.566040e+06 3.212348e+07 1.047843e+07 1.062238e+07 1.034952e+07 1.080179e+07 9.226396e+06 1.034757e+07 1.188810e+07 9.906365e+06 9.136869e+06 9.328465e+06 9.243255e+06 8.789467e+06 9.681203e+06 1.211671e+07 1.161077e+07 1.298304e+07 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1.337388e+07 2.964125e+06 9.235913e+06 9.533217e+06 1.059469e+07 8.770847e+06 9.472448e+06 1.154536e+07 8.603335e+06 7.874414e+06 1.161901e+07 1.034324e+07 1.200307e+07 1.022850e+07 1.073263e+07 9.462146e+06 1.179966e+07 8.540489e+06 1.074516e+07 1.148522e+07 9.881520e+06 1.115694e+07 1.144550e+07 1.182417e+07 1.005166e+07 1.361730e+07 1.052094e+07 1.255250e+07 1.017906e+07 1.048933e+07 1.049264e+07 1.131915e+07 1.188157e+07 1.044854e+07 9.118764e+06 9.337788e+06 1.190756e+07 C2 H8 N2 O5_18.768 8.458791e+07 3.528749e+07 3.580901e+07 3.668980e+07 2.712004e+07 3.624927e+07 3.221225e+07 3.639319e+07 27822520.51 3.612707e+07 5.116920e+07 3.090493e+07 27345426.02 2.833189e+07 3.502217e+07 3.483025e+07 6.810397e+07 3.651663e+07 3.663245e+07 3.374394e+07 2.980978e+07 3.781804e+07 3.632608e+07 3.775288e+07 22493657.914 3.875619e+07 3.467770e+07 3.626009e+07 2.855490e+07 3.269164e+07 3.652658e+07 4.001500e+07 24282805.18 3.375891e+07 3.311555e+07 3.745591e+07 7.761176e+06 3.552350e+07 3.633241e+07 3.695409e+07 2.367309e+07 3.338149e+07 3.643061e+07 4.273232e+07 2.808150e+07 3.470404e+07 3.000417e+07 3.826161e+07 3.085330e+07 2.889661e+07 2.913986e+07 3.052703e+07 3.140381e+07 3.316930e+07 3.084509e+07 3.902174e+07 3.674107e+07 3.594976e+07 3.329964e+07 2.927004e+07 2.880099e+07 3.025604e+07 2.852087e+07 3.367596e+07 3.428073e+07 3.061095e+07 3.347910e+07 3.130377e+07 3.086419e+07 2.668161e+07 3.065626e+07 2.722011e+07 3.443281e+07 3.024982e+07 3.573543e+07 3.442852e+07 2.728570e+07 3.271745e+07 7.866542e+07 2.973292e+07 3.001477e+07 2.956616e+07 3.516223e+07 2.806062e+07 2.911099e+07 3.304686e+07 3.227653e+07 3.363935e+07 3.219116e+07 3.276057e+07 3.455218e+07 3.061788e+07 2.965613e+07 3.037920e+07 3.763633e+07 2.821906e+07 3.035172e+07 3.237461e+07 3.098617e+07 3.115643e+07 2.900610e+07 3.290255e+07 2.822782e+07 3.587761e+07 3.368006e+07 2.747973e+07 2.906943e+07 2.968676e+07 2.947598e+07 3.569362e+07 3.256513e+07 2.759703e+07 3.517909e+07 3.978212e+07 3.375541e+07 2.996580e+07 2.900306e+07 3.467356e+07 3.362738e+07 3.578809e+07 3.455368e+07 3.753359e+07 3.633314e+07 3.459508e+07 3.348871e+07 3.299387e+07 2.571077e+07 3.297406e+07 4.170121e+07 3.548100e+07 3.140574e+07 1.025623e+08 3.654652e+07 3.298661e+07 3.142525e+07 3.203842e+07 3.761105e+07 3.323622e+07 3.611288e+07 3.357611e+07 3.252178e+07 2.910482e+07 2.837796e+07 2.978430e+07 2.558388e+07 3.420750e+07 3.711052e+07 4.005715e+07 3.529355e+07 3.304887e+07 2.663060e+07 2.887121e+07 2.599430e+07 3.050607e+07 3.968777e+07 2.868450e+07 3.043654e+07 2.719959e+07 2.763376e+07 2.924493e+07 3.472411e+07 3.633825e+07 2.991585e+07 3.234773e+07 3.562380e+07 3.496732e+07 3.306570e+07 3.140833e+07 4.106138e+07 3.804540e+07 4.484924e+07 4.009816e+07 3.257719e+07 3.255108e+07 3.218477e+07 3.547334e+07 3.017360e+07 3.444870e+07 3.017187e+07 2.915466e+07 3.317429e+07 3.465630e+07 3.286452e+07 2.858100e+07 2.918174e+07 2.983393e+07 3.560636e+07 3.379897e+07 2.918630e+07 3.335487e+07 3.096305e+07 4.231985e+07 4.627390e+08 3.176575e+07 3.019613e+07 2.900982e+07 3.453016e+07 3.325345e+07 3.148599e+07 4.760312e+07 4.117278e+07 3.699838e+07 9.515012e+06 3.281242e+07 2.934976e+07 3.136282e+07 4.520852e+07 3.181227e+07 2.554307e+07 2.928211e+07 3.694380e+07 4.033216e+07 3.134447e+07 2.973743e+07 3.244138e+07 3.230449e+07 2.320555e+07 2.671316e+07 3.372204e+07 3.215732e+07 3.426042e+07 3.740018e+07 3.498946e+07 3.392807e+07 3.449606e+07 3.523941e+07 3.197954e+07 2.832344e+07 2.524974e+07 3.388747e+07 2.997741e+07 3.275561e+07 3.564890e+07 2.953881e+07 3.129610e+07 1.309765e+07 3.348802e+07 3.981624e+07 2.887057e+07 3.367647e+07 2.970264e+07 3.097853e+07 2.536460e+07 3.306550e+07 2.904496e+07 3.363692e+07 3.587590e+07 4.185472e+07 3.791602e+07 2.872790e+07 4.037294e+07 3.496278e+07 3.212664e+07 3.156033e+07 3.466485e+07 3.276670e+07 2.965887e+07 3.869448e+07 3.317343e+07 3.054165e+07 3.034056e+07 3.267020e+07 C6 H10 N4 O3_18.768 3.412818e+08 1.245290e+08 1.305196e+08 1.371486e+08 1.155974e+08 1.262758e+08 1.385132e+08 1.295568e+08 125499582.90 1.317262e+08 1.638087e+08 1.174132e+08 106782486.94 1.137873e+08 1.309072e+08 1.303071e+08 2.784972e+08 1.271492e+08 1.359174e+08 1.256397e+08 1.267336e+08 1.438932e+08 1.285821e+08 1.352297e+08 99791028.584 1.290410e+08 1.407242e+08 1.264740e+08 1.197816e+08 1.277355e+08 1.288446e+08 1.390245e+08 102132981.48 1.350201e+08 1.231221e+08 1.321461e+08 9.273057e+07 1.276479e+08 1.317725e+08 1.325006e+08 9.612317e+07 1.196264e+08 1.477013e+08 1.549022e+08 1.099922e+08 1.150486e+08 1.231272e+08 1.323671e+08 1.267371e+08 1.085361e+08 1.177149e+08 1.331443e+08 1.222699e+08 1.294557e+08 1.293612e+08 1.339051e+08 1.305570e+08 1.315413e+08 1.175104e+08 1.055235e+08 1.178373e+08 1.041388e+08 1.150678e+08 1.284725e+08 1.366183e+08 1.092950e+08 1.197628e+08 1.344899e+08 1.109290e+08 9.962904e+07 1.122851e+08 1.022456e+08 1.163220e+08 1.228962e+08 1.269318e+08 1.235008e+08 1.071862e+08 1.290403e+08 3.225766e+08 1.071271e+08 1.205890e+08 1.008189e+08 1.272432e+08 1.107846e+08 1.138458e+08 1.174430e+08 1.085184e+08 1.207368e+08 1.166285e+08 2.617715e+07 1.150616e+08 1.191036e+08 3.044100e+07 1.263103e+08 1.260443e+08 1.116029e+08 1.154834e+08 1.202983e+08 1.207016e+08 1.136947e+08 1.339781e+08 1.176045e+08 1.046246e+08 1.307971e+08 1.373483e+08 1.253879e+08 1.103427e+08 9.657545e+07 1.203394e+08 1.401505e+08 1.305627e+08 1.125694e+08 1.241590e+08 1.345832e+08 1.422420e+08 1.175985e+08 1.106695e+08 1.313069e+08 1.283116e+08 1.425287e+08 1.208142e+08 1.272458e+08 1.332882e+08 1.139237e+08 1.274767e+08 1.229296e+08 1.150554e+08 1.183165e+08 1.490894e+08 1.367603e+08 1.077775e+08 4.177415e+08 1.242423e+08 1.135233e+08 1.160751e+08 1.278952e+08 1.084856e+08 1.215543e+08 1.362955e+08 1.332742e+08 1.227767e+08 1.119196e+08 1.051344e+08 1.063344e+08 1.017111e+08 1.245448e+08 1.295818e+08 1.473196e+08 1.294055e+08 1.121233e+08 1.181288e+08 1.278646e+08 1.046784e+08 1.218213e+08 1.570470e+08 1.062159e+08 1.156094e+08 1.041105e+08 1.006174e+08 1.107641e+08 1.294208e+08 1.220857e+08 1.221339e+08 1.215120e+08 1.315325e+08 1.284239e+08 1.222281e+08 1.224291e+08 1.330186e+08 1.527518e+08 1.523778e+08 1.463473e+08 1.295883e+08 1.241625e+08 1.168029e+08 2.864246e+07 1.303934e+08 1.231186e+08 1.205383e+08 1.201331e+08 1.297497e+08 1.207659e+08 1.203377e+08 1.072573e+08 1.020543e+08 1.254524e+08 1.320096e+08 1.231283e+08 1.366008e+08 1.204599e+08 1.091749e+08 1.463777e+08 2.725935e+09 1.240402e+08 1.051051e+08 1.275259e+08 1.302669e+08 1.151434e+08 1.093450e+08 1.659882e+08 1.548733e+08 1.216528e+08 3.229923e+07 1.434209e+08 1.149733e+08 1.156509e+08 1.637685e+08 1.115203e+08 9.293753e+07 1.015615e+08 4.580028e+07 1.434014e+08 1.197765e+08 1.045794e+08 1.060270e+08 1.109336e+08 9.873987e+07 1.064200e+08 1.290573e+08 1.120932e+08 1.260912e+08 1.341608e+08 1.245911e+08 1.231776e+08 1.221501e+08 1.199307e+08 1.097568e+08 1.085179e+08 1.041443e+08 1.292499e+08 1.151723e+08 1.120079e+08 1.322952e+08 1.046628e+08 1.168957e+08 1.349501e+08 1.186371e+08 1.440126e+08 1.151411e+08 1.247398e+08 1.066137e+08 1.169872e+08 1.005352e+08 1.101854e+08 1.238761e+08 1.172363e+08 1.348578e+08 1.337292e+08 1.348532e+08 1.114510e+08 1.435406e+08 1.156793e+08 1.208101e+08 1.160395e+08 1.263116e+08 1.186049e+08 1.172648e+08 1.389180e+08 1.248502e+08 1.159164e+08 1.243605e+08 1.322061e+08 99.01697_18.768 3.992468e+07 1.520363e+07 1.533566e+07 1.596465e+07 1.169230e+07 1.576407e+07 1.381294e+07 1.493562e+07 12567941.66 1.530055e+07 2.029920e+07 1.414741e+07 11791900.96 1.333795e+07 1.478016e+07 1.587749e+07 3.064992e+07 1.548389e+07 1.453898e+07 1.366193e+07 1.271040e+07 1.732142e+07 1.562824e+07 1.626025e+07 8402334.334 1.581385e+07 1.580767e+07 1.490982e+07 9.458614e+06 1.490092e+07 1.444239e+07 1.702332e+07 9083863.11 1.534654e+07 1.399048e+07 1.553554e+07 1.018188e+07 1.558981e+07 1.562904e+07 1.530308e+07 9.537106e+06 1.375482e+07 1.759733e+07 1.751325e+07 9.698073e+06 1.410023e+07 1.340332e+07 1.625270e+07 1.209761e+07 1.043127e+07 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1.133183e+07 1.158172e+07 1.699582e+07 1.427507e+07 1.070519e+07 1.133442e+07 1.506699e+07 1.751293e+07 1.303398e+07 1.173539e+07 1.278829e+07 1.149330e+07 1.014904e+07 1.186062e+07 1.171493e+07 1.380222e+07 1.546753e+07 1.564513e+07 1.440795e+07 1.375499e+07 1.292341e+07 1.412343e+07 1.098331e+07 1.083491e+07 1.144189e+07 1.449630e+07 1.174012e+07 1.235941e+07 1.511541e+07 1.143915e+07 1.245258e+07 1.584502e+07 1.428376e+07 1.694348e+07 1.338109e+07 1.383327e+07 1.098671e+07 1.341162e+07 1.006344e+07 1.406475e+07 1.323146e+07 1.298738e+07 1.438571e+07 1.657179e+07 1.639202e+07 1.202313e+07 1.730015e+07 1.407765e+07 1.526332e+07 1.424866e+07 1.346574e+07 1.384563e+07 1.379145e+07 1.549295e+07 1.447052e+07 1.221204e+07 1.157163e+07 1.503637e+07 C4 H11 N3 O5_18.769 9.661950e+06 4.246374e+06 3.576670e+06 4.004300e+06 3.915293e+06 4.189349e+06 3.433960e+06 3.916293e+06 3735049.81 3.571910e+06 5.727114e+06 3.917971e+06 2278769.86 2.881191e+06 3.228067e+06 4.405075e+06 7.308143e+06 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2.223985e+07 2.583601e+07 3.187895e+07 3.476428e+07 2.682511e+07 2.527805e+07 2.718933e+07 2.796687e+07 2.228638e+07 2.327627e+07 2.888792e+07 2.741944e+07 2.968187e+07 3.343345e+07 3.040141e+07 2.917748e+07 2.953423e+07 3.075059e+07 2.714295e+07 2.517414e+07 2.155563e+07 2.905070e+07 2.654466e+07 2.793641e+07 3.060696e+07 2.613253e+07 2.677237e+07 8.634148e+06 2.963383e+07 3.419828e+07 2.456263e+07 2.783551e+07 2.559234e+07 2.677575e+07 2.218342e+07 2.905263e+07 2.531125e+07 2.871403e+07 3.133331e+07 3.730230e+07 3.264303e+07 2.403409e+07 3.567253e+07 2.983395e+07 2.753122e+07 2.781191e+07 2.968981e+07 2.859081e+07 2.470509e+07 3.460846e+07 2.915454e+07 2.614816e+07 2.681684e+07 2.851829e+07 C6 H10 N4 O3_18.927 3.346825e+08 1.221210e+08 1.279958e+08 1.344966e+08 1.119403e+07 1.238342e+08 1.358359e+08 1.270551e+08 123076534.13 1.291834e+08 1.606546e+08 1.151624e+08 104736458.52 1.116081e+08 1.284141e+08 1.278264e+08 2.731930e+08 1.247263e+08 1.332804e+08 1.230949e+08 1.241439e+08 1.409354e+08 1.256942e+08 1.318910e+08 97260535.381 1.257450e+08 1.370136e+08 1.237031e+08 1.174734e+08 1.254162e+08 1.295070e+08 1.457667e+08 108525147.11 1.442575e+08 1.413159e+08 1.619397e+07 1.103813e+08 1.516237e+08 1.496035e+08 1.460256e+08 1.057494e+08 1.315835e+08 1.654277e+08 1.779571e+08 1.268178e+08 2.048222e+07 1.378734e+08 1.429833e+08 1.445517e+08 1.064628e+08 1.338333e+08 1.474520e+08 1.345353e+08 1.494207e+08 1.269003e+08 1.453193e+08 1.277618e+08 1.289275e+08 1.401718e+08 1.035097e+08 1.213532e+08 1.198719e+08 1.128782e+08 1.489196e+08 1.529080e+08 1.253308e+08 1.174021e+08 1.516532e+08 1.087646e+08 9.699359e+07 1.101148e+08 1.001954e+08 1.285733e+08 1.201814e+08 1.239708e+08 1.203802e+08 1.050882e+08 1.263361e+08 3.164396e+08 1.207110e+08 1.182619e+08 9.888881e+07 1.175517e+07 1.086774e+08 1.115736e+08 1.333544e+08 1.247036e+08 1.184337e+08 1.141126e+08 2.555782e+07 1.180193e+08 1.168056e+08 2.966196e+07 1.238761e+08 1.435028e+08 1.094564e+08 1.276454e+08 1.328049e+08 1.183758e+08 1.115269e+08 1.314295e+08 1.159397e+08 1.872165e+07 1.483795e+08 1.616567e+08 1.264027e+08 1.199526e+08 9.506836e+07 1.172015e+08 1.421906e+08 1.320291e+08 1.098363e+08 1.209006e+08 1.482363e+08 1.395103e+08 1.153250e+08 1.081409e+08 1.457432e+08 1.326969e+08 1.684032e+08 1.335746e+08 1.418130e+08 1.509318e+08 1.124901e+08 1.431563e+08 1.412972e+08 1.128324e+08 1.295965e+08 1.462287e+08 1.341350e+08 1.049213e+08 4.976170e+08 1.421135e+08 1.132205e+08 1.138567e+08 1.254071e+08 1.219762e+08 1.183593e+08 1.326999e+08 1.301757e+08 1.365231e+08 1.089589e+08 1.031307e+08 1.035148e+08 9.974488e+07 1.974673e+07 1.435139e+08 1.505289e+08 1.370748e+07 1.329207e+08 1.158688e+08 1.272321e+08 1.024027e+08 1.348659e+08 1.537330e+08 1.041635e+08 1.319286e+08 1.020996e+08 9.825755e+07 1.086460e+08 1.398634e+08 1.423964e+08 1.196729e+08 1.376707e+08 1.563570e+08 1.259773e+08 1.410867e+08 1.382498e+08 1.464036e+08 1.785111e+08 2.725594e+07 1.433009e+08 1.455134e+08 1.209134e+08 1.296776e+08 2.809133e+07 1.354427e+08 1.392410e+08 1.182335e+08 1.178301e+08 1.443787e+08 1.346597e+08 1.180391e+08 1.137537e+07 1.264098e+07 1.406023e+08 1.294583e+08 1.354844e+08 1.339627e+08 1.328151e+08 1.084031e+08 1.435576e+08 1.465394e+09 1.455139e+08 1.172814e+08 1.250677e+08 1.493672e+08 1.125344e+08 1.081551e+08 1.628013e+08 1.518978e+08 1.190673e+08 3.802747e+07 1.406643e+08 1.127504e+08 1.134497e+08 1.595336e+08 2.956543e+07 9.083232e+07 9.959781e+07 5.367344e+07 1.008057e+07 1.166764e+08 1.045549e+08 1.156010e+08 1.087549e+08 1.137945e+08 1.188892e+08 1.266025e+08 1.093948e+08 1.236595e+08 1.315812e+08 1.214907e+08 1.409317e+08 1.194295e+08 1.176239e+08 1.211181e+08 1.222005e+08 1.021334e+08 1.267511e+08 1.125179e+08 1.278474e+08 1.464138e+07 1.025918e+08 1.140394e+08 1.594106e+08 1.163433e+08 1.604172e+08 1.129160e+08 1.223281e+08 1.040693e+08 1.208473e+07 9.787117e+07 1.080555e+08 1.215109e+08 1.323332e+08 1.316324e+08 1.395458e+08 1.322434e+08 1.093291e+08 1.407876e+08 1.159532e+08 1.184808e+08 1.137979e+08 1.238698e+08 1.163415e+08 1.149985e+08 1.590047e+08 1.224748e+08 1.321306e+08 1.232356e+08 1.296901e+08 81.52976_19.097 1.277557e+07 8.048698e+06 6.459730e+06 4.285718e+06 6.699469e+06 1.273544e+07 8.104496e+06 6.179753e+06 11480921.66 8.792166e+06 8.448214e+06 5.250273e+06 5764968.34 4.805167e+06 3.604864e+06 2.044156e+07 3.503452e+06 8.301833e+06 4.850034e+06 3.486789e+06 3.775243e+06 5.582498e+06 4.732004e+06 8.198457e+06 1875824.848 7.902845e+06 1.045729e+07 1.189282e+07 2.708752e+06 5.637023e+06 5.110620e+06 4.872054e+06 2567873.27 7.095518e+06 9.877708e+06 7.200736e+06 7.622058e+05 1.455535e+07 3.326138e+06 2.084121e+06 3.855608e+06 1.001350e+07 8.486405e+06 7.468142e+06 5.837989e+06 9.178497e+06 7.530449e+06 7.497855e+06 1.352471e+07 1.327159e+06 5.586614e+06 9.044229e+06 8.887179e+06 7.776626e+06 4.841902e+06 9.205320e+06 1.190082e+07 1.667192e+07 6.023700e+06 3.016941e+06 6.659382e+06 3.422343e+07 6.471321e+06 8.392262e+06 8.252228e+06 6.563142e+06 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8.143674e+06 4.919443e+06 7.993264e+06 8.033347e+07 1.320526e+07 2.626761e+07 3.459762e+06 7.213868e+06 1.077612e+07 5.299979e+06 4.614687e+06 4.419345e+06 6.511086e+06 5.052950e+06 7.859232e+06 8.397031e+06 3.690371e+06 2.515053e+06 3.442923e+06 4.462778e+06 3.085607e+07 7.349134e+06 2.824319e+06 7.566458e+06 9.928894e+06 1.268373e+07 6.339532e+06 1.103440e+07 9.997054e+06 5.325311e+06 8.443808e+06 1.007574e+07 7.594607e+06 5.464937e+06 7.687093e+06 3.291720e+06 3.835555e+06 6.336943e+07 7.909585e+06 4.940486e+06 2.114115e+06 6.622246e+06 1.006329e+07 5.750628e+06 8.414201e+07 7.534100e+06 2.330183e+06 3.840747e+06 1.596505e+07 6.301367e+06 4.370393e+06 1.229706e+07 1.886128e+07 1.139279e+07 6.202207e+06 3.145196e+06 4.113303e+06 7.040859e+06 6.582898e+06 5.600218e+07 8.315676e+06 5.982983e+06 6.584061e+06 1.231629e+07 7.860608e+06 1.157042e+07 9.807197e+06 5.313273e+06 4.825963e+06 8.647563e+06 9.722971e+06 6.603951e+06 3.561528e+06 4.652853e+06 7.243162e+06 2.841681e+06 6.238119e+06 5.400733e+06 4.154325e+06 5.062017e+06 7.542323e+06 5.423205e+06 1.106812e+07 6.270180e+07 8.844063e+06 1.034770e+06 6.300052e+06 8.734478e+06 8.676395e+06 6.709078e+06 5.570420e+06 4.376269e+06 5.429948e+06 7.585413e+06 5.624309e+06 2.798931e+06 9.172951e+06 7.439291e+06 7.641432e+06 8.024153e+06 7.884052e+06 5.902631e+06 2.035745e+07 2.296654e+06 8.929234e+06 1.842685e+06 4.277103e+06 5.627410e+06 5.279311e+06 7.608211e+06 8.114814e+06 8.290836e+06 2.625909e+06 3.838785e+06 7.965151e+06 3.425202e+06 5.198664e+06 5.605712e+06 4.424518e+06 C H3 N O4 S_19.421 4.874334e+07 3.036259e+07 2.649794e+07 3.583854e+07 4.324491e+07 4.131080e+07 2.463728e+07 6.694839e+07 23727631.86 2.220014e+07 1.561231e+07 4.261771e+07 29513900.40 3.289495e+07 2.049320e+07 2.686073e+07 3.734806e+07 3.265815e+07 2.861841e+07 4.334349e+07 3.145099e+07 6.177736e+07 1.640579e+07 1.908691e+07 34940365.429 3.857028e+07 2.946227e+07 3.069414e+07 2.379474e+07 1.521280e+07 6.842619e+07 2.277343e+07 33440612.51 4.025800e+07 3.167760e+07 2.761276e+07 3.895919e+07 3.821029e+07 4.078393e+07 3.470975e+07 2.989633e+07 2.383772e+07 2.806239e+07 2.169966e+07 3.109478e+07 4.103327e+07 3.080433e+07 3.694181e+07 5.709772e+07 2.965701e+07 4.866890e+07 3.349023e+07 2.774679e+07 2.590790e+07 4.180174e+07 5.839234e+07 3.315794e+07 1.279863e+07 2.271540e+07 2.640925e+07 5.832383e+07 7.072925e+07 1.195039e+07 3.593499e+07 8.149970e+07 4.039800e+07 2.644032e+07 2.765308e+07 3.304754e+07 4.809168e+07 1.782909e+07 2.924055e+07 1.473919e+07 4.575847e+07 2.280956e+07 4.129322e+07 2.984213e+07 2.278231e+07 2.568890e+07 3.918428e+07 2.890450e+07 4.568487e+07 3.275095e+07 3.834726e+07 1.542825e+07 2.960704e+07 3.315592e+07 2.241037e+07 2.715522e+07 2.469668e+07 4.391411e+07 4.104718e+07 3.294125e+07 1.106032e+07 5.071594e+07 4.329065e+07 3.025281e+07 3.047211e+07 2.823417e+07 3.688037e+07 3.600944e+07 7.148977e+06 4.668336e+07 2.213874e+07 2.846463e+07 3.875329e+07 3.887984e+07 2.295534e+07 2.898252e+07 1.659903e+07 1.832151e+07 4.710650e+07 5.137051e+07 3.631549e+07 4.442034e+07 2.220405e+07 5.248755e+07 2.600009e+07 2.476938e+07 2.806529e+07 2.447251e+07 3.232119e+07 1.714217e+07 1.669169e+07 2.891352e+07 1.072225e+07 5.697074e+07 3.079306e+07 4.469329e+07 4.295970e+07 3.685378e+07 3.251013e+07 4.489433e+07 3.814148e+07 2.863474e+07 2.510471e+07 5.203749e+07 5.652154e+07 2.583210e+07 1.654147e+07 6.948918e+07 2.375961e+07 4.586215e+07 3.796880e+07 2.888223e+07 3.172670e+07 7.452405e+07 1.242866e+07 1.395852e+07 1.980785e+07 2.842456e+07 2.700374e+07 1.396011e+07 4.521480e+07 3.449527e+07 4.176889e+07 3.997632e+07 2.291711e+07 8.968501e+06 2.762962e+07 3.146552e+07 2.172528e+07 2.180064e+07 3.408101e+07 3.716881e+07 1.922009e+07 3.402977e+07 3.610600e+07 4.620859e+07 2.425931e+07 3.816242e+07 2.834418e+07 5.299972e+07 3.312781e+07 2.963178e+07 2.995607e+07 2.658716e+07 5.842389e+07 1.984587e+07 5.262086e+07 2.721297e+08 2.874169e+07 2.134747e+07 6.150416e+07 3.471306e+07 3.374427e+07 3.296795e+07 1.253781e+08 1.869434e+07 3.944692e+07 3.549333e+07 3.615808e+07 3.342313e+07 2.631868e+07 4.806925e+07 1.629529e+07 2.436322e+07 3.068624e+07 1.437199e+07 2.632399e+08 1.155652e+07 5.546422e+07 3.248574e+07 1.746034e+07 3.909790e+07 3.353831e+07 5.360744e+06 3.699822e+07 1.575264e+07 3.039413e+07 3.472204e+07 2.555998e+07 5.104110e+07 2.878667e+07 2.594019e+07 1.996268e+07 2.501269e+07 4.304593e+07 1.861217e+07 2.822523e+07 1.083697e+07 3.332373e+07 2.931793e+07 4.024791e+07 1.559526e+07 3.237747e+07 8.851807e+07 4.650416e+07 2.392528e+07 1.876082e+07 9.367789e+06 2.819120e+07 3.365985e+07 2.128964e+07 7.498972e+07 3.765478e+07 4.554026e+07 3.657342e+07 1.999863e+07 2.868289e+07 2.382700e+07 1.870496e+07 2.154183e+07 5.079294e+07 2.800930e+07 2.773868e+07 2.857756e+07 1.293048e+07 2.181005e+07 3.436376e+07 4.229951e+07 1.555841e+07 1.459005e+07 1.292995e+07 8.182809e+06 2.002557e+07 3.781636e+07 4.714597e+07 3.514454e+07 2.403421e+07 5.166569e+07 1.184063e+07 C3 H8 N2 O5 S_19.511 1.791320e+07 1.065113e+07 1.358679e+07 1.320629e+07 1.365758e+07 1.245877e+07 2.209808e+07 1.240713e+07 13547021.29 9.957882e+06 1.130066e+07 1.413781e+07 18865492.56 1.293611e+07 2.232713e+07 2.070967e+07 1.070291e+07 1.356690e+07 1.194796e+07 9.518607e+06 1.747146e+07 1.749316e+07 1.417425e+07 1.169490e+07 15119256.926 1.072925e+07 9.750941e+06 1.069829e+07 1.549776e+07 1.747701e+07 8.078029e+06 1.038275e+07 4612831.73 2.020211e+07 1.045042e+07 8.631974e+06 1.282817e+07 1.017057e+07 1.736520e+07 1.299417e+07 5.425762e+06 1.090166e+07 9.787678e+06 1.121367e+07 1.443968e+07 1.474104e+07 6.953903e+06 1.662938e+07 1.682261e+07 1.021140e+07 7.868677e+06 1.147360e+07 1.222114e+07 1.449193e+07 1.541006e+07 7.725985e+06 1.167749e+07 1.497653e+07 8.772528e+06 1.627282e+07 1.017349e+07 7.483645e+06 1.207930e+07 1.537726e+07 6.981226e+06 1.361613e+07 1.516547e+07 5.474029e+06 1.894807e+07 1.182719e+07 9.597540e+06 1.025177e+07 6.332974e+06 4.157668e+07 9.346577e+06 1.026202e+07 1.039478e+07 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