Metabolite RPLCp_1_CC3_0_TH1 RPLCp_2_CC3_0_TH2 RPLCp_3_CC3_50_TH1 RPLCp_4_CC3_50_TH2 RPLCp_5_CC3_200_TH1 RPLCp_6_CC3_200_TH2 RPLCp_7_CD12_0_TH1 RPLCp_8_CD12_0_TH2 RPLCp_9_CD12_50_TH1 RPLCp_10_CD12_50_TH2 RPLCp_11_CD12_200_TH1 RPLCp_12_CD12_200_TH2 RPLCp_13_CE6_0_TH1 RPLCp_14_CE6_0_TH2 RPLCp_15_CE6_50_TH1 RPLCp_16_CE6_50_TH2 RPLCp_17_CE6_200_TH1 RPLCp_18_CE6_200_TH2 RPLCp_19_PM12_0_TH1 RPLCp_20_PM12_0_TH2 RPLCp_21_PM12_50_TH1 RPLCp_22_PM12_50_TH2 RPLCp_23_PM12_200_TH1 RPLCp_24_PM12_200_TH2 RPLCp_25_PM17_0_TH1 RPLCp_26_PM17_0_TH2 RPLCp_27_PM17_50_TH1 RPLCp_28_PM17_50_TH2 RPLCp_29_PM17_200_TH1 RPLCp_30_PM17_200_TH2 RPLCp_31_SM14_0_TH1 RPLCp_32_SM14_0_TH2 RPLCp_33_SM14_50_TH1 RPLCp_34_SM14_50_TH2 RPLCp_35_SM14_200_TH1 RPLCp_36_SM14_200_TH2 RPLCp_37_SM15_0_TH1 RPLCp_38_SM15_0_TH2 RPLCp_39_SM15_50_TH1 RPLCp_40_SM15_50_TH2 RPLCp_41_SM15_200_TH1 RPLCp_42_SM15_200_TH2 4.75_219.1124n 290.4456435 228.084987 320.9957868 271.5616712 308.869638 321.2328489 553.7618642 376.8764574 546.663893 411.9336594 585.7454179 583.277561 699.5399604 655.7661487 892.8856388 740.1714036 1014.915187 994.5367117 723.864836 696.1042106 862.2137576 858.3634483 945.3664249 926.7984081 508.0381834 465.6818083 347.6871295 395.6839181 460.5396546 451.8820826 639.7688518 552.5114634 780.5073945 721.5054238 961.9307906 927.5530933 541.957732 479.192469 458.7757531 464.8876642 553.2098848 541.2607239 20.71_416.3289n 8.840437238 3.398042647 87.454441 40.98137383 40.13456101 19.52743589 9.461253295 36.0594501 73.11780668 174.7742809 91.1185131 107.1175828 13.2075442 0 35.05437498 7.176152703 4.431158008 0 14.68357832 6.961095993 42.80416418 25.21974119 64.41890308 39.37634381 2.359031143 2.614993558 11.33187347 5.865810041 12.65867678 5.30776973 5.192003071 1.801115258 11.07521244 11.18314168 14.42018842 9.753779433 1.223014876 0 5.03128822 0 14.00775283 2.850731977 24.11_777.5508n 635.2756568 345.5860367 724.521362 573.5180955 1083.867577 574.1551071 1123.393532 315.7869199 676.4031588 201.8218625 1323.430732 393.6553595 287.9073381 204.4455769 892.7206893 370.5062448 2326.990828 1928.437641 573.1123682 404.4120719 476.2090647 631.401982 1156.7644 870.2643969 885.2081238 450.7261153 475.0437473 394.0068477 1197.824399 674.9929233 1001.047713 365.7370787 687.9483368 597.8237493 2106.693703 1606.564152 491.9730941 376.7402712 609.1135693 919.0326054 867.1036316 521.7194652 20.85_813.6227n 3584.023446 3000.037705 3475.403284 2811.759428 6630.487326 6926.420807 4298.846015 2208.952778 4449.548969 1840.072071 4910.360256 5633.389984 1649.026911 1702.224744 3246.893861 1813.919818 3896.188639 3217.949357 1958.348474 2415.080093 2654.970534 2461.129197 5125.152913 5646.107492 3272.631214 1896.728638 3048.537595 1805.456295 5404.15533 4142.176898 2870.975727 1757.27082 7472.114074 2543.663339 7195.438801 6039.068199 3462.460443 1933.712958 2991.676113 2335.367512 5422.501791 3911.41931 13.53_375.2525n 1387.19365 1083.170604 894.7344134 749.0397237 1096.728753 1069.15866 2842.353325 1944.787847 4004.599869 3245.362158 1981.952248 2074.261568 734.28065 661.5622193 452.9942685 384.2060486 476.0783065 484.9363786 2817.811176 2747.907675 2444.483533 2501.719954 3294.586009 3277.148994 4122.210373 3714.902266 3572.227366 3581.605936 4819.831791 4535.842256 2696.89534 2392.942997 3036.199883 2856.832891 3370.613305 3396.482509 959.4660155 821.19738 708.7933484 706.4056374 997.4516835 961.4668098 9.31_309.0783n 41.66752657 33.11046179 44.15482382 36.77771019 35.53308184 42.60351887 24.35062789 16.84435026 24.89233351 27.57267826 38.26579159 32.47158124 32.31946244 25.10891923 48.06956189 39.65476685 52.45114844 55.98176763 18.21930171 20.26916898 34.41672266 28.22972467 25.69298782 24.99214258 25.39304498 22.66658114 33.75066996 25.04408735 39.85710871 34.70195097 44.09183783 34.39698828 70.80554839 64.26234832 79.36800325 77.51693223 31.00101275 27.35549844 38.05673749 41.60627683 41.82079337 45.42396763 6.05_326.1947n 122.7232708 121.7178269 98.07751195 77.52395185 119.6141772 93.38389755 552.9613546 410.6515446 215.4282397 186.2957838 139.3543397 159.4009337 114.0308005 102.2488337 90.01891924 71.65381155 111.2377783 104.906417 149.8216424 134.1860439 85.41201386 73.70340852 131.3504996 106.8568725 115.943395 102.2461002 91.16873939 87.75399443 103.5747487 88.07866588 141.3775929 125.2040299 124.3830576 114.17488 124.3262485 89.5473082 155.1751071 115.4704422 176.3620812 153.3383362 82.55868795 81.21714283 14.11_499.2710n 24.24047171 37.4755066 16.22302734 29.5477575 0 5.057133194 19.46114423 32.37339669 12.2619038 27.23357689 0 8.876216979 30.51714112 66.5135417 18.43120935 41.95768636 7.140817702 24.98167909 42.79931142 51.84403469 29.64713717 37.05019859 15.47743838 17.12029549 50.24618819 59.13626806 41.45762151 48.17778901 12.29353148 26.70402207 35.42073464 45.85414747 14.61531935 26.46727268 5.394373284 8.360100819 63.87946483 84.1371859 35.46548183 59.00624187 33.30906648 50.75559564 24.08_829.5844n 556.0364517 209.4541084 290.4905862 136.3852355 1806.981804 2945.963512 612.6109382 128.821342 230.1067105 83.01538208 1211.687462 2705.508854 316.9156456 455.4187375 326.345058 305.3829772 1746.060526 1684.888748 619.384185 577.1158537 201.3659008 398.961422 1814.363094 2144.332497 586.4388348 737.1117576 178.5441665 233.2588049 1867.190132 2414.36112 511.6424304 411.7304024 276.1450128 308.3246042 1747.827683 2162.53653 480.2633508 519.4186875 323.3369223 269.2370143 1144.283096 1649.019178 20.74_208.1466n 5.792438608 5.114861853 15.32353622 15.91256042 46.2907685 59.84055693 15.33655765 31.17820731 50.76476931 100.5295339 31.45060243 48.96316134 22.12008644 15.34764705 27.86933024 21.07645961 17.38153481 18.12287545 49.18643199 50.54394531 15.56257527 9.084813597 9.554101676 8.185382278 10.58610761 11.31302603 25.36916495 16.81962612 15.53165479 10.81570108 1.011990066 3.424760356 20.1057805 15.84116631 1.108684048 0.981417026 7.817264529 8.697178803 16.26415261 12.59315185 2.094640195 0.93413944 17.48_285.2673n 269.4886479 202.2060978 138.0468602 126.7743725 150.7754359 139.7797171 209.7249278 152.7967022 39.08623481 35.6036274 68.43775482 56.2423834 212.6212041 182.0639397 78.31974894 70.42798927 95.44215526 91.34600118 94.74940612 85.81188684 102.7850928 95.89795955 132.7485955 122.4772774 42.46319141 41.39837719 66.93223217 62.99144062 52.15188428 34.17301268 108.1666981 88.42018939 6.779480445 2.96129132 16.30303835 13.4211748 42.36489456 32.84130951 127.2695668 116.1301082 255.2765859 222.9890295 24.41_751.5717n 3380.889557 3098.845523 2532.642828 491.8210731 901.3509339 753.9265971 2918.262701 49.63945867 3189.942534 11.8585982 634.1118454 616.0437886 2250.839042 2195.900561 1125.490594 2000.560042 739.5724043 555.5375137 3003.579249 2892.53652 3056.824934 2028.665374 875.4114561 866.250726 3763.722859 3330.923931 2753.979142 2736.912617 869.4194729 892.380108 2122.794961 2662.145064 3068.345805 2148.734805 925.3021261 963.413734 2984.118817 3169.242243 2172.552117 1097.389815 700.9727855 698.2190086 2.23_307.0845n 69.26175188 82.69683412 82.16428364 110.5454479 420.1063991 567.963242 59.86838991 55.06306153 8.046252259 16.30690425 6.26100882 7.744592913 178.4010264 210.4745314 221.2964547 263.675813 500.2209116 575.8535464 36.57229833 32.59950028 181.7365932 224.7401734 109.1315768 102.1573296 45.31426917 65.81059482 31.89356769 37.81136332 235.10833 247.8085225 242.6167772 229.9945163 645.1933158 641.2010616 552.2269528 651.0238799 179.872093 170.1254193 65.87689871 77.47972859 215.7222912 265.7953794 20.12_398.3171n 0 3.366838839 13.89847034 12.30029191 5.41246548 12.77974597 3.369873238 13.79219158 1.990384668 21.1263513 0.614218314 6.237561564 1.875204015 0.591949918 3.305338657 0.839866518 0 0.618407227 1.201596528 2.161006375 0.673828679 6.256340391 0 4.120981002 0 0 0 0 0 0 0 0.858223836 0 1.996630729 0 0 0 0 1.237847643 0 1.194318309 2.587256289 20.95_210.1622n 15.4246397 14.4701772 33.89023666 32.45945684 67.78747433 82.97609718 30.96191624 46.77662249 104.8201609 129.3908878 54.49447451 70.54689133 39.90880921 29.00340965 39.58413781 32.14315683 26.9067198 28.88565352 82.33832615 75.86981885 31.69549443 30.54358775 18.77843557 21.23151472 23.42238445 22.63192162 38.33088623 30.27357715 23.0840274 24.51699277 7.413147556 6.949873569 34.32412335 36.43136477 0 2.415116441 21.25425268 24.35062491 32.69921825 26.3521345 5.505241149 5.173541146 20.95_227.1895n 4.269967131 8.386927474 36.14333373 70.90734675 106.2779127 184.6678764 16.30136662 202.8864941 112.6336047 575.8495967 76.75857781 209.5398668 50.34683535 36.88609766 62.46465575 50.43398121 11.79257063 21.68015599 108.4380766 104.1181903 26.28771969 45.0170723 7.879083825 23.22125579 14.74778673 22.03609163 46.90178719 30.08954511 16.2302614 5.498622585 0 2.744769206 20.54020659 40.41464803 0 0 6.926943192 28.86606199 30.81566876 26.26722706 1.624023236 2.819697782 15.15_543.3313n 25.5504017 36.79714831 8.858125118 34.88646951 1.809807445 7.156638493 23.77247828 27.2007851 12.54858883 16.47943544 4.686561696 11.3237542 32.66789446 63.0350797 25.47187688 56.52640799 5.365713059 21.52593274 37.42563919 58.88295661 33.48517435 41.90563595 13.89733481 25.30855994 46.07321089 68.69313563 40.26002005 54.94196235 22.61418258 34.30166432 25.49403477 60.66661008 19.57449506 16.23383867 6.908112614 11.09554147 31.36567254 53.20294793 28.18488599 26.29507084 26.04356858 20.40483379 20.97_785.5593n 36.81363452 20.53973702 35.98200196 38.58801604 73.37722197 62.43944511 50.74727735 18.30230147 44.96601108 8.374717502 47.82623124 129.877621 27.71829587 15.16541165 39.426707 32.89621447 31.73972838 25.72256534 42.05118849 26.49813216 38.67293472 34.17286038 72.62906077 42.36550401 32.83189287 48.26113053 26.8874592 33.55928906 59.81929779 59.13541843 26.90814066 37.89162342 28.44553359 34.15224122 53.13324636 56.13923901 39.60952799 34.51832663 41.75900514 37.19072521 76.48514093 69.20522742 13.95_414.2047n 335.3762722 246.8097896 319.5550134 254.8356174 365.4361573 364.3798542 0 0 0 0 0 0 688.8429788 503.8550868 693.5063912 564.399317 647.99238 644.6391656 0 0 0 0.779407989 0 0 0 0 0 0 0 0 0 0 0 0 0 0 339.500404 241.2052691 284.3145107 241.788059 354.1546117 296.6690945 24.09_773.5534n 1119.206696 798.8409761 1101.790859 479.8103889 750.7409738 1196.745965 1057.684608 939.0254676 1111.498252 370.4499623 887.8668567 257.6016807 613.7358047 558.7672237 683.0060749 822.7623098 803.5279367 744.0750922 857.1506165 1002.436212 678.2657393 857.438669 764.9699812 700.217078 1049.7506 737.4137782 934.3338123 649.835568 933.4447911 491.2140546 990.6916185 812.5711726 844.3973253 983.1721725 1462.829955 840.0682192 1027.452728 668.3485019 906.0079237 506.6824948 546.1203235 465.6000778 24.09_743.5088n 21.04593898 4.282390419 178.393809 19.05247848 206.2216204 224.5723594 22.73360138 3.248642664 302.9591607 2.19002317 284.4325369 376.0361476 10.40126346 6.279685726 645.2445095 392.4894843 361.4382432 343.9448151 29.73027713 21.24344757 267.5975739 294.9790645 396.0693477 398.9357782 11.78071833 21.8867292 161.2700167 164.4202138 269.9835967 269.5609459 10.86474012 15.96159228 391.4455034 421.9591938 435.0854901 471.0456816 9.991213653 15.85159438 288.8847725 250.5087186 204.1523264 204.9074459 3.06_612.1521n 500.9938041 419.5689521 468.5826916 413.4367004 400.2482313 457.6638642 343.1432229 232.6123656 362.7031355 273.3687296 379.7226447 343.4331603 324.2796805 297.8448023 519.9974937 438.3585286 511.2363603 461.8452066 279.0720076 278.0231224 282.4594131 320.8934068 349.9250035 386.7825606 308.1295981 306.8756656 250.7169099 265.1878573 314.4348908 342.7162922 402.4566906 361.1598963 438.622353 429.4792391 550.4203529 486.8068117 406.5192589 388.8459889 384.3526758 358.9165273 424.1785717 418.9112513 24.09_799.5708n 62.04704379 51.62426924 69.80183195 20.03518364 92.02762362 112.0647023 61.62917827 12.253151 137.8388746 1.600636274 99.16401632 109.3402715 42.3462989 27.35006583 181.0412019 84.69918264 274.4039536 214.8881241 50.92370433 31.38446438 77.56668603 59.01215599 136.3838408 91.20511475 75.90994081 64.47116038 66.46700907 70.40458273 77.76217849 93.95334324 27.61438513 48.00608992 121.5176513 107.3696123 120.8105837 136.7846561 34.31209659 51.25305831 79.78535015 94.90537982 88.47491796 86.75854172 17.37_520.2590n 1885.449459 1385.998143 1986.681119 1550.291728 1475.120915 1314.920662 1939.552296 1293.848162 2130.452373 1366.217551 1779.076374 1502.321851 2380.036582 2007.85923 2970.781856 2300.767605 2788.762115 2537.404493 2431.09331 2219.20209 2919.803844 2437.401423 2542.534615 2300.3453 3995.558685 3121.806397 2952.489434 2532.020649 3066.605584 2713.207364 2984.204159 2202.07491 3953.43739 3067.469641 4000.978776 3180.085132 4761.741094 3472.307621 4573.77371 3799.568435 4992.148391 4001.707427 18.07_481.3174n 360.5453182 471.1489298 247.9639408 353.3109636 98.06618745 135.6293765 247.4080364 367.1669371 225.8905067 313.8722226 112.6737056 157.9244608 466.7752915 695.9015655 357.5530774 478.1708604 202.6875557 250.2825181 377.0429095 495.2845202 351.7449058 381.5167785 224.1310311 282.4093996 443.3733779 538.058215 360.8307024 426.3922341 248.2323501 279.2217837 401.0812898 441.1624363 292.7584498 292.8554329 213.6610968 208.1788228 386.4741564 434.2691513 241.7102328 310.1494808 225.5171475 296.8190354 15.67_495.3337n 944.7456609 1342.434014 772.48718 1258.489053 316.0040201 726.5858281 881.4746705 1123.334145 805.5403804 1140.786321 420.7602246 794.0667013 949.1679193 1400.923933 998.9572325 1573.575055 647.0674513 1341.346701 1416.577216 1685.540087 1415.170118 1714.159861 1328.481278 1661.501816 1768.962082 2004.27697 1438.272202 1748.229579 1246.883667 1593.015786 1034.249983 1227.248857 981.3359581 1204.967327 746.4553874 994.5337282 1285.216315 1520.367781 1007.729635 1387.2596 951.7673529 1321.766548 24.09_779.5456n 3253.435673 332.0246079 1674.421063 738.475154 11405.44032 10435.02272 4587.703405 166.1338929 1577.995033 244.5695774 9819.921214 10623.46699 993.1306283 1546.566947 4070.528456 2399.219541 11463.77613 12698.27207 4482.038976 2451.402065 1551.663076 1396.334032 12842.12085 12040.03281 4393.15312 4720.990658 1524.502153 1176.176846 11840.0748 10628.98743 3697.557915 2365.217223 2892.050428 2206.047224 14869.30268 16870.25735 2864.526415 980.9869983 2640.174841 1927.97806 10036.59896 9005.247688 16.56_479.3003n 37.41402751 62.00320775 15.44156768 43.44502614 0 8.575040008 38.58036427 53.46875015 24.34430494 58.77804824 3.088454404 18.48337584 45.04282792 76.51759496 21.41686951 57.80707507 5.386713399 20.06030939 47.86085736 69.82673774 20.97697947 41.16613885 18.25841352 31.63289255 28.64977266 57.88112245 29.23046407 50.03544405 11.42432698 19.25918814 37.06468471 57.00236682 20.05973907 26.54439284 13.26101184 13.70757092 45.67132103 82.05008373 22.83899999 44.78838854 22.39692947 41.08012247 16.57_529.3186n 4928.466512 6575.527712 3143.192838 4751.955053 771.8364316 1383.36408 4181.409034 5374.994106 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