#METABOLOMICS WORKBENCH XiaoyangSu_20230818_124921 DATATRACK_ID:4228 STUDY_ID:ST002824 ANALYSIS_ID:AN004608
VERSION                          	1
CREATED_ON                       	08-23-2023
#PROJECT
PR:PROJECT_TITLE                 	Leukemia inhibitory factor suppresses hepatic de novo lipogenesis and induces
PR:PROJECT_TITLE                 	cachexia
PR:PROJECT_SUMMARY               	We performed metabolomic analysis to measure polar and lipid metabolites in the
PR:PROJECT_SUMMARY               	serum from TgLC and TgL mice with Tamoxifen (TAM) injection. We compared the
PR:PROJECT_SUMMARY               	levels of lipid metabolites in the liver from TgLC and TgL mice with TAM
PR:PROJECT_SUMMARY               	injection. The lipid metabolites levels in the liver from Balb/c mice bearing
PR:PROJECT_SUMMARY               	C26 or C26-LIF KO tumors were also measured. Mice under both fed and fasted
PR:PROJECT_SUMMARY               	conditions were included. To investigate whether fenofibrate can restore hepatic
PR:PROJECT_SUMMARY               	lipid homeostasis, TgLC mice were fed with a regular chow or fenofibrate diet.
PR:PROJECT_SUMMARY               	Lipid metabolites in liver tissues were analyzed after TAM injection. A similar
PR:PROJECT_SUMMARY               	effect of fenofibrate on lipid metabolites was observed in C26 tumor-bearing
PR:PROJECT_SUMMARY               	mice.
PR:INSTITUTE                     	Rutgers University
PR:DEPARTMENT                    	Department of Radiation Oncology
PR:LAST_NAME                     	Hu
PR:FIRST_NAME                    	Wenwei
PR:ADDRESS                       	195 Little Albany St, New Brunswick, NJ 08901
PR:EMAIL                         	wh221@cinj.rutgers.edu
PR:PHONE                         	7322356169
PR:DOI                           	http://dx.doi.org/10.21228/M8FB1R
#STUDY
ST:STUDY_TITLE                   	Leukemia inhibitory factor suppresses hepatic de novo lipogenesis and induces
ST:STUDY_TITLE                   	cachexia
ST:STUDY_SUMMARY                 	We performed metabolomic analysis to measure polar and lipid metabolites in the
ST:STUDY_SUMMARY                 	serum from TgLC and TgL mice with Tamoxifen (TAM) injection. Mice under both fed
ST:STUDY_SUMMARY                 	and fasted conditions were included.
ST:INSTITUTE                     	Rutgers University
ST:LAST_NAME                     	Hu
ST:FIRST_NAME                    	Wenwei
ST:ADDRESS                       	195 Little Albany St, New Brunswick, NJ 08901
ST:EMAIL                         	wh221@cinj.rutgers.edu
ST:PHONE                         	7322356169
ST:SUBMIT_DATE                   	2023-08-18
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_S_1F	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=TgLIF_S_1F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_S_1M	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=TgLIF_S_1M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_S_2F	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=TgLIF_S_2F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_S_2M	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=TgLIF_S_2M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-S_1m	Genotype:TgLC | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-S_1m.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-S_2f	Genotype:TgLC | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-S_2f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-S_2m	Genotype:TgLC | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-S_2m.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-S_3m	Genotype:TgLC | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-S_3m.mzXML
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_F_1F	Genotype:TgLC | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=TgLIF_F_1F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_F_1M	Genotype:TgLC | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=TgLIF_F_1M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_F_2F	Genotype:TgLC | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=TgLIF_F_2F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	TgLIF_F_2M	Genotype:TgLC | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=TgLIF_F_2M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-F_1f	Genotype:TgLC | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-F_1f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-F_1m	Genotype:TgLC | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-F_1m.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-F_2f	Genotype:TgLC | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-F_2f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_Tglif-F_2m	Genotype:TgLC | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_Tglif-F_2m.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_S_1F	Genotype:TgL | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=WT_S_1F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_S_1M	Genotype:TgL | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=WT_S_1M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_S_2F	Genotype:TgL | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=WT_S_2F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_S_2M	Genotype:TgL | Condition:Fasted | Metabolites:lipid	RAW_FILE_NAME=WT_S_2M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-S_1f	Genotype:TgL | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_WT-S_1f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-S_2f	Genotype:TgL | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_WT-S_2f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-S_3f	Genotype:TgL | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_WT-S_3f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-S_3m	Genotype:TgL | Condition:Fasted | Metabolites:polar	RAW_FILE_NAME=Serum_WT-S_3m.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_F_1F	Genotype:TgL | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=WT_F_1F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_F_1M	Genotype:TgL | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=WT_F_1M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_F_2F	Genotype:TgL | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=WT_F_2F.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WT_F_2M	Genotype:TgL | Condition:Fed | Metabolites:lipid	RAW_FILE_NAME=WT_F_2M.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-F_1f	Genotype:TgL | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_WT-F_1f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-F_1m	Genotype:TgL | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_WT-F_1m.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-F_2f	Genotype:TgL | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_WT-F_2f.mzXML
SUBJECT_SAMPLE_FACTORS           	-	Serum_WT-F_2m	Genotype:TgL | Condition:Fed | Metabolites:polar	RAW_FILE_NAME=Serum_WT-F_2m.mzXML
#COLLECTION
CO:COLLECTION_SUMMARY            	Whole blood was collected and centrifuged at 9000 rpm for 10 minutes. The
CO:COLLECTION_SUMMARY            	supernatant is serum. Serum was then stored at -80 °C.
CO:SAMPLE_TYPE                   	Blood (serum)
#TREATMENT
TR:TREATMENT_SUMMARY             	TgL and TgLC mice were injected with Tamoxifen under the fed and fasted
TR:TREATMENT_SUMMARY             	conditions.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	For lipidomic metabolites extraction, 10 μL serum were mixed with 75 μL
SP:SAMPLEPREP_SUMMARY            	methanol and 250 μL Methyl tert-butyl ether (MTBE). After shaking for 6 minutes
SP:SAMPLEPREP_SUMMARY            	at 4 °C, 62 μL H2O was added and followed by centrifugation for 2 minutes.
SP:SAMPLEPREP_SUMMARY            	Supernatants were dried down for further analysis. Polar metabolites were
SP:SAMPLEPREP_SUMMARY            	extracted from serum using the extraction buffer containing methanol:
SP:SAMPLEPREP_SUMMARY            	acetonitrile: H2O (40:40:20).
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Lipidomics method
CH:INSTRUMENT_NAME               	Thermo Vanquish
CH:COLUMN_NAME                   	Agilent InfinityLab Poroshell 120 EC-C18 (100 x 3mm,2.7um)
CH:COLUMN_TEMPERATURE            	55C
CH:FLOW_GRADIENT                 	0 min, 25% B; 2 min, 25% B; 5.5 min, 65% B; 12.5 min, 100% B; 19.5 min, 100% B;
CH:FLOW_GRADIENT                 	20.0 min, 25% B; 30 min, 25% B
CH:FLOW_RATE                     	0.2mL/min
CH:SOLVENT_A                     	90% water/10% methanol; 34.2 mM acetic acid; 1 mM ammonium acetate
CH:SOLVENT_B                     	75% isopropanol/25% methanol; 34.2 mM acetic acid; 1 mM ammonium acetate
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:ACQUISITION_PARAMETERS_FILE   	LCMS_Pos_30min_55C_LongElution
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Plus Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:MS_COMMENTS                   	Positive Ionization mode
MS:ION_MODE                      	POSITIVE
MS:CAPILLARY_TEMPERATURE         	300
MS:ION_SOURCE_TEMPERATURE        	360
MS:SPRAY_VOLTAGE                 	3500
MS:AUTOMATIC_GAIN_CONTROL        	3000000
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	Ion counts
MS_METABOLITE_DATA_START
Samples	TgLIF_S_1F	TgLIF_S_1M	TgLIF_S_2F	TgLIF_S_2M	TgLIF_F_1F	TgLIF_F_1M	TgLIF_F_2F	TgLIF_F_2M	WT_S_1F	WT_S_1M	WT_S_2F	WT_S_2M	WT_F_1F	WT_F_1M	WT_F_2F	WT_F_2M
Factors	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	Genotype:TgLC | Condition:Fasted | Metabolites:lipid	Genotype:TgLC | Condition:Fed | Metabolites:lipid	Genotype:TgLC | Condition:Fed | Metabolites:lipid	Genotype:TgLC | Condition:Fed | Metabolites:lipid	Genotype:TgLC | Condition:Fed | Metabolites:lipid	Genotype:TgL | Condition:Fasted | Metabolites:lipid	Genotype:TgL | Condition:Fasted | Metabolites:lipid	Genotype:TgL | Condition:Fasted | Metabolites:lipid	Genotype:TgL | Condition:Fasted | Metabolites:lipid	Genotype:TgL | Condition:Fed | Metabolites:lipid	Genotype:TgL | Condition:Fed | Metabolites:lipid	Genotype:TgL | Condition:Fed | Metabolites:lipid	Genotype:TgL | Condition:Fed | Metabolites:lipid	
Cearamide(d18:1/16:0)	124213.4000	69162.0500	186519.5500	159414.6900	185295.2000	176571.8300	211148.8900	196098.4800	39375.7900	60357.0400	59111.9700	53293.9100	85107.9700	117988.4800	116471.9400	106706.4500
Cearamide(d18:1/18:0)	101206.0000	29298.3800	102571.8400	76814.1800	138238.4400	22477.4100	116415.0300	91557.4800	84554.0400	29684.1800	65116.1400	44347.8500	44978.1200	45058.7100	87399.2500	55958.4500
Cearamide(d18:1/22:0)	303240.7200	508619.5300	362699.4700	766139.0600	644453.9400	299560.0900	630408.6900	1009670.5600	245723.3100	193737.8800	198401.1700	353727.4100	245151.4500	291863.7800	268633.9700	485590.5300
Cearamide(d18:1/24:0)	882418.5600	1491715.6200	917345.2500	2295069.0000	1468709.8800	1004907.6900	1435061.3800	2182409.5000	697484.3100	455963.6600	599038.9400	814087.9400	534652.6900	636879.5600	615199.1900	919684.4400
Cearamide(d18:1/24:1)	752903.5000	895492.0000	943997.0000	1258081.5000	1350192.0000	747623.5000	1099912.1200	1569534.5000	648043.3100	432652.9700	485471.9100	685522.5000	395532.4100	514525.0900	569539.8100	570877.4400
Cearamide(d18:1/24:2)	95478.5100	107522.1200	127508.3100	128830.6900	151474.8300	82072.2800	138156.8800	179661.1700	63823.0700	73180.6200	47813.5400	79912.2700	41763.1500	60097.7900	64658.2200	84743.4800
CE_NH4(16:0)	42871.4100	33138.0200	48428.5400	92930.5200	35374.8600	39915.3000	69387.3200	43796.6600	48296.5700	29440.4200	43309.6600	32873.7600	30210.7200	33570.7500	36825.1800	39596.8700
CE_NH4(16:1)	41384.5500	28081.4700	102824.1000	55848.3100	51665.0200	36561.5200	65583.9800	37265.1400	26475.9300	31258.6300	38395.0200	40591.8300	62697.4700	42120.0900	45713.4300	30532.5800
CE_NH4(16:2)	13730.8600	6685.1400	24919.4900	17608.4100	21022.3600	22975.5800	16614.0800	21273.4400	16917.0100	11797.8000	15982.9700	13011.0100	20963.1200	3485.8800	18641.7800	5872.7400
CE_NH4(18:0)	29897.7600	47740.5700	86218.5100	128751.7100	23470.8300	99616.7800	28689.2400	51734.8900	36525.0300	12006.9800	11402.8000	6770.8500	14700.3800	3886.7100	15982.5900	14629.5100
CE_NH4(18:1)	1388792.1200	2131854.0000	2510552.0000	4078792.0000	1439726.5000	2064566.0000	2238277.2500	1966748.0000	1353387.8800	945477.8100	978982.0000	921432.5000	1221589.2500	975625.9400	1192323.3800	724109.2500
CE_NH4(18_1-d7)	862902.8100	703157.3100	597536.9400	981499.1900	903488.4400	723767.0000	950170.8100	584095.9400	1444784.8800	1377269.1200	1568682.1200	1307864.5000	910883.4400	1025981.5000	1030264.5000	1119743.3800
CE_NH4(18:2)	6482446.5000	7951616.0000	10021210.0000	8101748.5000	8076633.5000	11004456.0000	7494048.0000	9246595.0000	7968856.0000	9254001.0000	9895205.0000	9384231.0000	7793394.5000	6280598.5000	8354581.5000	6611992.5000
CE_NH4(18:3)	601709.5000	488864.1200	1062660.2500	902996.3100	818135.1900	766222.6900	663450.6900	1045221.6900	708614.7500	609095.8100	594780.9400	715614.6900	885290.3100	352043.5000	588647.0000	362580.0300
CE_NH4(18:4)	3431.2700	3638.9100	11603.0600	10320.4500	24724.3400	22121.8700	11984.1900	11411.3200	5578.4500	8463.1800	9815.0300	11469.5300	43014.6400	11903.3300	27288.6200	10872.2200
CE_NH4(20:1)	9109.0000	23500.9900	40051.6100	60662.3100	11602.0800	56820.4100	27708.3800	20005.8400	9124.1600	7123.5900	6345.8600	4292.0800	19966.3400	10948.2700	17003.4600	7629.5700
CE_NH4(20:2)	68512.0200	88349.5700	67167.7200	77608.6800	95145.9500	92165.3200	93916.2600	98112.2100	153214.3000	117991.3800	104435.6000	99525.4800	131378.9400	121106.1900	123275.6000	121210.1500
CE_NH4(20:3)	57408.3600	125806.9900	42813.0700	90646.6500	70104.5400	107885.5300	75163.6300	102577.9700	178455.0200	162018.2500	193946.0500	182936.5500	201393.3900	182146.7500	161962.5800	202827.8600
CE_NH4(20:4)	6572861.5000	9032455.0000	6687687.5000	8438127.0000	8190396.0000	11894221.0000	7142297.5000	7931654.0000	9037327.0000	11214035.0000	12619683.0000	11787516.0000	10778702.0000	8179262.5000	11965101.0000	7314981.5000
CE_NH4(20:5)	1289455.8800	1337991.7500	1963011.3800	1897543.5000	1882065.3800	2451057.7500	1229174.5000	2550187.0000	1969146.6200	1537122.6200	2505894.7500	1829743.6200	2303659.2500	854797.6900	2326608.5000	1114404.6200
CE_NH4(20:6)		7631.0200	3357.8500	6624.6900		6918.3100	3797.4300	4965.4200	3213.0800	11573.7100		18328.8300	13376.4000	3233.4000	7747.6000	
CE_NH4(22:4)	77006.6000	87279.2900	53979.1700	62844.3200	63542.5000	75217.4600	55768.0800	97938.2600	164509.6100	99141.4700	112332.1200	106591.7700	155329.1400	140701.0900	133552.0200	106668.6800
CE_NH4(22:5)	20406.5800	20008.5400	18313.4100	27305.6900	14201.5300	11353.0500	9701.3600	43730.4500	32393.8200	31400.2200	20521.2100	36898.5500	17260.0500	26481.3200	28683.7400	21027.1800
CE_NH4(22:6)	4831101.5000	5966740.0000	5899168.0000	8093726.5000	5481011.5000	8776443.0000	4147419.2500	8251669.5000	5804008.0000	5416510.0000	7062376.0000	5741230.5000	4624266.5000	2582898.2500	3426219.2500	3175790.7500
DG_NH4(32:0)	135752.1400	187365.9500	108860.7500	157243.1100	193880.0600	223497.3600	238145.1100	289149.5300	156026.2500	204274.2000	168998.3400	188517.3800	316231.6200	314729.9700	289384.6900	356555.0000
DG_NH4(32:1)	30587.7800	55149.1900	18339.5400	43404.9600	59294.7800	36573.4500	64538.1200	44994.2500	10190.4700	18088.2900	13531.0700	28727.8900	85043.3900	109227.1800	60371.4100	128951.9500
DG_NH4(32:2)	29422.7100	20956.5000	19828.5000	18108.1100	18251.0500	8530.9300	20293.5900	41753.7500	4458.4800	9178.2200	9052.3800	7944.9200	20142.3100	51062.6800	53990.6400	46961.5100
DG_NH4(33_1-d7)	8894447.0000	9012235.0000	8504224.0000	9459767.0000	8816622.0000	9910989.0000	8579912.0000	9220055.0000	10249501.0000	10001032.0000	9229872.0000	10423285.0000	9408499.0000	10727908.0000	10682985.0000	9003127.0000
DG_NH4(34:0)	289891.5900	299329.3100	247267.1700	279164.2800	299433.4100	330612.8400	450386.8800	404585.8400	273562.5000	472086.3800	389877.2500	373976.3400	509657.9100	402516.5300	406434.5300	444502.2200
DG_NH4(34:1)	529588.0600	758586.5600	491836.7200	906316.5000	623997.5600	647933.2500	800913.0000	1156521.1200	368526.0900	496176.4100	349674.7500	470494.2200	711555.5000	1164671.6200	861672.6900	1233029.8800
DG_NH4(34:2)	1630134.6200	1702540.0000	1267163.3800	1750860.0000	1369423.6200	1442132.3800	1536261.3800	2181594.0000	1495911.0000	1530710.5000	1297513.6200	1473046.8800	1461933.5000	2226636.7500	1746719.6200	1867760.0000
DG_NH4(34:3)	108791.3400	92854.4500	77098.2700	118701.0000	70681.7400	77421.3000	101383.1300	157049.7700	40129.8900	22877.5400	37467.5200	82519.7700	88086.8500	135692.5500	134166.5300	183850.1700
DG_NH4(34:4)	67619.3000	51604.0300	78255.7700	88068.7500	42406.0000	122143.7500	86625.3600	92187.9500	96654.1800	21786.8000	90430.2300	43277.4600	59802.9900	73849.5500	73837.0500	44431.3400
DG_NH4(36:0)	383592.7200	346097.6600	304516.2200	313699.5300	290103.4100	347435.1200	711150.0600	357483.0900	304251.7200	499128.7800	614296.6900	332029.1600	451484.0900	346593.7500	382196.3400	474739.2500
DG_NH4(36:1)	182607.6700	292381.6200	125458.6500	232693.8300	208359.9200	159453.0500	205505.6200	287413.4100	97654.6600	109403.3700	108164.1000	105833.3000	202361.0500	247478.3000	228522.7500	223560.4800
DG_NH4(36:2)	923903.6900	1262380.1200	817446.8100	1755322.3800	849544.8100	890208.5000	1194659.3800	1527810.3800	623195.4400	582657.7500	517295.8400	820806.5600	746179.6900	1373960.2500	1039583.1900	1328127.1200
DG_NH4(36:3)	1676719.1200	2710935.5000	1304084.5000	3248128.0000	1386594.1200	1576618.1200	1832046.6200	2698428.2500	1037950.8100	1023047.5000	684729.7500	1472704.0000	1094783.8800	1978043.6200	1713604.0000	2305785.0000
DG_NH4(36:4)	967962.3100	1540251.5000	667985.9400	1639233.1200	894155.2500	671251.5600	1131603.6200	1475380.3800	453818.6200	542830.0600	387727.3400	688528.4400	482526.9100	1010667.7500	935605.4400	976392.0000
DG_NH4(36:5)	44537.6600	56966.2700	54188.1100	148688.8600	69013.2100	93085.5000	102273.3400	153050.2300	70714.3000	52451.8100	24740.1800	79333.1800	97780.0400	131025.1600	77913.3200	134423.8300
DG_NH4(38:3)	95818.4300	215818.7300	76621.8800	154393.0200	92010.4300	104960.7100	112335.4600	147038.0200	47632.7500	54380.0300	21267.2700	64686.8500	67531.7400	116058.5400	89401.7000	102618.8800
DG_NH4(38:4)	110512.9600	172093.0600	188320.7700	358634.9700	211201.6400	184996.7300	165771.2500	227620.7000	65801.8000	168920.6400	56254.3000	147223.9200	110337.7900	116069.4100	94365.1900	106445.1000
DG_NH4(38:5)	430611.2800	816424.8100	719812.5600	1593789.1200	777501.1900	854977.3100	553346.5000	1032289.2500	213334.1700	266020.0900	211812.7300	321126.5300	195350.3800	349717.5900	252954.6700	485330.5300
DG_NH4(38:6)	608396.6900	1120709.5000	1022217.0000	2315781.7500	929425.8100	893010.2500	737533.3100	1677810.0000	301300.9100	368324.7200	293028.0300	460531.3400	231245.9200	378658.6600	316046.8800	544888.4400
DG_NH4(40:5)	36862.4600	72185.2200	54744.2000	117291.1200	65285.5400	53458.8600	57951.8900	63716.9600	17167.9400	13997.5600	13780.1900	8650.0300	5509.0400	40367.6100	28368.6000	52303.5800
DG_NH4(40:6)	86571.1300	118492.8400	114830.1200	213957.7500	114996.6200	114076.1000	117379.8400	160332.5600	56889.7900	47309.4900	38067.3900	65858.2000	38370.9400	77003.2600	37367.4100	86770.9100
DG_NH4(40:7)	590688.4400	760874.5600	958919.7500	1767395.3800	509684.5900	1406400.6200	538145.1200	1083868.5000	326791.0300	407656.2200	286289.7500	372242.7500	215110.5500	249899.5800	201645.0600	265892.1900
DG_NH4(40:8)	778211.6900	984677.0000	1398701.3800	2885308.7500	650023.0600	1452583.5000	555632.5000	1426930.6200	393188.1600	562064.1900	370045.3800	510994.5000	195165.3000	175313.2500	256957.7000	179161.6100
DG_NH4(42:6)	545191.9400	807585.5600	654898.4400	783431.2500	459859.5900	1142152.6200	647803.0600	536243.8800	1273969.1200	761963.2500	1745510.1200	1316395.1200	1392364.5000	605261.0600	1215735.0000	539544.6200
DG_NH4(42:7)	52872.4600	52913.3900	37174.3300	66405.9900	43014.0000	75185.4400	53766.2800	44503.5100	68645.8900	45819.3500	85251.8800	68655.0400	97546.1500	52408.6800	78174.4800	37577.6700
DG_NH4(44:8)	708118.3100	931000.5000	544241.6900	671394.6900	414099.4700	1099585.7500	576405.1900	622727.7500	1211924.3800	929038.5600	2401242.2500	1517359.5000	1716897.0000	872641.9400	1464450.5000	701166.1900
DG_NH4(44:9)	164751.0500	202564.7000	160172.0200	191767.2000	139279.4200	300545.0900	210357.5500	198498.6700	225292.6400	112911.4100	244103.3900	158442.1600	329960.4100	186081.9500	326936.6900	153296.1600
LPC(14:0)	24420.8500	48222.3900	26258.4900	42926.8000	39338.9300	38914.2700	33697.0300	48269.0500	31015.7000	37409.6900	24154.4000	35145.4900	30655.5700	36141.9300	33603.9300	29553.5600
LPC(16:0)	65709172.0000	80795256.0000	62768052.0000	77474104.0000	81987912.0000	62271060.0000	90602712.0000	116569176.0000	93575976.0000	74723944.0000	103491032.0000	86802608.0000	85263584.0000	86409544.0000	93869400.0000	92049856.0000
LPC(16:1)	458370.0000	542068.3800	361996.9100	471947.0300	613369.1900	406686.0300	610349.5600	808028.6900	682000.5600	621666.2500	685789.4400	739827.8100	802666.6900	767272.8100	724771.9400	931471.6900
LPC(18:0)	61914656.0000	91240960.0000	55748004.0000	80540104.0000	77862112.0000	68341576.0000	76081592.0000	90606304.0000	62242188.0000	41420624.0000	49640364.0000	51614060.0000	39469228.0000	46010352.0000	49262912.0000	48283260.0000
LPC(18:1)	6581440.0000	9878673.0000	5752736.5000	6449176.0000	10209096.0000	6584952.0000	10076732.0000	10980709.0000	14765164.0000	12012121.0000	11623507.0000	12423181.0000	15013000.0000	14837219.0000	13496043.0000	14711840.0000
LPC(18_1-d7)	20395214.0000	22188392.0000	19514034.0000	20869496.0000	22045046.0000	22239696.0000	22884986.0000	21340742.0000	21330306.0000	22431776.0000	25402000.0000	21258800.0000	21472912.0000	23949034.0000	23471698.0000	21244578.0000
LPC(18:2)	17222508.0000	27300034.0000	12648411.0000	13364987.0000	40254540.0000	17027820.0000	31243618.0000	32955754.0000	46795572.0000	32812952.0000	29065014.0000	32126662.0000	65316560.0000	63158124.0000	61018592.0000	61443812.0000
LPC(18:3)	115046.5500	152642.7500	84735.7300	90362.9100	237217.3800	148297.4200	251991.4500	299541.2800	283088.6600	169039.3400	244168.3800	223475.0200	451137.6600	537335.0600	474970.5300	447738.3800
LPC(20:0)	134186.3900	293286.2500	108142.5000	232440.4500	174118.2700	202311.1700	149934.7000	207493.1700	145003.9200	186787.2500	125165.3800	210461.0500	170773.4200	181141.4200	145628.1400	204784.5600
LPC(20:1)	155242.0800	410119.2200	140509.9800	280541.7500	281662.5300	340931.7500	264921.0000	357899.2800	240380.2500	271993.5300	241363.5500	277468.4100	270526.4100	320202.9700	237446.2500	340496.0300
LPC(20:2)	144627.6200	232684.1400	102893.7900	147860.5200	208056.5200	139932.5500	167555.2700	193803.1700	334490.2800	252129.4500	235909.9400	262960.2800	293053.2800	259214.6200	248023.5800	312823.7200
LPC(20:3)	328823.4100	527962.8100	233408.0500	293535.6600	448421.7500	236399.1700	513001.7200	410787.1200	1683434.3800	1368992.8800	991720.7500	1034777.4400	1331301.6200	1554499.8800	920828.5600	1406307.1200
LPC(20:4)	2824408.0000	5439056.0000	2141400.2500	2519425.7500	4317752.0000	2397154.7500	4288211.0000	3854316.0000	11800172.0000	7948215.5000	9033768.0000	6886334.5000	9852157.0000	8788032.0000	7908117.5000	9482764.0000
LPC(20:5)	167814.9800	252900.1400	167082.6100	198831.3800	458709.0900	206719.5000	457492.2500	405642.8800	408034.3800	178116.3000	375354.9700	256935.1700	894330.5000	956837.6900	1052372.5000	825110.6900
LPC(22:0)	107857.4300	153597.1100	99525.3800	141419.5000	156926.0500	112157.2100	123553.6800	140756.0800	133575.4700	121940.7300	128546.1000	132157.4800	123501.0600	121487.1900	140371.6100	146584.4800
LPC(22:1)	35957.8100	60521.2000	33221.3500	43864.8900	37232.1800	38292.2500	35571.5100	33841.1400	47608.1600	40446.5500	44303.2600	40936.3700	32661.7700	47970.1100	40329.7900	51559.5100
LPC(22:4)	28394.9900	43217.4600	24042.4300	29035.7200	42513.8100	31440.0100	42963.8900	35521.1100	69481.2700	41671.8900	39545.9400	38125.5900	37982.4800	51876.2000	28769.3400	47961.9300
LPC(22:5)	106917.5400	142226.0000	93290.3700	100833.5400	159828.9800	65665.6600	138298.3000	187178.9800	412919.5900	226369.2300	211608.8000	225368.1900	132317.8000	217482.7700	211225.3800	288657.8100
LPC(24:0)	198334.2000	253837.7500	168291.4800	251477.4500	241110.8300	196847.3000	230160.9800	244690.6700	301538.0300	139094.6100	237241.9500	224084.9200	237231.3300	220118.2500	280573.0300	239105.7300
LPC(24:1)	39976.9500	60697.1200	32356.7000	38005.2700	61116.9500	48605.5600	38957.3300	41380.2700	48178.2300	46783.3400	46604.8200	55975.3900	42950.8700	64684.1400	58452.9500	55429.5400
LPC(24:2)	8255.2300	14024.3300	7317.2000	7834.9800	11205.4700	9774.2900	9581.5200	9632.3900	16796.2600	6750.6900	11994.3400	12428.8600	7290.2500	14944.4100	18499.5800	11760.5400
LPE(16:0)	1062356.1200	1440600.3800	1202737.6200	1857236.0000	1730836.6200	1283528.6200	1633210.1200	2220214.2500	1898170.0000	1183452.8800	1266030.5000	1346388.7500	1255286.0000	1331522.5000	1535529.8800	1581982.5000
LPE(18:0)	1712334.1200	2216569.7500	1908130.1200	2405009.2500	2392307.7500	1956271.3800	2235886.0000	2599334.2500	2287703.0000	1490144.0000	1587576.0000	1539995.8800	1561393.6200	1594232.6200	2039653.3800	1769305.3800
LPE(18:1)	177140.4200	305412.7800	174664.3000	267371.4700	367541.7500	299738.6200	306653.0600	334947.1200	358240.1200	326188.1600	233759.5200	292323.2200	458255.4100	490202.4100	540967.3100	457957.6600
LPE(18_1-d7)	3209760.0000	3726180.0000	3248548.0000	3572705.2500	3514003.7500	3548017.2500	3651618.0000	3279543.7500	3614116.0000	3353080.7500	3792236.7500	3742105.2500	3332016.7500	3489911.0000	3815592.0000	3707594.7500
LPE(18:2)	728717.1900	1107474.2500	592361.3100	734399.5000	1562773.0000	900237.6900	1213703.3800	1191888.6200	907829.7500	775247.1900	602927.4400	563282.2500	1763820.5000	1767260.0000	2080499.3800	1482490.0000
LPE(18:3)	8588.2300	6507.6300	6765.2600	3239.6700	26193.6000	16940.5300	21589.5400	32778.0900	26964.9600	8765.6300	3428.8300	4051.3000	40222.9500	54556.3200	61501.8200	53935.9300
LPE(20:0)	827993.4400	1491972.6200	775652.0600	1093533.6200	1089921.1200	1092582.0000	1064427.3800	1500468.5000	1012027.6900	1182472.1200	917297.8100	1214125.6200	1049210.2500	1225406.2500	965787.1900	1092056.6200
LPE(20:1)	54275.2100	81151.0600	45070.1900	52473.8600	90234.5900	69788.0300	78655.8700	85209.9800	113532.9100	111151.1500	89954.6200	120479.5400	138183.9200	133209.0500	123944.4100	114101.5600
LPE(20:3)	17747.1600	27642.6300	12970.9100	9723.3500	27005.8400	9604.9000	28272.5900	15015.8700	37206.8800	43048.4600	22032.5900	32576.5400	53415.7900	53558.2400	60795.4600	54496.7500
LPE(20:4)	747566.0600	1032091.0000	652255.3100	731694.0600	894593.4400	586051.3100	893248.6900	899146.9400	1112771.5000	1242344.6200	1133395.3800	760767.5600	1150323.7500	1099208.6200	1482469.0000	1107391.2500
LPE(20:5)	64037.2800	77701.9400	58794.4600	46578.7700	122413.9300	59765.4100	102030.4600	124463.9000	57385.2000	58412.7500	53266.6100	25535.0800	117971.0600	114459.1200	156716.8000	95723.0500
LPE(22:0)	180880.2500	652502.9400	212626.7700	361005.4700	244132.5000	450701.3400	283669.2200	566482.9400	172811.3300	407302.5900	164153.3100	348232.8800	289500.2500	430065.3800	249781.7300	349906.4100
LPE(22:1)	29406.8400	55212.9600	29572.2400	34028.9800	42384.1800	38566.8500	38482.5800	49802.0900	46540.2800	50164.5800	40164.2300	45111.0600	56709.4300	51336.3300	46398.7000	29513.1300
LPE(22:4)	7939.0400	12173.8300	9265.8300	12165.6500	12020.3800	4393.6300	9567.2200	6447.3800	14852.2200	18162.1300	9960.9800	12128.8000	14117.7500	12908.3600	16069.8600	10236.3000
LPE(22:6)	1364559.6200	1533286.0000	1053745.8800	1097312.2500	1433637.6200	680337.3100	1463167.5000	2030887.3800	1807042.1200	1738328.6200	1930288.6200	1362144.5000	1366807.6200	1357096.5000	1917370.6200	1935782.5000
MG_Na(14:0)	68108.7000	72237.6000	70584.8600	73497.1200	86470.4300	84783.5600	76239.5400	88059.7400	183646.3800	130722.0500	115319.7700	193137.7500	181555.6400	147486.9800	174119.2700	129500.2000
MG_Na(16:0)	1306167.6200	1550397.1200	1397245.2500	1459589.3800	1627068.8800	1587432.3800	1495454.3800	1533054.5000	4348007.5000	4575418.5000	2813318.7500	5773762.5000	4374494.0000	3469723.7500	4323830.5000	2214537.2500
MG_Na(18:0)	3035389.0000	3067551.2500	2873039.2500	3406846.0000	3271686.0000	3366418.7500	3680222.7500	3411869.7500	6912115.5000	6804146.0000	4680660.5000	7481711.5000	5783433.5000	4806738.0000	5872077.5000	4182010.7500
MG_Na(18:1)	602148.0600	706368.4400	440756.6200	483569.6600	384105.1600	345841.0300	562704.4400	505056.9100	460725.2500	558178.4400	810055.5000	461627.8800	496232.5000	471582.2500	538859.0600	423890.1600
MG_Na(18_1-d7)	1406360.6200	1376613.1200	1375892.1200	1436935.3800	1407497.0000	1436702.8800	1334455.0000	1388730.1200	1259302.1200	1386993.6200	1376657.8800	1452817.3800	1449789.1200	1454886.8800	1419947.0000	1298748.0000
MG_Na(18:2)	1177942.1200	1096774.1200	759689.5000	730438.0600	545125.8100	466578.3800	745730.5000	761658.1900	862140.1900	1050215.8800	1610519.1200	736470.1900	953683.3100	714202.0000	1081976.5000	766752.3100
MG_Na(20:4)	41725.7900	50023.1700	36127.0200	22003.7300	17876.7500	28757.3100	27696.2900	24495.8500	29452.0500	61009.2600	51069.1900	26746.3900	26087.4300	21667.2700	30208.3600	30701.8400
MG_Na(22:6)	103408.6200	38896.7900	77483.0500	36242.1400	50242.9400	17183.4000	36130.3700	53737.9300	66060.8000	89134.3400	111774.0900	52472.1500	42155.7300	30910.2300	54552.1800	31506.5600
MG_NH4(16:0)	411526.5300	486560.9100	442351.4700	486692.4100	560248.0600	499637.3400	516684.7200	503973.7500	1785101.8800	1697351.3800	973168.5600	2193691.2500	1507626.1200	1141410.0000	1613687.3800	901202.5000
MG_NH4(18:0)	1383402.3800	1601129.1200	1404983.8800	1686703.0000	1637871.0000	1744569.0000	1927819.3800	1702915.6200	3608175.7500	3955351.0000	2520125.7500	4380875.5000	3115563.0000	2482289.2500	3419274.7500	2376821.7500
MG_NH4(18:1)	243776.4500	321694.4700	199205.5200	201260.6700	163316.0600	137161.2700	233461.1400	194300.7000	185922.7300	263476.1900	321833.0300	163232.4100	233436.0800	190466.2000	237650.7500	174688.1900
MG_NH4(18:2)	867663.2500	883082.5000	572397.8100	581700.3800	464741.4100	307230.0900	632052.3100	578633.5600	574871.2500	693164.7500	1104717.3800	513489.0000	602014.8800	478794.7500	725763.8100	499081.5000
PC(30:0)	524852.9400	315061.5900	596571.4400	514754.8400	765335.3100	414998.2200	650680.0600	652660.9400	409223.0900	488793.3400	362940.7500	491719.6600	512515.8400	476778.2800	603018.6200	558819.1900
PC(30:1)	20794.4900	26865.4100	30600.3200	17507.7500	31344.8300	12574.1600	18208.6900	37617.6600	11606.4500	25487.7700	17145.2900	26944.4900	17977.8900	19217.6900	18587.9400	18125.0300
PC(32:0)	7576410.0000	6626207.5000	9252383.0000	8789148.0000	8856603.0000	7404757.5000	9831461.0000	8274806.5000	8290545.5000	7852440.0000	10505460.0000	9372840.0000	9890083.0000	10201837.0000	11514692.0000	10816368.0000
PC(32:1)	1809689.0000	1673072.6200	2363231.0000	1896800.8800	2779607.2500	1608115.0000	2519401.7500	3013164.7500	1815520.5000	1536480.6200	1562997.0000	2557985.0000	1967724.3800	2907022.0000	2691235.7500	3135380.0000
PC(32:2)	493246.2200	504539.1200	545037.4400	468866.3800	855583.6900	371758.3400	780422.5600	789765.2500	552385.1900	501506.1600	455106.5900	638209.7500	581547.4400	835674.0600	919546.0000	929187.1900
PC(33_1-d7)	73529888.0000	84047976.0000	82787272.0000	78096600.0000	65311788.0000	79794776.0000	66829568.0000	62072172.0000	86368808.0000	84343144.0000	97733976.0000	74849704.0000	82287592.0000	81029600.0000	76659872.0000	61072544.0000
PC(34:0)	1367434.0000	1798195.5000	1047486.3100	1579594.8800	2457511.7500	1702118.5000	2432824.5000	1857346.3800	2132533.2500	1421443.1200	2359756.2500	1755443.6200	2724661.5000	4173242.0000	5122602.0000	3883556.0000
PC(34:1)	88412168.0000	105339584.0000	132386752.0000	118997672.0000	98915576.0000	63683908.0000	118117496.0000	128880232.0000	89735368.0000	81646528.0000	83736224.0000	102630424.0000	73364040.0000	90272184.0000	78709696.0000	92054664.0000
PC(34:2)	212097920.0000	252094976.0000	247043504.0000	277712064.0000	292727072.0000	242279152.0000	295220704.0000	320203168.0000	216886864.0000	190150848.0000	196683264.0000	201613968.0000	238800400.0000	279005408.0000	320094208.0000	304597216.0000
PC(34:3)	2957473.0000	3813591.0000	3211591.2500	4012945.7500	6239688.0000	3364948.7500	5774285.5000	8356480.0000	3181254.7500	2865782.0000	2710938.7500	4399877.5000	4556158.5000	5929638.5000	6637642.0000	7615039.5000
PC(34:4)	83308.1600	88801.3100	86473.3400	75153.9700	130613.2300	71055.3500	137617.6200	157515.4200	117875.2700	103915.9600	41877.2200	133944.4200	193012.0000	238932.7300	214069.5200	253084.9800
PC(36:0)	290558.6900	596194.3100	182746.9400	296529.6600	322019.7200	299226.7200	490818.8400	347442.8400	585056.5000	280012.7800	560721.3800	330056.5300	415063.6600	579196.3100	535924.9400	629181.1900
PC(36:1)	20557406.0000	24454734.0000	19915470.0000	27722578.0000	28119462.0000	24474560.0000	27679710.0000	37744196.0000	17301412.0000	16440143.0000	13515213.0000	19093106.0000	16079783.0000	24421742.0000	13960376.0000	20844514.0000
PC(36:2)	159293088.0000	225664176.0000	191014208.0000	223215216.0000	245266560.0000	197292848.0000	248131072.0000	253727920.0000	145230960.0000	124358728.0000	127700608.0000	148951008.0000	197857392.0000	229578928.0000	233511440.0000	232846720.0000
PC(36:3)	19269412.0000	29882882.0000	19384208.0000	24782486.0000	37187992.0000	30199098.0000	28892794.0000	31276610.0000	23995840.0000	23449832.0000	21189382.0000	25208362.0000	35902940.0000	51175668.0000	46147660.0000	41071908.0000
PC(36:4)	33990364.0000	51695008.0000	39339424.0000	50938412.0000	38271924.0000	36000660.0000	44550736.0000	48072180.0000	54959812.0000	50866476.0000	63861452.0000	54980444.0000	54654244.0000	57403892.0000	58338572.0000	61418412.0000
PC(36:5)	4466869.0000	5747702.5000	4638764.0000	6598014.0000	12689601.0000	5256890.5000	11243560.0000	12926544.0000	3007732.0000	1998886.3800	3317525.0000	4774444.5000	11202957.0000	13828699.0000	15441268.0000	14620305.0000
PC(38:1)	229696.1400	317672.0300	202708.3800	273522.6600	433094.9100	402369.8400	371426.9100	349003.7500	224333.2000	203337.0600	223779.8300	244129.1400	216488.3900	378770.1200	320292.6600	382778.6600
PC(38:2)	1530110.0000	1972641.8800	1309632.6200	1707147.5000	2435154.7500	1800921.6200	2087026.5000	2212189.7500	1455785.6200	1264788.3800	1153157.7500	1610782.6200	1936642.5000	2353069.2500	2004591.1200	2016131.3800
PC(38:3)	5931252.5000	8909825.0000	5422020.5000	9659566.0000	7303688.0000	7773726.5000	7749622.5000	5139077.5000	8500465.0000	8430157.0000	6749490.0000	9687488.0000	7742718.0000	9997101.0000	7243455.5000	8129336.5000
PC(38:4)	46299360.0000	80221368.0000	59122988.0000	72453064.0000	53748384.0000	47181376.0000	64768928.0000	65879980.0000	66257924.0000	55423744.0000	68135800.0000	66560532.0000	47536732.0000	55659404.0000	52856132.0000	58379744.0000
PC(38:5)	9160496.0000	14603736.0000	11075131.0000	15193275.0000	12247932.0000	9818559.0000	13021612.0000	17716038.0000	9106828.0000	7361107.5000	8859028.0000	10011713.0000	12088204.0000	14904829.0000	13433259.0000	12559535.0000
PC(38:6)	63244228.0000	64221952.0000	69298072.0000	92501576.0000	58473776.0000	58611472.0000	59674532.0000	101953080.0000	68312168.0000	52771632.0000	87800376.0000	70355640.0000	34363600.0000	43821876.0000	42430548.0000	55023008.0000
PC(40:1)	23874.4200	34085.7700	16943.9400	23045.0500	34325.1100	36222.1600	26228.8100	38514.4700	29131.4400	25768.3600	22677.1500	32136.2300	26488.8100	46501.5100	14531.8900	39489.6100
PC(40:2)	83081.2600	133700.0500	70583.3000	87631.3500	173512.1200	100030.4100	122868.5600	128380.4900	73884.2000	83246.6500	52598.6100	63215.1700	141244.2700	187778.3800	126218.8100	122030.0200
PC(40:3)	74580.7300	174797.9200	61030.3400	59325.7900	105710.7600	80758.0000	40496.2800	141901.2300	73193.1600	53685.4200	36409.4400	59250.1800	86173.2700	157612.7700	121136.1500	112337.1600
PC(40:4)	433292.3800	582916.0000	548542.1900	735644.5000	693042.5000	691078.6200	631175.8800	653898.9400	439442.3400	355894.3800	390061.7800	426752.0900	394112.5900	369797.4100	401219.8400	394392.0000
PC(40:5)	1028222.5000	997298.4400	508077.8800	1121354.0000	1497977.6200	529750.1900	1286550.6200	1617252.6200	1512715.0000	713610.6900	369024.0900	883721.8100	281817.2200	1012019.0000	1111317.3800	797389.1900
PC(40:6)	52088000.0000	68849256.0000	51163264.0000	85972720.0000	53069568.0000	49347636.0000	58722436.0000	89456328.0000	39803684.0000	24161614.0000	34584372.0000	41953640.0000	17430262.0000	21565854.0000	25481360.0000	29092976.0000
PC(40:7)	2281720.2500	4141509.7500	2165218.2500	4139716.7500	2496273.2500	2782757.0000	2724556.0000	4456070.0000	2982108.0000	2603946.7500	4363355.5000	3615368.7500	2034732.5000	2478022.2500	1918510.6200	2898527.0000
PC(40:8)	1021251.6900	1505553.1200	839872.4400	1430569.0000	1276314.1200	1135672.2500	1167564.1200	1745949.8800	979309.3100	934114.4400	983963.2500	1196054.0000	970506.5000	1063263.5000	993318.8100	1552945.3800
PC(42:1)	19332.8000	18247.8300	6601.1400	5022.4500	17660.5100	9831.6000	14642.2000	9015.8300	14031.9300	13524.3100	27663.0400	17599.0700	18019.8400	15739.0700	22365.4400	11453.2600
PC(42:10)	179902.0500	281703.1200	190552.3300	297901.1600	260024.7500	210010.2000	229412.9800	333036.5600	233658.0500	147926.4800	183657.3300	166066.8300	202080.6400	257595.7700	198788.0200	290650.7200
PC(42:11)	545399.1900	523755.4700	429877.3800	469311.3800	794545.5600	656341.5000	722991.3100	625060.7500	430001.4700	544771.2500	565859.1900	536460.5000	783855.8100	880506.5600	895191.2500	755713.8100
PC(42:2)	61971.1900	83300.6200	39102.1100	65992.5100	110184.8700	81477.8100	69115.6600	80761.8600	55348.7500	49643.9800	58619.5500	49203.3300	90858.2400	104901.8400	95293.8700	78535.6200
PC(42:3)	44625.8900	63005.2500	37625.4500	39834.9500	101708.2200	72296.0700	47672.5200	47853.6200	35643.4500	19523.6400	20107.3100	29003.7400	72381.5100	91072.9500	104524.8700	82425.3400
PC(42:4)	66595.4600	53553.6700	38953.0600	59907.3000	74278.7000	69624.1600	69758.7300	63755.3300	57797.3600	35858.5900	35252.4500	46168.3100	66518.6500	73930.5000	81333.4900	47333.6100
PC(42:5)	70433.3400	98253.0400	77793.0600	135792.4400	105684.5600	79465.7600	125501.1300	144846.0000	84505.5300	54085.2200	51372.2500	129041.0000	48923.2500	60748.9400	78064.5100	84741.1000
PC(42:6)	76708.3400	163268.0800	94480.1900	236411.0000	113087.8100	166562.8300	112128.1600	191662.3800	81845.6900	94993.2800	73984.1000	161628.4500	78118.2400	38596.9300	40035.3000	96205.2200
PC(42:7)	124099.7700	239614.7300	144316.3000	232393.6200	93663.2300	79271.0500	76347.1500	234648.0000	121371.3700	117781.7000	118070.2200	119684.2300	121418.5500	70383.4000	61094.8600	52566.2900
PC(42:8)	245444.5000	306723.0900	220693.5800	366189.9700	218224.7500	181305.7500	215855.9500	408803.0000	133205.5600	101240.1800	117153.4500	155850.1900	94903.7700	71562.4300	77990.9200	82328.0400
PC(42:9)	32595.7700	46474.0700	43139.9900	20670.7500	49986.8400	36287.8100	29386.7200	64924.8800	28221.8400	29090.6900	12832.0600	13899.4200	26560.5100	17879.2100	27612.8600	37970.4400
PC(44:10)	17120.5100	11936.0800	12077.8800	7351.9700	95745.3400	51253.1700	85893.0100	30124.4400	16605.0100	24569.8800	22172.1000	34449.0300	109659.6500	123230.4600	110228.6600	106958.3800
PC(44:11)	325010.2200	419754.0000	215775.7000	205056.1400	1061526.1200	718373.4400	870532.8100	583082.0600	298814.3800	265004.3800	283251.6200	324044.0900	1083463.3800	1120808.6200	1132720.1200	1001614.6900
PC(44:12)	43454.2900	86188.0400	42602.6700	41391.6400	82375.5600	45989.5000	75023.0900	90779.0500	67448.6600	43350.6600	21710.7800	40458.7300	54971.0200	66470.6900	128780.3400	96521.7100
PC(44:4)	13686.4200	19720.8700	16109.7900	19701.2100	22499.5600	43560.6400	42087.5000	27310.0100	22495.5000	23138.5900	15536.0400	18010.0000	50629.6800	35801.3400	47318.4500	47928.7700
PC(44:5)	12340.1700	29028.5000	9990.2800	17591.3500	26762.4600	26103.5200	21490.7700	20811.4800	20666.8700	12810.7200	12234.6600	9464.2800	39690.4800	47258.8500	37215.5900	33424.3400
PC(44:6)	5490.1800	15600.6300	5603.6400	21660.8000	13024.1300	17825.9500	17884.0600	17171.2600	8402.9300	7449.9400	5585.0000	5160.7300	20697.7200	20024.5500	13518.0100	12576.2100
PE(33_1-d7)	2038586.1200	2073590.3800	2182668.2500	2042662.0000	2222275.0000	2405197.0000	2099017.2500	2095437.6200	2249423.2500	2225765.7500	2418930.0000	2089926.3800	2147229.7500	2487610.2500	2485315.7500	1674836.1200
PE(34:0)	127039.4400	136212.5600	158817.6100	142358.3800	120051.5700	95123.1000	136181.1400	85355.8700	139360.6200	182681.2500	152812.0000	178522.8100	168536.0000	254741.3000	207349.9500	201303.9800
PE(34:1)	74474.9200	116808.3500	142056.0500	374956.3400	187691.1100	238667.5800	149669.7000	223345.7000	45850.4200	154569.8900	32679.6700	55681.8600	142117.2200	208909.8600	182800.2300	244493.2700
PE(34:2)	1197776.6200	1839846.3800	1971942.0000	4215625.5000	1707466.6200	2567578.2500	1340059.0000	2389761.0000	345101.8400	373656.2800	288454.9700	512954.6200	610864.8100	999075.0000	807619.4400	991537.6900
PE(34:3)	23242.6400	34617.0200	53945.5400	100667.3500	58247.6200	58043.5500	53956.2500	120868.7200	3568.1200	4206.4300	4255.3300	11652.1600	12577.9800	55075.0300	32855.9300	42939.8300
PE(36:1)	104345.7400	196935.4800	139517.5300	220583.8300	381347.4700	398501.8400	315459.7200	281794.8400	90306.0400	177737.8100	51332.9900	113704.1900	312254.5900	510911.6600	370983.7800	431052.4700
PE(36:2)	1420726.6200	2272823.2500	1967787.1200	3114657.0000	3414909.2500	3587910.0000	1968989.3800	2802441.2500	725820.3100	835638.3100	482857.4100	834669.8100	1636942.0000	2865699.0000	2350188.2500	2277301.2500
PE(36:3)	329529.3800	769387.4400	423493.8800	862143.0600	710611.2500	988656.3100	555280.2500	789831.4400	162849.2700	304180.8400	139886.7000	268691.5000	548930.9400	722060.5600	638313.5600	581295.5600
PE(36:4)	904902.7500	1556038.0000	1180017.6200	3038472.2500	1070358.3800	1956003.6200	905103.8100	1551459.6200	429462.2500	519231.0900	410114.2500	594076.0000	417724.0000	838453.8100	512090.4100	867889.4400
PE(38:4)	2166367.2500	3651143.2500	3998312.0000	6716802.5000	3289218.2500	4893599.0000	2440699.0000	4892877.5000	1495476.0000	1535116.6200	1190869.8800	1776672.8800	1546847.3800	2496884.2500	2098355.5000	2295854.7500
PE(38:5)	453066.7200	864059.0000	759532.6900	1308805.6200	683685.1900	932065.5600	597414.9400	1124923.6200	224523.0000	582949.0600	273070.9700	333082.2200	386976.4100	543470.1900	460537.0000	557492.4400
PE(38:6)	3049907.2500	4133656.7500	4269312.5000	7820443.5000	2984793.2500	3830859.2500	3079225.0000	7054561.5000	1195726.8800	1251045.8800	1268680.8800	1546520.0000	1113853.0000	1890958.3800	1442707.0000	1966954.1200
PE(40:6)	1310301.3800	1695129.8800	1955683.3800	2791182.7500	1768832.8800	1670798.0000	1588173.0000	3327632.2500	1003620.5600	1059183.6200	794540.8100	1359704.7500	666712.3100	1055565.8800	1124465.0000	1390803.2500
PE(40:7)	374169.2500	564785.6900	336316.8400	659234.9400	473988.8800	502389.5900	430086.7500	923777.5000	206789.0800	436784.3400	262314.4100	427232.0900	228156.0000	383797.5000	259797.0000	353305.2500
PS(33_1-d7)	521374.2800	601447.1900	510946.2200	604985.8100	590538.8100	544291.3100	587514.5000	527345.5600	487543.4100	533808.7500	645257.3100	482458.2200	590764.0000	535465.1900	611118.5600	522478.5900
SM(d18:1/16:0)	52862260.0000	40844356.0000	66403340.0000	48401776.0000	65797580.0000	41677364.0000	55957484.0000	54874484.0000	27735458.0000	16636796.0000	27476808.0000	19722238.0000	19856670.0000	17189110.0000	28142606.0000	23139910.0000
SM(d18:1/18:0)	4326579.0000	1539663.3800	6163633.5000	1793312.3800	5197110.0000	1533695.0000	4305330.0000	2453930.7500	7181308.5000	2365863.5000	6294754.0000	2608405.5000	2578927.7500	2382762.7500	5189090.5000	2315898.2500
SM(d18:1/18:1)	927029.1900	650129.5600	1239827.5000	776787.3100	1278398.0000	663947.6200	1053718.1200	839407.1900	1567584.1200	604350.2500	1131024.0000	649251.6900	820815.0600	621065.1900	1355737.5000	771174.7500
SM(d18_1-18_1-d9)	22879082.0000	22949626.0000	23961274.0000	22725872.0000	23531870.0000	23808214.0000	25497326.0000	24133794.0000	24094366.0000	24211386.0000	23237544.0000	22649082.0000	22936474.0000	24521578.0000	22545094.0000	23658578.0000
SM(d18:1/20:0)	686672.9400	392085.9700	1098323.0000	805171.6900	792558.0600	514537.5300	866295.6900	844443.1900	974347.9400	757818.0000	986999.6900	775694.1900	476455.2500	518695.6200	673649.6900	649940.3100
SM(d18:1/22:0)	4670039.5000	6423781.5000	5610868.5000	10385091.0000	5019018.0000	6150209.5000	5144550.0000	9862548.0000	5074634.5000	4626113.0000	4796144.5000	6713983.5000	2731622.7500	3829161.2500	2439644.5000	6083958.5000
SM(d18:1/22:1)	1102398.2500	1451197.6200	1405441.6200	2104191.2500	1577860.0000	1519898.6200	1517595.0000	2376784.2500	1374166.1200	1071202.8800	1403562.3800	1850403.8800	719149.5000	1039613.5000	1037530.5600	1341025.3800
SM(d18:1/22:2)	384290.0000	356316.0900	767891.4400	464467.4100	561537.2500	265310.9100	554956.4400	595273.6900	520561.2500	275872.1900	379716.4100	287241.7500	302680.2500	335472.3400	387904.0000	369880.7500
SM(d18:1/24:1)	25430608.0000	24160394.0000	33489882.0000	31902928.0000	28882576.0000	28395894.0000	26309654.0000	32382624.0000	26688106.0000	16892412.0000	20450074.0000	18056010.0000	15236699.0000	16790758.0000	18917240.0000	18226768.0000
SM(d18:1/24:2)	5952925.5000	5912344.5000	8002558.0000	8843193.0000	7952566.0000	7684595.5000	6514973.5000	7709412.5000	5947076.0000	4533484.5000	5452122.5000	5452174.5000	3916732.7500	4432917.5000	5046066.0000	5470279.5000
SM(d18:1/24:3)	466070.0300	419240.8800	590339.3800	568742.9400	548392.2500	381637.0000	498405.6200	456313.0900	440691.7500	277353.1600	425486.8400	410872.4100	303089.1900	322703.8800	446489.5000	433756.7800
SM(d18:1/24:4)	388453.7200	159907.4500	822654.8100	275400.4100	473505.5900	214541.6200	617461.1900	417509.2800	496097.4100	233677.0200	425833.2500	122035.4100	386662.0000	316421.6200	454300.1600	345062.6200
SM(d18:1/24:5)	232284.0200	70865.8700	344228.9700	58175.6700	215399.8100	20747.6800	265335.9100	177670.1200	500704.1600	194805.8000	359920.3800	140821.5200	242313.3100	147781.7200	231057.3800	160487.7700
SM(d18:1/24:6)	103007.9400	64672.8400	177937.7300	81469.0900	125703.7300	36182.6700	106170.2800	111816.1500	228056.2700	99100.9100	163114.2200	80224.6800	182871.3800	69927.5300	157818.8300	124579.0500
TG_NH4(42:1)	4460.1500	28095.2400	2590.7400		8110.0700	3952.6900	7316.4600	7915.0000	3143.9300	6385.2000	7785.5500	3400.2200	20649.9400	75871.7700	23426.9300	62404.3200
TG_NH4(42:2)	7054.8700	26033.4900			3421.7000	4256.0800	4764.8400	3512.9400		2868.6700	3569.8400	3220.3700	3511.5700	49908.2700	16476.5500	38843.9300
TG_NH4(44:1)	18373.4300	47730.9900	4117.0500	4208.1500	19080.9000	12216.5800	43667.5000	15421.9000	3739.0500	17712.2500	10312.1300	19883.5500	38657.4400	243108.2700	57906.4600	181243.7700
TG_NH4(44:2)	29982.7800	99038.6900	11778.3400	8723.6800	31405.8200	20800.5400	43599.8200	41927.7400	3996.6700	15526.5000	11201.3800	10700.5500	49435.0400	293952.3100	108720.2900	228855.7000
TG_NH4(44:3)	28326.2100	48200.2200	8381.8700	5490.7200	9301.4000	3734.9300	21137.0600	14523.7400		7679.1100	3930.4000	5437.8700	17754.3900	125407.2500	52995.2700	119489.7100
TG_NH4(46:1)	52577.7700	64701.7900	30126.3500	10681.2300	47547.5500	25137.6200	94418.2800	69542.2000	9487.7100	35672.4300	26665.9600	18109.7200	84638.2400	296920.3800	109921.8800	235136.0500
TG_NH4(46:2)	132145.6400	188043.9500	55239.8300	54466.3600	63846.8300	36757.6400	137737.8000	132095.6400	15839.9300	52430.8900	68434.6600	81584.3000	95436.4400	661371.1900	178655.0500	481256.4100
TG_NH4(46:3)	93766.8700	230158.8600	59645.4600	60034.1400	86453.7800	35521.9500	88429.2300	89671.2900	33445.6100	41677.5300	38635.2400	51681.5200	69930.8600	470361.5000	149168.3300	359608.8800
TG_NH4(48:1)	123321.1500	115572.0200	69579.7700	63696.0500	132399.8000	79007.3100	233356.3900	191150.1700	65617.6000	92912.3800	82921.7900	101615.7300	273674.7200	794550.8100	307070.3400	495226.0000
TG_NH4(48-1-d7)	1649803.8800	1939039.0000	2270314.0000	1823259.6200	2056203.0000	2396041.2500	1600694.3800	1562029.3800	2491642.7500	3146806.0000	3621145.7500	2763050.2500	3034340.2500	1647238.8800	1871732.6200	1669412.3800
TG_NH4(48:2)	373931.6600	346072.0300	127278.6600	143004.8900	260436.2300	145993.8300	541909.6900	316293.0900	125172.2500	139817.9500	181695.0600	260917.5000	388160.5300	1453030.8800	779259.0600	1334813.6200
TG_NH4(48:3)	276818.6200	449471.9100	123309.6000	131614.1900	184275.1400	99975.1000	265925.8800	231988.8900	102353.7600	118171.8200	106178.4500	161307.2300	237316.3900	1126524.8800	454424.2800	870878.2500
TG_NH4(48:4)	179193.6700	348672.4700	109313.9100	106099.4500	160163.6600	49972.7200	162025.2700	189051.1200	61447.6900	117267.7200	92178.3500	143240.0500	101778.8000	625106.7500	209694.9500	512937.6600
TG_NH4(48:5)	87811.5200	101167.1300	40985.1900	50046.1200	64357.9400	25931.3200	58517.2200	82723.5000	29292.8700	38625.8100	27551.6200	47226.6200	36175.1100	233474.6200	93745.0900	174340.6200
TG_NH4(48:6)	14670.5600	25751.8100	8481.9500	5076.9100	25021.0900	5306.3300	12360.6500	12830.4200	4636.4200	7762.0800	10563.9000	14419.2100	16591.3300	66923.7200	42795.5200	66180.3000
TG_NH4(48:7)	6598.2300	4628.5000	2792.6100	7622.0800	11115.7300		3191.3600	10147.6600	3915.6300	3556.1300	2490.6200	2774.1300	4378.8200	28701.8200	13447.4100	17010.2100
TG_NH4(50:0)	85770.4800	137144.4500	33752.3800	22516.8400	84146.2700	160023.3900	231639.8600	55260.9900	44024.7700	33484.1300	83242.8900	44726.5200	143563.8300	348023.3400	211597.4200	221936.4200
TG_NH4(50:1)	870607.1900	914289.0000	642474.9400	693786.5600	796760.5000	587205.1200	1836182.5000	1165545.2500	661374.4400	396453.3400	936251.9400	608171.0600	1044091.5000	2024059.1200	1755257.3800	2181135.0000
TG_NH4(50:2)	1736533.1200	1522654.3800	1044261.9400	1040732.0000	1624833.0000	1180286.2500	2685387.2500	1771738.3800	1209984.8800	1170343.8800	1402773.8800	1653413.8800	1580917.3800	3824632.0000	2826676.0000	4371403.5000
TG_NH4(50:3)	1030637.4400	1440837.8800	657123.0000	913493.6900	992801.5600	627978.5600	2165569.2500	1220119.6200	734071.0000	697560.1200	786628.5000	1277699.1200	1550735.5000	5272902.5000	2510029.2500	3871879.7500
TG_NH4(50:4)	864990.5600	948987.4400	345367.3400	453867.7800	569367.0600	384776.2500	1009615.0000	829027.4400	381194.5000	417246.2200	378646.6600	703646.8100	713666.6900	3270014.0000	1558793.6200	2540282.5000
TG_NH4(50:5)	246432.4500	317461.7200	190569.5000	206846.3100	233953.9400	117303.2000	391805.4100	316425.9100	115891.0900	146876.1600	147992.2300	207068.6900	182329.1200	1221663.8800	441079.1200	979209.0000
TG_NH4(50:6)	161965.2300	166138.7800	102620.4800	128018.8700	191887.5800	38960.6400	164405.5500	234410.0500	57182.8600	71839.0800	83762.2000	90033.7000	105286.0700	505654.2200	253863.5500	414865.7200
TG_NH4(50:7)	94220.1500	71625.9700	81353.1300	57731.7100	122814.5600	23099.7700	69147.1200	143152.3800	33773.5000	27194.5100	54532.7300	42548.5900	43583.6800	125668.5900	85896.2700	105286.0200
TG_NH4(50:8)	40268.8800	24919.8700	40497.8800	24306.8400	52896.9300	3193.2000	30587.4000	97584.5100	10749.8700	7735.7300	16897.7800	13176.8000	21889.7200	19016.3900	38972.9500	35701.1800
TG_NH4(52:1)	447052.1200	698149.6200	237252.7300	198909.3900	504204.8400	225026.8000	965150.9400	254323.0200	155131.3900	65769.4300	290556.9700	104851.6200	484078.5900	1718481.1200	938386.7500	1151859.8800
TG_NH4(52:2)	5209981.0000	6253174.5000	4795845.5000	6854478.5000	3763520.2500	4606375.5000	6855813.5000	5889748.5000	4383178.5000	3373628.0000	4388103.5000	3313954.0000	4125832.2500	10179465.0000	6840444.0000	9179347.0000
TG_NH4(52:3)	8991216.0000	14906387.0000	8635445.0000	13684045.0000	8345020.0000	10225523.0000	12636636.0000	10417565.0000	7876977.5000	9056823.0000	6784332.0000	12553189.0000	7403712.5000	16284167.0000	13054371.0000	16921584.0000
TG_NH4(52:4)	11014477.0000	11610548.0000	6895786.0000	10080713.0000	6103214.5000	6917362.0000	12115941.0000	8929895.0000	8208535.5000	8286420.0000	5325484.5000	10450447.0000	8077867.5000	15047196.0000	11967517.0000	15279584.0000
TG_NH4(52:5)	2535155.0000	2671825.5000	962239.8100	2534881.0000	1949446.6200	1280408.1200	3663716.2500	2779953.2500	1902077.0000	1582860.0000	1512601.6200	2747066.2500	2043306.0000	8158824.0000	4015116.2500	6481295.5000
TG_NH4(52:6)	574867.0600	774512.8100	363596.4100	479478.3400	500669.1600	283106.0900	817699.6900	765854.0000	392707.1200	509661.0000	362821.6200	623001.1900	498629.6600	2443776.2500	1088878.2500	2160863.7500
TG_NH4(52:7)	380692.2200	263984.1200	345361.9400	312264.6600	463929.0900	134745.5200	406351.8800	589584.8100	160204.5300	164371.1700	212454.8900	252862.9500	206140.5200	980413.5000	487872.0900	802254.1900
TG_NH4(52:8)	292604.2500	216347.2000	259162.8000	203638.5800	307871.6200	76418.7300	153086.4400	514843.7500	89505.6500	127570.9800	171727.6100	159863.8000	114710.6200	274687.6600	231062.4200	281781.0900
TG_NH4(52:9)	120644.0500	70153.7900	141666.1700	102900.1900	161592.9800	34097.6400	75702.8700	248321.2000	57583.7300	46372.6800	58200.7600	57107.4700	40460.5400	59010.5700	79659.3100	81374.0400
TG_NH4(54:1)	126004.7100	191778.1100	22696.9700	38714.0100	65161.9600	33658.2100	158537.4400	69879.2800	41743.4700	24970.5000	50036.6400	38033.7900	69095.2000	294729.2500	227821.0500	263489.8100
TG_NH4(54:2)	598213.6900	894800.6900	381173.7800	359703.8800	566816.8800	448612.7800	811290.0000	340061.0300	267090.0900	195970.9800	230947.0000	329843.3800	461706.9100	1326635.3800	573656.8100	982178.3100
TG_NH4(54:3)	2672661.7500	3569750.7500	2511589.2500	2716833.2500	2937017.0000	1642989.0000	3229339.0000	3235935.2500	1875939.6200	1822225.5000	1349666.7500	1373946.0000	2131350.0000	5793798.0000	3183475.2500	3982741.0000
TG_NH4(54:4)	6735069.5000	6678750.0000	3283386.0000	4500743.5000	4788502.5000	3604017.0000	6545356.0000	4614427.5000	3775222.0000	2944043.2500	2900839.2500	3389835.2500	4813361.5000	6649226.0000	7421810.5000	6238881.5000
TG_NH4(54:5)	5509841.5000	6835308.0000	3485919.2500	4287370.5000	4183813.2500	3628898.7500	5494686.5000	5139026.0000	4242851.0000	4185745.2500	3265492.2500	4832320.5000	5484745.0000	11764695.0000	7948451.5000	7536552.0000
TG_NH4(54:6)	4340006.0000	6732107.5000	3394319.2500	4184229.7500	3567460.7500	3154186.2500	6825797.5000	5127842.0000	3894896.7500	2808689.7500	3906564.0000	3811758.0000	3736218.0000	11281448.0000	6918346.0000	8419117.0000
TG_NH4(54:7)	3374538.7500	2749498.7500	2717154.7500	3726185.2500	2666729.2500	1836697.6200	3538678.2500	4456603.5000	2610622.0000	2157941.2500	2299932.0000	2760274.7500	1867562.0000	5332309.5000	3208396.2500	4277421.5000
TG_NH4(54:8)	769598.5000	1064044.1200	921911.0000	908187.1900	1014093.0000	463956.0000	1130541.1200	1464964.1200	632241.6900	559452.8100	587459.5600	736209.5000	486696.5000	1386862.1200	862791.6900	1548502.1200
TG_NH4(54:9)	424196.8800	328155.2500	428023.3400	375208.9100	565370.0600	110326.0900	317302.5000	644099.0000	171202.5600	174664.3000	249183.6700	229851.2700	173381.5000	262825.7200	309422.2200	365970.7800
TG_NH4(56:10)	658225.6900	574281.2500	679927.0000	907695.5600	895795.5000	310033.9100	797517.5000	1635314.6200	609378.1200	477058.7200	533109.0600	631268.3800	445581.5900	778476.9400	785064.8100	1188530.3800
TG_NH4(56:2)	102645.7300	178214.3600	10219.3000	53175.9700	55962.6600	29166.6000	82870.6200	52265.3800	13163.3300	11705.9400	38989.2100	23478.3200	60348.5600	182903.4800	106409.6600	109916.0300
TG_NH4(56:3)	204052.1700	386464.5900	123026.4400	127127.6300	126117.9800	82033.2100	175762.1200	113292.3100	80769.1800	78110.4100	35068.8800	68432.5200	111622.8200	309362.8100	166342.7000	251564.0200
TG_NH4(56:4)	413098.6600	747795.3100	252188.0800	420651.4700	434684.9100	239781.5600	402280.8800	371130.2500	242618.1200	260763.5000	161113.5600	226440.8900	335723.1600	741961.5000	348958.5300	452325.9100
TG_NH4(56:5)	957798.0600	1271913.1200	1047662.5000	1041384.6900	897089.8100	782341.8100	974440.2500	1078110.8800	744867.3100	649990.5000	702537.5000	496925.0900	543063.8100	1016432.9400	802131.6900	938878.8100
TG_NH4(56:6)	1833886.3800	2956051.7500	2405703.2500	1504735.3800	2925372.7500	2223461.7500	2757237.2500	2363747.7500	1857067.6200	1579969.3800	1607372.3800	1524784.3800	1438585.3800	1335671.2500	2048694.6200	1785271.6200
TG_NH4(56:7)	5377990.5000	7813133.5000	7397078.5000	9485288.0000	6538884.0000	6975656.5000	5954561.5000	7312826.5000	5789604.0000	4778734.0000	4560047.0000	5417022.5000	3208482.0000	4648334.5000	3629108.0000	3583298.7500
TG_NH4(56:8)	12194463.0000	14257371.0000	14218844.0000	17438852.0000	8652929.0000	10968790.0000	11398947.0000	13653683.0000	8505831.0000	7394985.5000	8386924.0000	11052019.0000	5084891.5000	6681846.5000	8223008.5000	8146173.5000
TG_NH4(56:9)	3493829.0000	4206383.0000	3592798.0000	4340192.0000	3123603.0000	2098961.7500	3890187.0000	6419829.5000	3873782.7500	2972440.7500	2524806.7500	3189730.2500	1852365.8800	2912349.7500	2885038.7500	3650204.2500
TG_NH4(58:10)	7418818.5000	6846507.5000	5893592.0000	8337778.5000	7488084.0000	5612182.0000	6156312.0000	8604072.0000	6048231.5000	4312496.5000	5455267.5000	4609360.0000	3413875.2500	3125955.2500	3874617.7500	3582476.0000
TG_NH4(58:11)	2778715.2500	3510895.0000	4934342.0000	4516439.5000	4692946.5000	2128381.7500	4552075.5000	8313608.5000	2908465.0000	2131546.2500	3126934.7500	3252676.7500	1811751.1200	2028569.6200	2614356.7500	3386717.0000
TG_NH4(58:5)	53968.4800	51507.2500	39409.2000	43041.8800	29478.2000	51420.5900	50247.8600	33030.5100	28393.1300	23498.9800	5888.9000	15951.2600	16998.1500	89420.2700	42834.6500	43252.1800
TG_NH4(58:6)	279835.9700	288449.0300	326106.8400	288908.4100	333957.5000	145389.1600	310493.5900	339878.2200	171212.1400	118743.9800	125108.2700	117380.9100	114139.0200	230371.0000	166553.9200	155753.0000
TG_NH4(58:7)	847047.5600	760042.6900	948249.4400	895372.5000	749475.5600	629043.0600	1248601.2500	755784.0000	888574.2500	534309.9400	660975.4400	559133.8100	543394.5000	446073.6600	609276.3800	399589.0900
TG_NH4(58:8)	2429374.0000	2600693.5000	2915145.2500	2446087.5000	2183624.5000	2944024.7500	2467205.7500	1799480.0000	2459528.0000	2003304.8800	1967290.6200	2199961.7500	1138901.3800	1285551.6200	1327884.1200	1403980.3800
TG_NH4(58:9)	4683512.0000	6800086.0000	5711504.0000	6261819.5000	4900704.5000	4644245.5000	5757441.5000	5161307.5000	5227357.5000	2977583.7500	4936707.5000	4057135.2500	3476851.2500	3287820.0000	3591704.7500	2813229.0000
TG_NH4(60:10)	440588.6600	640291.5000	634135.1900	586040.3100	919428.2500	632069.0600	540414.8100	718291.4400	628084.6900	444281.7500	466828.4700	445585.1600	369559.4700	327310.0000	339329.0900	333811.3400
TG_NH4(60:11)	2483457.0000	3055462.7500	3593591.7500	3031241.0000	3424455.2500	2669124.2500	2933372.0000	3628932.2500	1910748.3800	1349819.8800	2214675.2500	2073580.1200	1895530.0000	1267792.6200	2454768.7500	1900921.3800
TG_NH4(60:12)	6083221.5000	8039214.0000	8149740.0000	9269094.0000	7375707.5000	6449826.5000	5719886.0000	10520943.0000	6088442.5000	3798092.0000	5616344.5000	4476944.0000	4501326.0000	2246732.2500	5115428.5000	4287105.5000
TG_NH4(60:7)	45628.0800	83731.0000	39004.4300	41191.6900	84212.1500	49751.5400	89576.8800	54681.7700	30866.1900	35945.5700	11015.4700	24857.6800	17936.6400	53242.5200	46207.7000	22456.1200
TG_NH4(60:8)	186642.0800	148956.2500	200539.6700	155530.9400	192529.5800	146016.7500	274725.0000	177773.4200	166024.9800	93921.7800	124469.5300	121804.5700	98979.6900	91138.4700	124211.4400	54715.4400
TG_NH4(60:9)	254230.5800	268083.1200	315631.8800	259314.4500	438753.4700	300899.4100	314925.9100	264589.0300	255540.4800	201420.3900	159296.8000	216525.7000	222047.2700	122402.9100	200851.5600	173508.5300
TG_NH4(62:10)	57287.8000	34025.6100	63030.5300	21695.2200	107793.8100	58786.4800	66827.5600	24790.8100	27950.7500	16082.7600	22853.4000	23635.1100	29485.2400	10368.7800	26920.0900	28030.2100
TG_NH4(62:11)	157278.6100	150399.8400	193793.3800	150388.2200	244185.3600	155013.3000	167065.0900	218372.8000	155980.8000	104051.3800	114186.4700	108270.0200	92486.7800	89115.9400	79779.4900	80018.1200
TG_NH4(62:12)	214965.7700	361491.5900	720797.3100	186166.3000	533048.3100	272787.0000	276109.9400	476315.3800	334026.9700	271946.8100	343770.0300	322129.3400	242361.9500	164430.1100	326669.9100	291601.6600
TG_NH4(62:13)	2477043.5000	2303692.0000	3234540.2500	4264410.5000	3041786.0000	3695491.0000	2569553.0000	2409066.0000	2725812.0000	1378649.2500	1939175.6200	1677516.3800	2040863.5000	959372.0600	1486268.6200	1393419.3800
TG_NH4(62:14)	5103884.5000	6296761.5000	8430263.0000	7864447.5000	4304065.0000	7537580.0000	4629773.5000	6708471.5000	5370746.5000	4488920.0000	3930286.7500	3399438.7500	3661802.7500	2644957.2500	3156799.2500	3404321.0000
TG_NH4(62:15)	608182.4400	464496.3400	788426.8100	649658.0000	930471.5000	265688.2800	574503.1900	1203968.1200	488670.7800	432331.3400	489332.2500	426748.1200	375816.3400	241748.4500	478262.4100	451865.5300
TG_NH4(64:12)	31015.5200	16865.4000	24135.4200	28180.9300	41654.8300	28203.5000	34996.5400	31731.2400	26384.7200	14505.9300	11110.7000	11307.9800	13379.0000	4328.7100	4897.8200	11760.6500
TG_NH4(64:13)	106252.2700	61185.9500	125018.8200	95632.6900	104111.8800	99502.7600	94797.5900	74889.9100	90861.8400	54091.9800	32671.9800	65492.1600	111551.9600	40941.9900	51676.3300	53183.6600
TG_NH4(64:14)	115395.7300	141567.8600	169409.9500	207188.1100	210910.7300	188531.0800	171455.9800	165165.7300	137676.2700	79097.5200	99822.9500	107528.4300	128147.9600	91432.0600	104936.3100	134302.9200
TG_NH4(64:15)	119344.0200	58022.7100	123808.0600	56909.3300	223311.0500	41347.1200	168454.0200	213857.1900	127597.3400	87378.7100	171718.7300	72901.8200	126387.8100	25481.4700	112227.8500	120822.1000
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	pubchem_id	inchi_key	kegg_id	other_id	other_id_type	ri	ri_type	moverz_quant	
Cearamide(d18:1/16:0)								538.518127	
Cearamide(d18:1/18:0)								566.549438	
Cearamide(d18:1/22:0)								622.611572	
Cearamide(d18:1/24:0)								650.643127	
Cearamide(d18:1/24:1)								648.62738	
Cearamide(d18:1/24:2)								646.612	
CE_NH4(16:0)								642.616882	
CE_NH4(16:1)								640.601074	
CE_NH4(16:2)								638.585632	
CE_NH4(18:0)								670.648865	
CE_NH4(18:1)								668.632935	
CE_NH4(18_1-d7)								675.675659	
CE_NH4(18:2)								666.616821	
CE_NH4(18:3)								664.601196	
CE_NH4(18:4)								662.58551	
CE_NH4(20:1)								696.663635	
CE_NH4(20:2)								694.648438	
CE_NH4(20:3)								692.63324	
CE_NH4(20:4)								690.616638	
CE_NH4(20:5)								688.60083	
CE_NH4(20:6)								686.585754	
CE_NH4(22:4)								718.648254	
CE_NH4(22:5)								716.633423	
CE_NH4(22:6)								714.616272	
DG_NH4(32:0)								586.539185	
DG_NH4(32:1)								584.52356	
DG_NH4(32:2)								582.507874	
DG_NH4(33_1-d7)								605.583252	
DG_NH4(34:0)								614.570374	
DG_NH4(34:1)								612.554932	
DG_NH4(34:2)								610.538696	
DG_NH4(34:3)								608.523315	
DG_NH4(34:4)								606.507935	
DG_NH4(36:0)								642.601624	
DG_NH4(36:1)								640.585999	
DG_NH4(36:2)								638.570374	
DG_NH4(36:3)								636.554749	
DG_NH4(36:4)								634.539062	
DG_NH4(36:5)								632.523438	
DG_NH4(38:3)								664.586182	
DG_NH4(38:4)								662.570496	
DG_NH4(38:5)								660.555115	
DG_NH4(38:6)								658.539551	
DG_NH4(40:5)								688.58606	
DG_NH4(40:6)								686.570435	
DG_NH4(40:7)								684.554565	
DG_NH4(40:8)								682.538818	
DG_NH4(42:6)								714.60144	
DG_NH4(42:7)								712.585632	
DG_NH4(44:8)								738.602661	
DG_NH4(44:9)								736.586121	
LPC(14:0)								468.307709	
LPC(16:0)								496.338837	
LPC(16:1)								494.323059	
LPC(18:0)								524.370117	
LPC(18:1)								522.354492	
LPC(18_1-d7)								529.398193	
LPC(18:2)								520.338684	
LPC(18:3)								518.322632	
LPC(20:0)								552.401306	
LPC(20:1)								550.385559	
LPC(20:2)								548.370605	
LPC(20:3)								546.354126	
LPC(20:4)								544.338135	
LPC(20:5)								542.32251	
LPC(22:0)								580.433655	
LPC(22:1)								578.41687	
LPC(22:4)								572.369751	
LPC(22:5)								570.353821	
LPC(24:0)								608.463684	
LPC(24:1)								606.447693	
LPC(24:2)								604.432251	
LPE(16:0)								454.292053	
LPE(18:0)								482.323151	
LPE(18:1)								480.307617	
LPE(18_1-d7)								487.351471	
LPE(18:2)								478.291931	
LPE(18:3)								476.27597	
LPE(20:0)								510.354431	
LPE(20:1)								508.338806	
LPE(20:3)								504.306854	
LPE(20:4)								502.291443	
LPE(20:5)								500.276978	
LPE(22:0)								538.38562	
LPE(22:1)								536.370239	
LPE(22:4)								530.32312	
LPE(22:6)								526.291504	
MG_Na(14:0)								325.23407	
MG_Na(16:0)								353.265411	
MG_Na(18:0)								381.296692	
MG_Na(18:1)								379.281128	
MG_Na(18_1-d7)								386.325226	
MG_Na(18:2)								377.26535	
MG_Na(20:4)								401.2659	
MG_Na(22:6)								425.26535	
MG_NH4(16:0)								348.310181	
MG_NH4(18:0)								376.341339	
MG_NH4(18:1)								374.325623	
MG_NH4(18:2)								372.309998	
PC(30:0)								706.536377	
PC(30:1)								704.520752	
PC(32:0)								734.567444	
PC(32:1)								732.552673	
PC(32:2)								730.536316	
PC(33_1-d7)								753.611084	
PC(34:0)								762.599426	
PC(34:1)								760.583252	
PC(34:2)								758.567627	
PC(34:3)								756.553711	
PC(34:4)								754.535767	
PC(36:0)								790.630737	
PC(36:1)								788.61438	
PC(36:2)								786.598389	
PC(36:3)								784.583069	
PC(36:4)								782.567078	
PC(36:5)								780.551453	
PC(38:1)								816.646362	
PC(38:2)								814.631226	
PC(38:3)								812.61438	
PC(38:4)								810.598267	
PC(38:5)								808.582336	
PC(38:6)								806.5672	
PC(40:1)								844.676941	
PC(40:2)								842.661194	
PC(40:3)								840.645569	
PC(40:4)								838.630188	
PC(40:5)								836.614075	
PC(40:6)								834.598145	
PC(40:7)								832.582031	
PC(40:8)								830.569519	
PC(42:1)								872.708374	
PC(42:10)								854.568787	
PC(42:11)								852.556335	
PC(42:2)								870.692505	
PC(42:3)								868.677063	
PC(42:4)								866.66095	
PC(42:5)								864.644836	
PC(42:6)								862.629822	
PC(42:7)								860.613342	
PC(42:8)								858.599304	
PC(42:9)								856.583679	
PC(44:10)								882.603027	
PC(44:11)								880.588745	
PC(44:12)								878.570923	
PC(44:4)								894.692322	
PC(44:5)								892.676758	
PC(44:6)								890.660461	
PE(33_1-d7)								711.564636	
PE(34:0)								720.552856	
PE(34:1)								718.537048	
PE(34:2)								716.520508	
PE(34:3)								714.505005	
PE(36:1)								746.568665	
PE(36:2)								744.552185	
PE(36:3)								742.537231	
PE(36:4)								740.520752	
PE(38:4)								768.551575	
PE(38:5)								766.536316	
PE(38:6)								764.519653	
PE(40:6)								792.551025	
PE(40:7)								790.535889	
PS(33_1-d7)								755.554199	
SM(d18:1/16:0)								703.573059	
SM(d18:1/18:0)								731.604553	
SM(d18:1/18:1)								729.588928	
SM(d18_1-18_1-d9)								738.644897	
SM(d18:1/20:0)								759.635986	
SM(d18:1/22:0)								787.666931	
SM(d18:1/22:1)								785.651245	
SM(d18:1/22:2)								783.635681	
SM(d18:1/24:1)								813.682312	
SM(d18:1/24:2)								811.666687	
SM(d18:1/24:3)								809.650269	
SM(d18:1/24:4)								807.634216	
SM(d18:1/24:5)								805.620178	
SM(d18:1/24:6)								803.603516	
TG_NH4(42:1)								738.659119	
TG_NH4(42:2)								736.643005	
TG_NH4(44:1)								766.690186	
TG_NH4(44:2)								764.6745	
TG_NH4(44:3)								762.659119	
TG_NH4(46:1)								794.721313	
TG_NH4(46:2)								792.705688	
TG_NH4(46:3)								790.689819	
TG_NH4(48:1)								822.752563	
TG_NH4(48-1-d7)								829.796387	
TG_NH4(48:2)								820.736877	
TG_NH4(48:3)								818.721436	
TG_NH4(48:4)								816.70575	
TG_NH4(48:5)								814.68927	
TG_NH4(48:6)								812.673706	
TG_NH4(48:7)								810.658813	
TG_NH4(50:0)								852.799377	
TG_NH4(50:1)								850.783752	
TG_NH4(50:2)								848.767883	
TG_NH4(50:3)								846.752502	
TG_NH4(50:4)								844.737	
TG_NH4(50:5)								842.721497	
TG_NH4(50:6)								840.705994	
TG_NH4(50:7)								838.689819	
TG_NH4(50:8)								836.674194	
TG_NH4(52:1)								878.81488	
TG_NH4(52:2)								876.79895	
TG_NH4(52:3)								874.783325	
TG_NH4(52:4)								872.767944	
TG_NH4(52:5)								870.752625	
TG_NH4(52:6)								868.736938	
TG_NH4(52:7)								866.721436	
TG_NH4(52:8)								864.705811	
TG_NH4(52:9)								862.689819	
TG_NH4(54:1)								906.846069	
TG_NH4(54:2)								904.830627	
TG_NH4(54:3)								902.814697	
TG_NH4(54:4)								900.79895	
TG_NH4(54:5)								898.783752	
TG_NH4(54:6)								896.767944	
TG_NH4(54:7)								894.752625	
TG_NH4(54:8)								892.736816	
TG_NH4(54:9)								890.721313	
TG_NH4(56:10)								916.736816	
TG_NH4(56:2)								932.862732	
TG_NH4(56:3)								930.845947	
TG_NH4(56:4)								928.830383	
TG_NH4(56:5)								926.814697	
TG_NH4(56:6)								924.799011	
TG_NH4(56:7)								922.783203	
TG_NH4(56:8)								920.767639	
TG_NH4(56:9)								918.752258	
TG_NH4(58:10)								944.767578	
TG_NH4(58:11)								942.752014	
TG_NH4(58:5)								954.845459	
TG_NH4(58:6)								952.830078	
TG_NH4(58:7)								950.814575	
TG_NH4(58:8)								948.798828	
TG_NH4(58:9)								946.783325	
TG_NH4(60:10)								972.799072	
TG_NH4(60:11)								970.783203	
TG_NH4(60:12)								968.767761	
TG_NH4(60:7)								978.845398	
TG_NH4(60:8)								976.830078	
TG_NH4(60:9)								974.814575	
TG_NH4(62:10)								1000.829956	
TG_NH4(62:11)								998.814392	
TG_NH4(62:12)								996.798706	
TG_NH4(62:13)								994.783508	
TG_NH4(62:14)								992.767578	
TG_NH4(62:15)								990.752258	
TG_NH4(64:12)								1024.829468	
TG_NH4(64:13)								1022.814575	
TG_NH4(64:14)								1020.799072	
TG_NH4(64:15)								1018.783752	
METABOLITES_END
#END