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["Table S1 Chemical formula for ESI(-)-FT-ICR MS spectra"]
["Exact m/z","Intensity1","Intensity2","Intensity3","Intensity4","Intensity5","Intensity6","Intensity7","Intensity8","Intensity9","Intensity10","Intensity11","Intensity12","Intensity13","Intensity14","Intensity15","Intensity16","Intensity17","Intensity18","Measured m/z","C","13C","H","2H","O","18O","N","15N","S","33S","34S","P","Cl","37Cl","Br","81Br","I","Error","Neutral m/z","Intensity","RA","S/N","DBE","O/C","H/C","N/C","S/C","P/C","Cl/C","Br/C","I/C","AImod","NOSC","X/C","DBE-O","DBE/C","Formula","Class","Group","Category","Category No."]
[124.0888146,0,0,0,0,0,0,0,0,0,848257,0,0,0,0,0,0,0,0,123.0815095,8,0,12,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,124.0888146,{"$nulls":3},3,0.125,1.5,0,0,0,0,0,0,0.3333333333333333,-1.25,1.5,2,0.375,"C8H12O1","O1","CHO","Lignin",6]
[133.0197489,0,0,0,0,0,753571,0,0,0,0,0,0,0,0,0,0,0,0,132.012483,4,0,7,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,133.0197489,{"$nulls":3},2,0.5,1.75,0.25,0.25,0,0,0,0,0,0.5,1.75,0,0.5,"C4H7O2N1S1","O2N1S1","CHONS","N-ConSatCom",3]
[138.0316938,0,0,0,0,0,723095,0,752623,0,0,0,0,0,0,847610,0,0,0,137.02439439999998,7,0,6,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,138.0316938,{"$nulls":3},5,0.42857142857142855,0.8571428571428571,0,0,0,0,0,0,0.6363636363636364,0,0.8571428571428571,2,0.7142857142857143,"C7H6O3","O3","CHO","Lignin",6]
[138.0680792,0,845318,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,137.06078825,8,0,10,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,138.0680792,{"$nulls":3},4,0.25,1.25,0,0,0,0,0,0,0.42857142857142855,-0.75,1.25,2,0.5,"C8H10O2","O2","CHO","Lignin",6]
[140.0837292,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,758843,0,0,139.0764775,8,0,12,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,140.0837292,{"$nulls":3},3,0.25,1.5,0,0,0,0,0,0,0.2857142857142857,-1,1.5,1,0.375,"C8H12O2","O2","CHO","Lignin",6]
[141.04259280000002,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,749947,0,0,140.035307,6,0,7,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,141.04259280000002,{"$nulls":3},4,0.5,1.1666666666666667,0.16666666666666666,0,0,0,0,0,0.42857142857142855,0.3333333333333333,1.1666666666666667,1,0.6666666666666666,"C6H7O3N1","O3N1","CHON","Lignin",6]
[142.0088499,0,0,0,0,0,1707612,0,0,0,0,0,0,0,0,1199853,0,0,0,141.001643,6,0,6,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,142.0088499,{"$nulls":3},4,0.3333333333333333,1,0,0.16666666666666666,0,0,0,0,0.5,0,1,2,0.6666666666666666,"C6H6O2S1","O2S1","CHOS","Lignin",6]
[142.0266084,0,0,0,0,0,1262401,0,0,0,0,0,776092,0,781680,1297137.0000000002,0,790737,947075,141.01934172727275,6,0,6,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,142.0266084,{"$nulls":3},4,0.6666666666666666,1,0,0,0,0,0,0,0.5,0.3333333333333333,1,0,0.6666666666666666,"C6H6O4","O4","CHO","Lignin",6]
[142.0629938,922800,997940,0,1432496,949310,1931946,1033904,736917,1207890.9999999998,1233327,1038150,882437,1057234.9999999998,770169,2145081.9999999995,0,1008827,969093,141.05573410526316,7,0,10,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,142.0629938,{"$nulls":3},3,0.42857142857142855,1.4285714285714286,0,0,0,0,0,0,0.2727272727272727,-0.5714285714285714,1.4285714285714286,0,0.42857142857142855,"C7H10O3","O3","CHO","Lignin",6]
[142.0993792,0,0,0,735385,0,1877812,0,0,872316,0,0,0,0,751042,2208579.0000000005,0,0,759638,141.09207954545457,8,0,14,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,142.0993792,{"$nulls":3},2,0.25,1.75,0,0,0,0,0,0,0.14285714285714285,-1.25,1.75,0,0.25,"C8H14O2","O2","CHO","N-FreeSatCom",4]
[143.9881145,0,0,0,0,0,851569,0,0,0,0,0,0,0,0,0,0,0,0,142.9808295,5,0,4,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,143.9881145,{"$nulls":3},4,0.6,0.8,0,0.2,0,0,0,0,0.6,0.8,0.8,1,0.8,"C5H4O3S1","O3S1","CHOS","Lignin",6]
[144.0422584,1089120,0,1011811,926583.0000000001,873090,2067521,738271,1205621,1353055,1129780,1076010,0,1243229,1128893,2141620,0,1050815,1157842.0000000002,143.0349817647059,6,0,8,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,144.0422584,{"$nulls":3},3,0.6666666666666666,1.3333333333333333,0,0,0,0,0,0,0.25,0,1.3333333333333333,-1,0.5,"C6H8O4","O4","CHO","Lignin",6]
[144.0575146,0,0,1090152,911771,1090406,819877,0,0,819363,830520,0,0,0,0,0,0,810243,0,143.05023246153846,10,0,8,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,144.0575146,{"$nulls":3},7,0.1,0.8,0,0,0,0,0,0,0.6842105263157895,-0.6,0.8,6,0.7,"C10H8O1","O1","CHO","Lignin",6]
[144.0786438,900138,0,0,0,0,1623179,809545,1081984,0,0,790772,0,0,0,2248126,0,769512,844571,143.07134729411766,7,0,12,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,144.0786438,{"$nulls":3},2,0.42857142857142855,1.7142857142857142,0,0,0,0,0,0,0.09090909090909091,-0.8571428571428571,1.7142857142857142,-1,0.2857142857142857,"C7H12O3","O3","CHO","N-FreeSatCom",4]
[144.1150292,0,0,0,0,0,890069,0,0,0,0,0,0,0,745233,0,0,0,0,143.10779125,8,0,16,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,144.1150292,{"$nulls":3},1,0.25,2,0,0,0,0,0,0,0,-1.5,2,-1,0.125,"C8H16O2","O2","CHO","N-FreeSatCom",4]
[146.021523,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1370582,0,0,0,145.01426400000003,5,0,6,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,146.021523,{"$nulls":3},3,1,1.2,0,0,0,0,0,0,0.2,0.8,1.2,-2,0.6,"C5H6O5","O5","CHO","Tannins",5]
[146.03677919999998,742749,838254,1136162,0,823989,1124037,0,0,814711,0,0,0,1010323,795277,1052315,956619,0,0,145.02949365,9,0,6,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,146.03677919999998,{"$nulls":3},7,0.2222222222222222,0.6666666666666666,0,0,0,0,0,0,0.75,-0.2222222222222222,0.6666666666666666,5,0.7777777777777778,"C9H6O2","O2","CHO","ConAroStru",8]
[146.0579084,0,0,0,0,0,1070411,0,857578,0,0,0,0,0,0,1163425,0,0,0,145.05061325,6,0,10,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,146.0579084,{"$nulls":3},2,0.6666666666666666,1.6666666666666667,0,0,0,0,0,0,0,-0.3333333333333333,1.6666666666666667,-2,0.3333333333333333,"C6H10O4","O4","CHO","Aminosugars",2]
[146.07316459999998,798888,1223801.0000000002,1176045,1010360,883328.0000000001,1232400,1011237,1087695,827650,1184753,848456,816979,1012958.0000000001,904856,1398117,973398,1325626,897598,145.06590158823528,10,0,10,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,146.07316459999998,{"$nulls":3},6,0.1,1,0,0,0,0,0,0,0.5789473684210527,-0.8,1,5,0.6,"C10H10O1","O1","CHO","Lignin",6]
[146.0942938,0,0,0,0,0,856086,0,0,0,0,0,0,0,0,0,0,0,0,145.087036,7,0,14,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,146.0942938,{"$nulls":3},1,0.42857142857142855,2,0,0,0,0,0,0,0,-1.1428571428571428,2,-2,0.14285714285714285,"C7H14O3","O3","CHO","N-FreeSatCom",4]
[147.06841359999999,0,0,0,0,738712,0,0,0,0,0,0,0,0,0,924359,0,0,0,146.06119566666666,9,0,9,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,147.06841359999999,{"$nulls":3},6,0.1111111111111111,1,0.1111111111111111,0,0,0,0,0,0.6,-0.4444444444444444,1,5,0.6666666666666666,"C9H9O1N1","O1N1","CHON","Lignin",6]
[148.037173,0,0,0,0,0,0,0,0,1000855,0,0,0,0,0,0,0,0,0,147.0299015,5,0,8,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,148.037173,{"$nulls":3},2,1,1.6,0,0,0,0,0,0,0,0.4,1.6,-3,0.4,"C5H8O5","O5","CHO","Carbohydrates",1]
[148.0524292,1772007,0,1742126,2089970,2308278.0000000005,3796855,1596259,2275841.0000000005,1883516,1476293,0,0,1724150,0,4247086,1331112,1894861,1824130.9999999998,147.04514076470588,9,0,8,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,148.0524292,{"$nulls":3},6,0.2222222222222222,0.8888888888888888,0,0,0,0,0,0,0.625,-0.4444444444444444,0.8888888888888888,4,0.6666666666666666,"C9H8O2","O2","CHO","Lignin",6]
[148.0557999,0,0,0,0,0,748152,0,0,0,0,0,0,0,0,0,0,0,0,147.04847766666668,6,0,12,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,148.0557999,{"$nulls":3},1,0.3333333333333333,2,0,0.16666666666666666,0,0,0,0,0,-1,2,-1,0.16666666666666666,"C6H12O2S1","O2S1","CHOS","N-FreeSatCom",4]
[148.08881459999998,1434226,1129515,1080473,1045166,1172802,1267779,1291951.0000000002,1718669,1629512,1747728,1784715,1223016,1624513,1240725,1860665,1018228.0000000001,1518680,1612335,147.0815471111111,10,0,12,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,148.08881459999998,{"$nulls":3},5,0.1,1.2,0,0,0,0,0,0,0.47368421052631576,-1,1.2,4,0.5,"C10H12O1","O1","CHO","Lignin",6]
[149.0476782,0,0,0,0,0,1806266,0,0,0,0,0,0,0,0,2148705.9999999995,0,0,0,148.04039866666668,8,0,7,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,149.0476782,{"$nulls":3},6,0.25,0.875,0.125,0,0,0,0,0,0.6666666666666666,0,0.875,4,0.75,"C8H7O2N1","O2N1","CHON","Lignin",6]
[149.08406359999998,852657,773293,0,876618,752845,1074974,0,0,0,0,838006,951964,0,988781,981164.9999999999,0,0,1306153.0000000002,148.076779875,9,0,11,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,149.08406359999998,{"$nulls":3},5,0.1111111111111111,1.2222222222222223,0.1111111111111111,0,0,0,0,0,0.4666666666666667,-0.6666666666666666,1.2222222222222223,4,0.5555555555555556,"C9H11O1N1","O1N1","CHON","Lignin",6]
[149.9986791,0,0,0,0,0,843191,0,0,0,0,0,0,0,0,1019472,0,0,0,148.99135175,4,0,6,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,149.9986791,{"$nulls":3},2,1,1.5,0,0.25,0,0,0,0,0,1,1.5,-2,0.5,"C4H6O4S1","O4S1","CHOS","Tannins",5]
[150.0316938,0,0,2152530,0,0,2372770,1117348,0,0,0,0,0,0,0,3763098,0,0,0,149.024399,8,0,6,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,150.0316938,{"$nulls":3},6,0.375,0.75,0,0,0,0,0,0,0.6923076923076923,0,0.75,3,0.75,"C8H6O3","O3","CHO","Lignin",6]
[150.0680792,2994229,2487925,2535005.9999999995,3107292,2736860,4090126,2965104,2990242,3948486,3074312,2741286,2777621,3212412,2915914,4607526,2357480,2929294,3359079,149.06080415789475,9,0,10,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,150.0680792,{"$nulls":3},5,0.2222222222222222,1.1111111111111112,0,0,0,0,0,0,0.5,-0.6666666666666666,1.1111111111111112,3,0.5555555555555556,"C9H10O2","O2","CHO","Lignin",6]
[150.1044646,1533313,1295745,1313642,1629416,1202409,1645210,1749308,2087983,1801298,1651924,1583955,1085023.9999999998,1978023.9999999998,1704022,2111666,1388596,2076570,1715763,149.0972046666667,10,0,14,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,150.1044646,{"$nulls":3},4,0.1,1.4,0,0,0,0,0,0,0.3684210526315789,-1.2,1.4,3,0.4,"C10H14O1","O1","CHO","Lignin",6]
[151.0269428,0,0,0,0,0,0,0,0,0,0,0,0,0,0,856095,0,0,0,150.019644,7,0,5,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,151.0269428,{"$nulls":3},6,0.42857142857142855,0.7142857142857143,0.14285714285714285,0,0,0,0,0,0.7777777777777778,0.5714285714285714,0.7142857142857143,3,0.8571428571428571,"C7H5O3N1","O3N1","CHON","Lignin",6]
[151.0633282,905604,1177222.9999999998,0,1121849,1095608,2456802,892799,1875963,1468531,866257,1210690,918936.9999999999,1354120,792019,2518507,0,1202007,1299569.9999999998,150.056048,8,0,9,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,151.0633282,{"$nulls":3},5,0.25,1.125,0.125,0,0,0,0,0,0.5,-0.25,1.125,3,0.625,"C8H9O2N1","O2N1","CHON","Lignin",6]
[151.0997136,0,842004,0,0,0,1067503.0000000002,0,807656,0,0,0,0,0,0,963255,0,778339,0,150.09245781818183,9,0,13,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,151.0997136,{"$nulls":3},4,0.1111111111111111,1.4444444444444444,0.1111111111111111,0,0,0,0,0,0.3333333333333333,-0.8888888888888888,1.4444444444444444,3,0.4444444444444444,"C9H13O1N1","O1N1","CHON","Lignin",6]
[152.0109584,0,0,0,0,0,1177133,0,0,0,0,0,0,0,0,1152807,0,0,0,151.00368472727274,7,0,4,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,152.0109584,{"$nulls":3},6,0.5714285714285714,0.5714285714285714,0,0,0,0,0,0,0.8,0.5714285714285714,0.5714285714285714,2,0.8571428571428571,"C7H4O4","O4","CHO","ConAroStru",8]
[152.0473438,0,3892317,5244674,4285723.000000001,4148375,6698426,3351953,5052632,4347492.000000001,0,3173474,3484384,3786007,3878623,9466877,2737340,3161764,3955649,151.04005829411764,8,0,8,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,152.0473438,{"$nulls":3},5,0.375,1,0,0,0,0,0,0,0.5384615384615384,-0.25,1,2,0.625,"C8H8O3","O3","CHO","Lignin",6]
[152.0585772,0,0,0,0,0,1012158,0,0,0,0,0,0,0,0,809367,0,0,0,151.05121925,7,0,8,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,152.0585772,{"$nulls":3},5,0.2857142857142857,1.1428571428571428,0.2857142857142857,0,0,0,0,0,0.5,0.2857142857142857,1.1428571428571428,3,0.7142857142857143,"C7H8O2N2","O2N2","CHON","Lignin",6]
[152.0837292,3234020,2791530,2510479,3373736,2686501,4797127,2914718,3011941,4109872,3531691,2764016,2124781,3291300,3018347,5146303.999999999,2281480,3426864,3502669,151.0764509375,9,0,12,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,152.0837292,{"$nulls":3},4,0.2222222222222222,1.3333333333333333,0,0,0,0,0,0,0.375,-0.8888888888888888,1.3333333333333333,2,0.4444444444444444,"C9H12O2","O2","CHO","Lignin",6]
[152.1201146,0,792695,939932,1192949,0,1655892,1279722,1081266,920125,1089464,1030973,766649,870064,1172024,1431500,0,1289597,952506,151.11284184210527,10,0,16,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,152.1201146,{"$nulls":3},3,0.1,1.6,0,0,0,0,0,0,0.2631578947368421,-1.4,1.6,2,0.3,"C10H16O1","O1","CHO","N-FreeSatCom",4]
[153.0425928,0,0,914113,0,1118978,3023773,0,1499072,2130495,0,0,1653619,0,0,3722887,761682,0,1578267,152.03530933333334,7,0,7,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,153.0425928,{"$nulls":3},5,0.42857142857142855,1,0.14285714285714285,0,0,0,0,0,0.5555555555555556,0.2857142857142857,1,2,0.7142857142857143,"C7H7O3N1","O3N1","CHON","Lignin",6]
[153.0789782,0,0,774062,805525.0000000001,845712,1487274,0,896942,1313356,858852,823451,0,1128157.9999999998,0,1737620.0000000002,0,798408,1145528,152.07168137499997,8,0,11,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,153.0789782,{"$nulls":3},4,0.25,1.375,0.125,0,0,0,0,0,0.3333333333333333,-0.5,1.375,2,0.5,"C8H11O2N1","O2N1","CHON","Lignin",6]
[153.1153636,0,944056.9999999999,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,152.108041,9,0,15,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,153.1153636,{"$nulls":3},3,0.1111111111111111,1.6666666666666667,0.1111111111111111,0,0,0,0,0,0.2,-1.1111111111111112,1.6666666666666667,2,0.3333333333333333,"C9H15O1N1","O1N1","CHON","N-ConSatCom",3]
[154.0088499,0,0,0,0,0,1076861.0000000002,0,0,0,0,786197,0,0,0,1387224,0,0,0,153.00160625,7,0,6,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,154.0088499,{"$nulls":3},5,0.2857142857142857,0.8571428571428571,0,0.14285714285714285,0,0,0,0,0.6,0,0.8571428571428571,3,0.7142857142857143,"C7H6O2S1","O2S1","CHOS","Lignin",6]
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[154.0378418,0,0,813160,0,0,1072327,0,0,0,0,0,0,0,0,1021923.0000000001,0,0,0,153.030561,6,0,6,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,154.0378418,{"$nulls":3},5,0.5,1,0.3333333333333333,0,0,0,0,0,0.6,1,1,2,0.8333333333333334,"C6H6O3N2","O3N2","CHON","Lignin",6]
[154.0629938,3429539,2367984,2674065,2997637,2446078.0000000005,5338001,2711132,3821625,4016171,3159264,2466122,2749142,3153756,2759645,5825900,2183416,3208036,3095941,153.05570526666668,8,0,10,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,154.0629938,{"$nulls":3},4,0.375,1.25,0,0,0,0,0,0,0.38461538461538464,-0.5,1.25,1,0.5,"C8H10O3","O3","CHO","Lignin",6]
[154.0742272,0,0,0,0,0,0,0,0,0,0,0,0,0,0,903374.9999999999,0,0,0,153.06692533333333,7,0,10,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,154.0742272,{"$nulls":3},4,0.2857142857142857,1.4285714285714286,0.2857142857142857,0,0,0,0,0,0.25,0,1.4285714285714286,2,0.5714285714285714,"C7H10O2N2","O2N2","CHON","Lignin",6]
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[155.0218574,0,0,924336,0,0,1340628.0000000002,0,0,1279432.0000000002,0,0,0,0,840821,1699265,0,0,1347872,154.01458528571428,6,0,5,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,155.0218574,{"$nulls":3},5,0.6666666666666666,0.8333333333333334,0.16666666666666666,0,0,0,0,0,0.6666666666666666,1,0.8333333333333334,1,0.8333333333333334,"C6H5O4N1","O4N1","CHON","Lignin",6]
[155.0582428,878862,0,0,1289504,0,1647266,0,0,898581,0,0,0,796355,0,2436302,0,757049,1208301,154.0509792727273,7,0,9,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,155.0582428,{"$nulls":3},4,0.42857142857142855,1.2857142857142858,0.14285714285714285,0,0,0,0,0,0.3333333333333333,0,1.2857142857142858,1,0.5714285714285714,"C7H9O3N1","O3N1","CHON","Lignin",6]
[155.0946282,0,0,0,0,0,0,0,0,0,0,0,0,0,0,878107.0000000001,0,0,0,154.0874188,8,0,13,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,155.0946282,{"$nulls":3},3,0.25,1.625,0.125,0,0,0,0,0,0.16666666666666666,-0.75,1.625,1,0.375,"C8H13O2N1","O2N1","CHON","N-ConSatCom",3]
[155.9881145,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1268639.0000000002,0,0,0,154.9808426666667,6,0,4,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,155.9881145,{"$nulls":3},5,0.5,0.6666666666666666,0,0.16666666666666666,0,0,0,0,0.7142857142857143,0.6666666666666666,0.6666666666666666,2,0.8333333333333334,"C6H4O3S1","O3S1","CHOS","ConAroStru",8]
[156.005873,0,0,0,762414,0,950247,0,750937,0,0,0,0,0,773019,832421,0,0,975690,154.99858341666666,6,0,4,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,156.005873,{"$nulls":3},5,0.8333333333333334,0.6666666666666666,0,0,0,0,0,0,0.7142857142857143,1,0.6666666666666666,0,0.8333333333333334,"C6H4O5","O5","CHO","Tannins",5]
[156.0244999,0,0,0,0,0,2245230,0,0,0,0,0,0,0,0,2023468,0,0,0,155.01720425000002,7,0,8,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,156.0244999,{"$nulls":3},4,0.2857142857142857,1.1428571428571428,0,0.14285714285714285,0,0,0,0,0.4,-0.2857142857142857,1.1428571428571428,2,0.5714285714285714,"C7H8O2S1","O2S1","CHOS","Lignin",6]
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[156.1150292,0,0,0,0,0,1959569,0,1033187,1168540,773770,0,0,0,755715.0000000001,2676814,0,998060,762963,155.1077640588235,9,0,16,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,156.1150292,{"$nulls":3},2,0.2222222222222222,1.7777777777777777,0,0,0,0,0,0,0.125,-1.3333333333333333,1.7777777777777777,0,0.2222222222222222,"C9H16O2","O2","CHO","N-FreeSatCom",4]
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[157.0375074,0,0,0,0,873334,0,0,885929.0000000001,0,828770,0,0,0,0,1011618,0,0,874573,156.03021816666666,6,0,7,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,157.0375074,{"$nulls":3},4,0.6666666666666666,1.1666666666666667,0.16666666666666666,0,0,0,0,0,0.3333333333333333,0.6666666666666666,1.1666666666666667,0,0.6666666666666666,"C6H7O4N1","O4N1","CHON","Lignin",6]
[157.07389279999998,0,0,0,0,0,1407361,0,0,0,0,0,0,0,0,1400432,0,0,0,156.06665700000002,7,0,11,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,157.07389279999998,{"$nulls":3},3,0.42857142857142855,1.5714285714285714,0.14285714285714285,0,0,0,0,0,0.1111111111111111,-0.2857142857142857,1.5714285714285714,0,0.42857142857142855,"C7H11O3N1","O3N1","CHON","N-ConSatCom",3]
[158.0037645,0,0,0,0,0,1582698,0,0,0,0,0,0,0,0,1145228,0,0,0,156.996467,6,0,6,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,158.0037645,{"$nulls":3},4,0.5,1,0,0.16666666666666666,0,0,0,0,0.42857142857142855,0.3333333333333333,1,1,0.6666666666666666,"C6H6O3S1","O3S1","CHOS","Lignin",6]
[158.021523,1038121.9999999999,0,0,1292491,0,1182481,0,0,941613,0,0,0,0,0,1564179,0,0,1038723,157.0142684444444,6,0,6,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,158.021523,{"$nulls":3},4,0.8333333333333334,1,0,0,0,0,0,0,0.42857142857142855,0.6666666666666666,1,-1,0.6666666666666666,"C6H6O5","O5","CHO","Tannins",5]
[158.0401499,0,0,0,0,0,1381625,0,0,0,0,0,0,0,0,1410522,0,0,0,157.03294466666668,7,0,10,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,158.0401499,{"$nulls":3},3,0.2857142857142857,1.4285714285714286,0,0.14285714285714285,0,0,0,0,0.2,-0.5714285714285714,1.4285714285714286,1,0.42857142857142855,"C7H10O2S1","O2S1","CHOS","Lignin",6]
[158.0579084,1683832,0,0,0,1120714,4581248,1396911,0,1807803,0,1181529,960640,0,0,4922401,0,2105380,0,157.05062854545454,7,0,10,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,158.0579084,{"$nulls":3},3,0.5714285714285714,1.4285714285714286,0,0,0,0,0,0,0.2,-0.2857142857142857,1.4285714285714286,-1,0.42857142857142855,"C7H10O4","O4","CHO","Lignin",6]
[158.07316459999998,1280253.9999999998,1172632,1386419,1351264,1094416,988166,936757,1465280,1403649,1263210,979359,1345893,1018345,1002079,1023910.0000000001,812211,1153450,982295,157.06586084210525,11,0,10,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,158.07316459999998,{"$nulls":3},7,0.09090909090909091,0.9090909090909091,0,0,0,0,0,0,0.6190476190476191,-0.7272727272727273,0.9090909090909091,6,0.6363636363636364,"C11H10O1","O1","CHO","UnsatHydrocar",7]
[158.0942938,853478,0,762171,795544,0,4520334.000000001,0,1303816,1099657,936562,947048,0,0,885287,4104494,791355,1067698,0,157.08700143749996,8,0,14,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,158.0942938,{"$nulls":3},2,0.375,1.75,0,0,0,0,0,0,0.07692307692307693,-1,1.75,-1,0.25,"C8H14O3","O3","CHO","N-FreeSatCom",4]
[158.1306792,0,0,0,0,0,0,0,0,0,0,0,0,0,0,800100,0,0,0,157.12339925,9,0,18,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,158.1306792,{"$nulls":3},1,0.2222222222222222,2,0,0,0,0,0,0,0,-1.5555555555555556,2,-1,0.1111111111111111,"C9H18O2","O2","CHO","N-FreeSatCom",4]
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[160.037173,0,0,0,0,0,1702928.9999999998,0,0,0,0,0,0,0,0,1559447,0,0,0,159.029949,6,0,8,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,160.037173,{"$nulls":3},3,0.8333333333333334,1.3333333333333333,0,0,0,0,0,0,0.14285714285714285,0.3333333333333333,1.3333333333333333,-2,0.5,"C6H8O5","O5","CHO","Tannins",5]
[160.0524292,2090369.0000000002,1895457,2785722,2270819,2770351,3765399,1853112,2510968.9999999995,2185729.9999999995,2265318,1868289,2547700,2732838,1955030,3651357,1737829,2293924,2302233,159.04516394736842,10,0,8,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,160.0524292,{"$nulls":3},7,0.2,0.8,0,0,0,0,0,0,0.6666666666666666,-0.4,0.8,5,0.7,"C10H8O2","O2","CHO","Lignin",6]
[160.05579989999998,0,0,0,0,0,1128856.0000000002,0,0,0,0,0,0,0,0,864606.9999999999,0,0,0,159.048598,7,0,12,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,160.05579989999998,{"$nulls":3},2,0.2857142857142857,1.7142857142857142,0,0.14285714285714285,0,0,0,0,0,-0.8571428571428571,1.7142857142857142,0,0.2857142857142857,"C7H12O2S1","O2S1","CHOS","N-FreeSatCom",4]
[160.0735584,0,0,0,0,0,3484960,0,1217314,0,0,0,0,0,826078,2048549,0,0,0,159.0662732857143,7,0,12,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,160.0735584,{"$nulls":3},2,0.5714285714285714,1.7142857142857142,0,0,0,0,0,0,0,-0.5714285714285714,1.7142857142857142,-2,0.2857142857142857,"C7H12O4","O4","CHO","Aminosugars",2]
[160.08881459999998,1171727.0000000002,1500143,1430537,1735122,1825214,1158502.0000000002,2085190,1840360,1518353,1878324,1586575,1427586,1700660,1533732,1071595.0000000002,1406323,1590066,1486055,159.08154472222222,11,0,12,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,160.08881459999998,{"$nulls":3},6,0.09090909090909091,1.0909090909090908,0,0,0,0,0,0,0.5238095238095238,-0.9090909090909091,1.0909090909090908,5,0.5454545454545454,"C11H12O1","O1","CHO","UnsatHydrocar",7]
[160.1099438,0,0,0,0,0,937070,0,0,0,0,0,0,0,0,1002420,0,0,0,159.10266066666668,8,0,16,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,160.1099438,{"$nulls":3},1,0.375,2,0,0,0,0,0,0,0,-1.25,2,-2,0.125,"C8H16O3","O3","CHO","N-FreeSatCom",4]
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[161.08406359999998,837050,940668,910453,784301,885718,964472,1126608,1109630,1131162,1107771,0,0,1168827,1132584,882257,797204,922265,1103858,160.07685,10,0,11,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,161.08406359999998,{"$nulls":3},6,0.1,1.1,0.1,0,0,0,0,0,0.5294117647058824,-0.6,1.1,5,0.6,"C10H11O1N1","O1N1","CHON","Lignin",6]
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[162.0316938,2357397,2992953,4127954,2835319,2744799,3636026,1884619,3343619,2831125,1862324,1544275,2999413,2382387.0000000005,2185054,4467496,1381927,2183344,2697454,161.02441118750002,9,0,6,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,162.0316938,{"$nulls":3},7,0.3333333333333333,0.6666666666666666,0,0,0,0,0,0,0.7333333333333333,0,0.6666666666666666,4,0.7777777777777778,"C9H6O3","O3","CHO","ConAroStru",8]
[162.03506449999998,0,0,0,0,0,1175740,0,0,0,0,0,0,0,0,903305,0,0,0,161.027785,6,0,10,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,162.03506449999998,{"$nulls":3},2,0.5,1.6666666666666667,0,0.16666666666666666,0,0,0,0,0,-0.3333333333333333,1.6666666666666667,-1,0.3333333333333333,"C6H10O3S1","O3S1","CHOS","N-FreeSatCom",4]
[162.04292719999998,0,0,0,0,0,1272383,0,0,0,0,0,0,0,0,1452716,0,0,0,161.03560733333333,8,0,6,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,162.04292719999998,{"$nulls":3},7,0.25,0.75,0.25,0,0,0,0,0,0.8,0.5,0.75,5,0.875,"C8H6O2N2","O2N2","CHON","Lignin",6]
[162.052823,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1196655.9999999998,0,0,0,161.04551800000002,6,0,10,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,162.052823,{"$nulls":3},2,0.8333333333333334,1.6666666666666667,0,0,0,0,0,0,0,0,1.6666666666666667,-3,0.3333333333333333,"C6H10O5","O5","CHO","Carbohydrates",1]
[162.0680792,3048995,2633928,3642977,4050438,3710702,5247433,2914650,4791058.999999999,4829220,3618242,2880194,3392771,3474881,3228396,5303606,2446325,4630079,3779580,161.0608005,10,0,10,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,162.0680792,{"$nulls":3},6,0.2,1,0,0,0,0,0,0,0.5555555555555556,-0.6,1,4,0.6,"C10H10O2","O2","CHO","Lignin",6]
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[163.0269428,0,0,0,960281,894333.9999999999,1976788,880477,1363104,1549222,883907,0,0,0,0,2555830,0,1114110,1326656,162.01968984615385,8,0,5,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,163.0269428,{"$nulls":3},7,0.375,0.625,0.125,0,0,0,0,0,0.8181818181818182,0.5,0.625,4,0.875,"C8H5O3N1","O3N1","CHON","ConAroStru",8]
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[163.09971359999997,999236,864619,0,904183.9999999999,0,0,1505402,1524286,936516,879392,1085745.9999999998,950233,989535,1137799,1392595,770988,998107,902430,162.09248977777779,10,0,13,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,163.09971359999997,{"$nulls":3},5,0.1,1.3,0.1,0,0,0,0,0,0.4117647058823529,-0.8,1.3,4,0.5,"C10H13O1N1","O1N1","CHON","Lignin",6]
[164.0109584,916790,0,1627001,1585209,1157660,1406572,0,1025211,845429.9999999999,975313,809139,1246980,1253198,1038836.9999999999,1661378.9999999998,0,1070283,956626.0000000001,163.0036848888889,8,0,4,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,164.0109584,{"$nulls":3},7,0.5,0.5,0,0,0,0,0,0,0.8333333333333334,0.5,0.5,3,0.875,"C8H4O4","O4","CHO","ConAroStru",8]
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[164.0473438,3197893,3346542,4739080,4046153,4277548,8725242.999999998,3043323,5055818,4001477,3551712,3052931,4097554,3595869,3955971,10655805,0,4264538,3026209,163.04006481249996,9,0,8,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,164.0473438,{"$nulls":3},6,0.3333333333333333,0.8888888888888888,0,0,0,0,0,0,0.6,-0.2222222222222222,0.8888888888888888,3,0.6666666666666666,"C9H8O3","O3","CHO","Lignin",6]
[164.0585772,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1154263.0000000002,0,0,0,163.05127149999998,8,0,8,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,164.0585772,{"$nulls":3},6,0.25,1,0.25,0,0,0,0,0,0.6,0.25,1,4,0.75,"C8H8O2N2","O2N2","CHON","Lignin",6]
[164.0837292,4331220,3437437,3138967,4385112,3818555,5406475,4244106,4812634,5620564,4917998,3533074,3862817,4971884,4665618,6686363,3329427,4715881,5467696,163.07643377777782,10,0,12,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,164.0837292,{"$nulls":3},5,0.2,1.2,0,0,0,0,0,0,0.4444444444444444,-0.8,1.2,3,0.5,"C10H12O2","O2","CHO","Lignin",6]
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[165.1153636,0,918117,0,0,0,0,0,0,0,0,0,0,0,812851,878566,0,0,0,164.108134,10,0,15,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,165.1153636,{"$nulls":3},4,0.1,1.5,0.1,0,0,0,0,0,0.29411764705882354,-1,1.5,3,0.4,"C10H15O1N1","O1N1","CHON","Lignin",6]
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[166.0266084,6832625,6447262,7029305,12165978,11442389,12471450,7516583,9087492,9025906.000000002,5478153,5356365.999999999,5725486,6034308,5721126,10858648.999999998,7488720,5948290,5522772,165.019341,8,0,6,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,166.0266084,{"$nulls":3},6,0.5,0.75,0,0,0,0,0,0,0.6666666666666666,0.25,0.75,2,0.75,"C8H6O4","O4","CHO","Lignin",6]
[166.04523529999997,0,0,0,0,0,853921,0,0,0,0,0,0,0,0,942276,0,0,0,165.038055,9,0,10,0,1,0,0,0,1,0,0,0,0,0,0,0,0,null,166.04523529999997,{"$nulls":3},5,0.1111111111111111,1.1111111111111112,0,0.1111111111111111,0,0,0,0,0.4666666666666667,-0.6666666666666666,1.1111111111111112,4,0.5555555555555556,"C9H10O1S1","O1S1","CHOS","Lignin",6]
[166.0629938,4387583.999999999,4242605,5261383.999999999,4730917,4396164,9571912.000000002,4524470,5622172,6744449,4930584,3872606,5246780,5270419,4446901,13309111,3345708,4479120,5540707,165.05572018749996,9,0,10,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,166.0629938,{"$nulls":3},5,0.3333333333333333,1.1111111111111112,0,0,0,0,0,0,0.4666666666666667,-0.4444444444444444,1.1111111111111112,2,0.5555555555555556,"C9H10O3","O3","CHO","Lignin",6]
[166.0742272,0,0,0,0,0,1306829.0000000002,0,0,0,0,0,0,0,0,1396496,0,0,0,165.0669332222222,8,0,10,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,166.0742272,{"$nulls":3},5,0.25,1.25,0.25,0,0,0,0,0,0.4,0,1.25,3,0.625,"C8H10O2N2","O2N2","CHON","Lignin",6]
[166.09937920000002,4711439,3582396,3666519,3994805,3368851,6138264,6346025,4788140,5375888,4443175,3881837,3682251,4850337.999999999,3853891,6059931,3781051,5003935,4580466.999999999,165.09210823529415,10,0,14,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,166.09937920000002,{"$nulls":3},4,0.2,1.4,0,0,0,0,0,0,0.3333333333333333,-1,1.4,2,0.4,"C10H14O2","O2","CHO","Lignin",6]
[166.1357646,0,0,0,0,0,929895,907412,1066939,0,0,0,0,0,0,823594,0,0,818177,165.1284852857143,11,0,18,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,166.1357646,{"$nulls":3},3,0.09090909090909091,1.6363636363636365,0,0,0,0,0,0,0.23809523809523808,-1.4545454545454546,1.6363636363636365,2,0.2727272727272727,"C11H18O1","O1","CHO","N-FreeSatCom",4]
[167.0040989,0,0,0,0,0,951782,0,0,0,0,0,0,0,0,946257.0000000001,0,0,0,165.996831,7,0,5,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,167.0040989,{"$nulls":3},6,0.2857142857142857,0.7142857142857143,0.14285714285714285,0.14285714285714285,0,0,0,0,0.75,0.5714285714285714,0.7142857142857143,4,0.8571428571428571,"C7H5O2N1S1","O2N1S1","CHONS","Lignin",6]
[167.0218574,0,0,0,0,0,1752542,0,0,0,0,0,0,0,0,1239640.9999999998,0,0,0,166.014595,7,0,5,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,167.0218574,{"$nulls":3},6,0.5714285714285714,0.7142857142857143,0.14285714285714285,0,0,0,0,0,0.75,0.8571428571428571,0.7142857142857143,2,0.8571428571428571,"C7H5O4N1","O4N1","CHON","Lignin",6]
[167.0582428,0,0,0,0,0,3586797,0,0,2340125,0,0,0,0,0,4597544,0,0,2507907,166.0509764,8,0,9,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,167.0582428,{"$nulls":3},5,0.375,1.125,0.125,0,0,0,0,0,0.45454545454545453,0,1.125,2,0.625,"C8H9O3N1","O3N1","CHON","Lignin",6]
[167.0946282,0,842200,0,819297,1068349,1526141,1341217.0000000002,1052242,831052,989378,802009,1012447,1271225.9999999998,1289370,1585719,0,789321,1015314,166.087364,9,0,13,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,167.0946282,{"$nulls":3},4,0.2222222222222222,1.4444444444444444,0.1111111111111111,0,0,0,0,0,0.2857142857142857,-0.6666666666666666,1.4444444444444444,2,0.4444444444444444,"C9H13O2N1","O2N1","CHON","Lignin",6]
[168.005873,0,0,825331,0,0,1232832,0,0,0,0,0,0,0,0,1351347,0,0,0,166.9985924285714,7,0,4,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,168.005873,{"$nulls":3},6,0.7142857142857143,0.5714285714285714,0,0,0,0,0,0,0.7777777777777778,0.8571428571428571,0.5714285714285714,1,0.8571428571428571,"C7H4O5","O5","CHO","Tannins",5]
[168.0244999,0,0,0,0,0,2285576,0,0,0,0,0,0,0,0,2510523,0,0,0,167.01720683333332,8,0,8,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,168.0244999,{"$nulls":3},5,0.25,1,0,0.125,0,0,0,0,0.5,-0.25,1,3,0.625,"C8H8O2S1","O2S1","CHOS","Lignin",6]
[168.0422584,3469363,2634082.9999999995,4686466,3698425,3572436,10176202.000000002,3132906,4131302,3989559,3011915,2810161,3476321,3033537,3164256,10601449,2311500.9999999995,2822465,4167585,167.0349797142857,8,0,8,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,168.0422584,{"$nulls":3},5,0.5,1,0,0,0,0,0,0,0.5,0,1,1,0.625,"C8H8O4","O4","CHO","Lignin",6]
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[168.0575146,0,0,0,0,0,0,0,843756,0,0,0,0,0,0,0,0,0,0,167.05030075000002,12,0,8,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,168.0575146,{"$nulls":3},9,0.08333333333333333,0.6666666666666666,0,0,0,0,0,0,0.7391304347826086,-0.5,0.6666666666666666,8,0.75,"C12H8O1","O1","CHO","ConAroStru",8]
[168.0608853,0,906795,0,0,0,0,0,780718,0,0,0,0,0,0,0,0,0,0,167.053631,9,0,12,0,1,0,0,0,1,0,0,0,0,0,0,0,0,null,168.0608853,{"$nulls":3},4,0.1111111111111111,1.3333333333333333,0,0.1111111111111111,0,0,0,0,0.3333333333333333,-0.8888888888888888,1.3333333333333333,3,0.4444444444444444,"C9H12O1S1","O1S1","CHOS","Lignin",6]
[168.0786438,4280386,3291506,3494673,5161737,3879139,9800682,4435706,5250805.999999999,7819823,5111129.999999999,3820737,3392624,4962769,4373615,10783495,3832795,5602257,6524080,167.07136505263156,9,0,12,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,168.0786438,{"$nulls":3},4,0.3333333333333333,1.3333333333333333,0,0,0,0,0,0,0.3333333333333333,-0.6666666666666666,1.3333333333333333,1,0.4444444444444444,"C9H12O3","O3","CHO","Lignin",6]
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[169.0197489,0,0,0,0,0,1444912,0,0,0,0,0,0,0,0,1763036,0,0,0,168.01248966666665,7,0,7,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,169.0197489,{"$nulls":3},5,0.2857142857142857,1,0.14285714285714285,0.14285714285714285,0,0,0,0,0.5,0.2857142857142857,1,3,0.7142857142857143,"C7H7O2N1S1","O2N1S1","CHONS","Lignin",6]
[169.0375074,1002129,996546,939491,0,0,2926136,0,1159887,2021974,0,1018847,1454200,0,0,3384676,0,0,1692101,168.03020800000002,7,0,7,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,169.0375074,{"$nulls":3},5,0.5714285714285714,1,0.14285714285714285,0,0,0,0,0,0.5,0.5714285714285714,1,1,0.7142857142857143,"C7H7O4N1","O4N1","CHON","Lignin",6]
[169.07389279999998,0,0,0,0,0,2478663,0,0,0,0,0,0,0,1269513,2829171,0,0,0,168.06662899999998,8,0,11,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,169.07389279999998,{"$nulls":3},4,0.375,1.375,0.125,0,0,0,0,0,0.2727272727272727,-0.25,1.375,1,0.5,"C8H11O3N1","O3N1","CHON","Lignin",6]
[169.11027819999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,815234,0,0,0,168.10301,9,0,15,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,169.11027819999998,{"$nulls":3},3,0.2222222222222222,1.6666666666666667,0.1111111111111111,0,0,0,0,0,0.14285714285714285,-0.8888888888888888,1.6666666666666667,1,0.3333333333333333,"C9H15O2N1","O2N1","CHON","N-ConSatCom",3]
[170.0037645,0,0,0,0,0,1958804.9999999998,0,0,0,0,0,0,0,0,3042171,0,0,0,168.99646833333335,7,0,6,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,170.0037645,{"$nulls":3},5,0.42857142857142855,0.8571428571428571,0,0.14285714285714285,0,0,0,0,0.5555555555555556,0.2857142857142857,0.8571428571428571,2,0.7142857142857143,"C7H6O3S1","O3S1","CHOS","Lignin",6]
[170.021523,1591147,1545181,2426816,1962322.0000000002,1479976,7053532,1350563,1768628,1274034,1367301,1467145,1474317,1567733,1493009,6912770,998001,1224569,1517799,169.01424355555557,7,0,6,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,170.021523,{"$nulls":3},5,0.7142857142857143,0.8571428571428571,0,0,0,0,0,0,0.5555555555555556,0.5714285714285714,0.8571428571428571,0,0.7142857142857143,"C7H6O5","O5","CHO","Tannins",5]
[170.03275639999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,806343,0,0,0,169.025454,6,0,6,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,170.03275639999998,{"$nulls":3},5,0.6666666666666666,1,0.3333333333333333,0,0,0,0,0,0.5,1.3333333333333333,1,1,0.8333333333333334,"C6H6O4N2","O4N2","CHON","Lignin",6]
[170.0401499,0,0,0,0,0,2375907.9999999995,0,0,0,0,0,0,0,0,2090506,0,0,0,169.032874,8,0,10,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,170.0401499,{"$nulls":3},4,0.25,1.25,0,0.125,0,0,0,0,0.3333333333333333,-0.5,1.25,2,0.5,"C8H10O2S1","O2S1","CHOS","Lignin",6]
[170.0579084,2716282,2418476,2385104,2764130,2292216,6673644,2586034.0000000005,3315268,3444737,3183252,2623257,2300188,2673413,2715424,7607116,2237056,3275528,3287542,169.05063344444443,8,0,10,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,170.0579084,{"$nulls":3},4,0.5,1.25,0,0,0,0,0,0,0.3333333333333333,-0.25,1.25,0,0.5,"C8H10O4","O4","CHO","Lignin",6]
[170.07316459999998,0,0,0,0,0,821810,0,1177546,0,0,0,1226658,0,975014,0,0,1038862,881149,169.06588013333334,12,0,10,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,170.07316459999998,{"$nulls":3},8,0.08333333333333333,0.8333333333333334,0,0,0,0,0,0,0.6521739130434783,-0.6666666666666666,0.8333333333333334,7,0.6666666666666666,"C12H10O1","O1","CHO","UnsatHydrocar",7]
[170.0942938,2558345,2142011,2062815,2295794,1863527,9664100,2811969,3627090.9999999995,3561489,2776227,1902249,2047594,2217236,2699247,11517738,1957455,4477464,3987461.9999999995,169.08702710526316,9,0,14,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,170.0942938,{"$nulls":3},3,0.3333333333333333,1.5555555555555556,0,0,0,0,0,0,0.2,-0.8888888888888888,1.5555555555555556,0,0.3333333333333333,"C9H14O3","O3","CHO","N-FreeSatCom",4]
[170.1306792,0,0,0,0,0,1462923,0,1377251,0,0,0,0,0,0,2285488,0,1447847.0000000002,0,169.12338458333332,10,0,18,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,170.1306792,{"$nulls":3},2,0.2,1.8,0,0,0,0,0,0,0.1111111111111111,-1.4,1.8,0,0.2,"C10H18O2","O2","CHO","N-FreeSatCom",4]
[170.9990135,0,0,0,0,0,0,0,0,0,0,0,0,0,0,856864,0,0,0,169.991808,6,0,5,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,170.9990135,{"$nulls":3},5,0.5,0.8333333333333334,0.16666666666666666,0.16666666666666666,0,0,0,0,0.6,1,0.8333333333333334,2,0.8333333333333334,"C6H5O3N1S1","O3N1S1","CHONS","Lignin",6]
[171.0353989,0,0,0,0,0,1353870,0,0,0,0,0,0,0,0,1548975,0,0,0,170.02808299999998,7,0,9,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,171.0353989,{"$nulls":3},4,0.2857142857142857,1.2857142857142858,0.14285714285714285,0.14285714285714285,0,0,0,0,0.25,0,1.2857142857142858,2,0.5714285714285714,"C7H9O2N1S1","O2N1S1","CHONS","Lignin",6]
[171.0531574,0,0,0,1173393,0,1504278,0,0,917347,898741,0,929429,1197794,1085948,1736183,0,0,0,170.04587199999997,7,0,9,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,171.0531574,{"$nulls":3},4,0.5714285714285714,1.2857142857142858,0.14285714285714285,0,0,0,0,0,0.25,0.2857142857142857,1.2857142857142858,0,0.5714285714285714,"C7H9O4N1","O4N1","CHON","Lignin",6]
[171.06841359999999,0,0,0,0,0,1449500,0,894324.0000000001,1089321,0,0,0,0,0,947644.9999999999,0,0,796644,170.06117033333334,11,0,9,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,171.06841359999999,{"$nulls":3},8,0.09090909090909091,0.8181818181818182,0.09090909090909091,0,0,0,0,0,0.6842105263157895,-0.36363636363636365,0.8181818181818182,7,0.7272727272727273,"C11H9O1N1","O1N1","CHON","UnsatHydrocar",7]
[171.0895428,0,0,0,0,0,1640100.9999999998,0,0,0,0,0,0,0,0,1542086,0,0,0,170.08233475,8,0,13,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,171.0895428,{"$nulls":3},3,0.375,1.625,0.125,0,0,0,0,0,0.09090909090909091,-0.5,1.625,0,0.375,"C8H13O3N1","O3N1","CHON","N-ConSatCom",3]
[171.98302909999998,0,0,0,0,0,994084,0,0,0,0,0,0,0,0,819905,0,0,0,170.975747,6,0,4,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,171.98302909999998,{"$nulls":3},5,0.6666666666666666,0.6666666666666666,0,0.16666666666666666,0,0,0,0,0.6666666666666666,1,0.6666666666666666,1,0.8333333333333334,"C6H4O4S1","O4S1","CHOS","ConAroStru",8]
[172.01941449999998,880940,0,0,0,3061381,2246708,0,0,0,0,0,0,0,0,1859665,0,0,0,171.01212625000002,7,0,8,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,172.01941449999998,{"$nulls":3},4,0.42857142857142855,1.1428571428571428,0,0.14285714285714285,0,0,0,0,0.3333333333333333,0,1.1428571428571428,1,0.5714285714285714,"C7H8O3S1","O3S1","CHOS","Lignin",6]
[172.037173,1643124,1311334,0,1902652,1908108.9999999998,2516539,1302892.9999999998,0,1731904,1651025,1361139,0,0,0,2877784,1161126,1854148,1725249,171.02989900000006,7,0,8,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,172.037173,{"$nulls":3},4,0.7142857142857143,1.1428571428571428,0,0,0,0,0,0,0.3333333333333333,0.2857142857142857,1.1428571428571428,-1,0.5714285714285714,"C7H8O5","O5","CHO","Tannins",5]
[172.0524292,1339834,1304045,1453847,1747650,1051072.0000000002,0,898867,1226521.0000000002,1463238,1478232,1199097,1823825,1439809,1459674,1616991,860076,1260426,1517064,171.04514639999996,11,0,8,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,172.0524292,{"$nulls":3},8,0.18181818181818182,0.7272727272727273,0,0,0,0,0,0,0.7,-0.36363636363636365,0.7272727272727273,6,0.7272727272727273,"C11H8O2","O2","CHO","Lignin",6]
[172.05579989999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1208288,0,0,0,171.0485374,8,0,12,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,172.05579989999998,{"$nulls":3},3,0.25,1.5,0,0.125,0,0,0,0,0.16666666666666666,-0.75,1.5,1,0.375,"C8H12O2S1","O2S1","CHOS","Lignin",6]
[172.0735584,1946819,1407797,1450400,1399051,2138653,10224203,1930108,4020642,2739023,2605537.0000000005,1658883,1499098,2079818,2802019,13084219,1979445,5349715,2571985,171.06628288235294,8,0,12,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,172.0735584,{"$nulls":3},3,0.5,1.5,0,0,0,0,0,0,0.16666666666666666,-0.5,1.5,-1,0.375,"C8H12O4","O4","CHO","Lignin",6]
[172.08881459999998,0,0,1558374,1664210,0,0,0,0,0,0,0,1628192,1798736,0,0,0,0,1734680,171.08155385714286,12,0,12,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,172.08881459999998,{"$nulls":3},7,0.08333333333333333,1,0,0,0,0,0,0,0.5652173913043478,-0.8333333333333334,1,6,0.5833333333333334,"C12H12O1","O1","CHO","UnsatHydrocar",7]
[172.1099438,1015506,945029.0000000001,995631,0,1043244,4051418.9999999995,1023883,2060978,1589214,1451376,0,894185,0,1159154,5214071,892675,1746786,873825,171.10267494444443,9,0,16,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,172.1099438,{"$nulls":3},2,0.3333333333333333,1.7777777777777777,0,0,0,0,0,0,0.06666666666666667,-1.1111111111111112,1.7777777777777777,-1,0.2222222222222222,"C9H16O3","O3","CHO","N-FreeSatCom",4]
[172.1463292,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,938865,0,171.13899937500003,10,0,20,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,172.1463292,{"$nulls":3},1,0.2,2,0,0,0,0,0,0,0,-1.6,2,-1,0.1,"C10H20O2","O2","CHO","N-FreeSatCom",4]
[173.032422,0,0,0,0,0,0,0,0,0,0,0,0,0,0,931648,0,0,0,172.02516300000002,6,0,7,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,173.032422,{"$nulls":3},4,0.8333333333333334,1.1666666666666667,0.16666666666666666,0,0,0,0,0,0.2,1,1.1666666666666667,-1,0.6666666666666666,"C6H7O5N1","O5N1","CHON","Tannins",5]
[173.0476782,0,0,0,0,0,3553772,0,913475,0,893049,0,0,886366,0,3352838,0,984875,1143793,172.04041278571427,10,0,7,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,173.0476782,{"$nulls":3},8,0.2,0.7,0.1,0,0,0,0,0,0.75,0,0.7,6,0.8,"C10H7O2N1","O2N1","CHON","Lignin",6]
[173.05104889999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1280392,0,0,0,172.043814,7,0,11,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,173.05104889999998,{"$nulls":3},3,0.2857142857142857,1.5714285714285714,0.14285714285714285,0.14285714285714285,0,0,0,0,0,-0.2857142857142857,1.5714285714285714,1,0.42857142857142855,"C7H11O2N1S1","O2N1S1","CHONS","N-ConSatCom",3]
[173.0688074,0,0,0,0,0,816021,0,0,0,0,0,0,0,0,1004879,0,0,0,172.0614695,7,0,11,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,173.0688074,{"$nulls":3},3,0.5714285714285714,1.5714285714285714,0.14285714285714285,0,0,0,0,0,0,0,1.5714285714285714,-1,0.42857142857142855,"C7H11O4N1","O4N1","CHON","Aminosugars",2]
[173.08406359999998,1034856,1047066,1466441,1180929,870608,1220860,974690,1435410,962359,876361,0,1218555,1085806,0,1053462,0,1636730,1048705,172.07679007692306,11,0,11,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,173.08406359999998,{"$nulls":3},7,0.09090909090909091,1,0.09090909090909091,0,0,0,0,0,0.5789473684210527,-0.5454545454545454,1,6,0.6363636363636364,"C11H11O1N1","O1N1","CHON","UnsatHydrocar",7]
[173.9809206,0,0,0,0,0,800028,0,0,0,0,0,0,0,0,844436,0,0,0,172.97356100000002,6,0,6,0,2,0,0,0,2,0,0,0,0,0,0,0,0,null,173.9809206,{"$nulls":3},4,0.3333333333333333,1,0,0.3333333333333333,0,0,0,0,0.3333333333333333,0.3333333333333333,1,2,0.6666666666666666,"C6H6O2S2","O2S2","CHOS","Lignin",6]
[173.99867909999998,0,0,0,0,0,873794.9999999999,0,0,0,0,0,0,0,0,0,0,0,0,172.991434,6,0,6,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,173.99867909999998,{"$nulls":3},4,0.6666666666666666,1,0,0.16666666666666666,0,0,0,0,0.3333333333333333,0.6666666666666666,1,0,0.6666666666666666,"C6H6O4S1","O4S1","CHOS","Lignin",6]
[174.0164376,0,0,0,0,0,1407755,0,0,893566,0,0,0,0,863944,1522339,0,0,0,173.00915814285716,6,0,6,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,174.0164376,{"$nulls":3},4,1,1,0,0,0,0,0,0,0.3333333333333333,1,1,-2,0.6666666666666666,"C6H6O6","O6","CHO","Tannins",5]
[174.0316938,0,1049380,1850071,0,0,1657746,0,2320615,1855108.0000000002,0,1302610,2138625,0,0,2522538,0,1395079,1382678,173.02440083333337,10,0,6,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,174.0316938,{"$nulls":3},8,0.3,0.6,0,0,0,0,0,0,0.7647058823529411,0,0.6,5,0.8,"C10H6O3","O3","CHO","ConAroStru",8]
[174.03506449999998,0,0,0,0,0,3103123,0,0,0,0,0,0,0,0,3296171,0,0,0,173.02779049999998,7,0,10,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,174.03506449999998,{"$nulls":3},3,0.42857142857142855,1.4285714285714286,0,0.14285714285714285,0,0,0,0,0.1111111111111111,-0.2857142857142857,1.4285714285714286,0,0.42857142857142855,"C7H10O3S1","O3S1","CHOS","Lignin",6]
[174.052823,0,0,0,0,0,2389659,0,0,1961997,1397663,0,0,0,0,2812595,0,0,0,173.04554050000002,7,0,10,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,174.052823,{"$nulls":3},3,0.7142857142857143,1.4285714285714286,0,0,0,0,0,0,0.1111111111111111,0,1.4285714285714286,-2,0.42857142857142855,"C7H10O5","O5","CHO","Tannins",5]
[174.0680792,3716097,3718067,3874278,4210730,4108791,4096929,3519164,5798167,4400788,3600166,3531233,4193296,4642694,3810589,4532665.000000001,2479967,4542614,4324262.000000001,173.06081220000002,11,0,10,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,174.0680792,{"$nulls":3},7,0.18181818181818182,0.9090909090909091,0,0,0,0,0,0,0.6,-0.5454545454545454,0.9090909090909091,5,0.6363636363636364,"C11H10O2","O2","CHO","Lignin",6]
[174.07144989999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1364539,0,0,0,173.064198,8,0,14,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,174.07144989999998,{"$nulls":3},2,0.25,1.75,0,0.125,0,0,0,0,0,-1,1.75,0,0.25,"C8H14O2S1","O2S1","CHOS","N-FreeSatCom",4]
[174.0892084,0,800508,0,0,0,10091649,0,2387839,1257500,787630,806954,0,0,1063589.9999999998,10174511.999999998,0,1719647,831439,173.08193193749997,8,0,14,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,174.0892084,{"$nulls":3},2,0.5,1.75,0,0,0,0,0,0,0,-0.75,1.75,-2,0.25,"C8H14O4","O4","CHO","N-FreeSatCom",4]
[174.1044646,2446864,2223043,1764341,2129977.0000000005,2019718,0,2749131,2586118,1956771,2509621,1994865,2333343,2133013,2024876,1298760.9999999998,2403694,2308389,2054069,173.09718063157896,12,0,14,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,174.1044646,{"$nulls":3},6,0.08333333333333333,1.1666666666666667,0,0,0,0,0,0,0.4782608695652174,-1,1.1666666666666667,5,0.5,"C12H14O1","O1","CHO","UnsatHydrocar",7]
[174.1255938,0,0,0,0,0,807706,0,0,0,0,0,0,0,0,0,0,0,0,173.11837649999998,9,0,18,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,174.1255938,{"$nulls":3},1,0.3333333333333333,2,0,0,0,0,0,0,0,-1.3333333333333333,2,-2,0.1111111111111111,"C9H18O3","O3","CHO","N-FreeSatCom",4]
[175.0269428,0,0,0,0,0,0,0,0,780421,0,0,0,0,0,933842,0,0,0,174.01962666666668,9,0,5,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,175.0269428,{"$nulls":3},8,0.3333333333333333,0.5555555555555556,0.1111111111111111,0,0,0,0,0,0.8461538461538461,0.4444444444444444,0.5555555555555556,5,0.8888888888888888,"C9H5O3N1","O3N1","CHON","ConAroStru",8]
[175.03031349999998,0,0,0,0,0,950908,0,0,0,0,0,0,0,0,892179.9999999999,0,0,0,174.02308266666668,6,0,9,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,175.03031349999998,{"$nulls":3},3,0.5,1.5,0.16666666666666666,0.16666666666666666,0,0,0,0,0,0.3333333333333333,1.5,0,0.5,"C6H9O3N1S1","O3N1S1","CHONS","Lignin",6]
[175.0633282,1331230.0000000002,0,1853191,1905110.0000000002,0,3763018,1169210,2155421,2182324,1746887,1519118,0,1912098,1792505,3417442.0000000005,1345137,2549814,2647119,174.0560539411765,10,0,9,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,175.0633282,{"$nulls":3},7,0.2,0.9,0.1,0,0,0,0,0,0.625,-0.2,0.9,5,0.7,"C10H9O2N1","O2N1","CHON","Lignin",6]
[175.09971359999997,0,1210783,0,913893.9999999999,1524656,876634,1161641,1125869,1280579.0000000002,0,1184926,1478841,1102193,1318088.0000000002,977969,871040,1653317,1020639,174.09244747058824,11,0,13,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,175.09971359999997,{"$nulls":3},6,0.09090909090909091,1.1818181818181819,0.09090909090909091,0,0,0,0,0,0.47368421052631576,-0.7272727272727273,1.1818181818181819,5,0.5454545454545454,"C11H13O1N1","O1N1","CHON","UnsatHydrocar",7]
[176.0143291,0,0,0,0,0,2769120,0,0,0,0,0,0,0,0,2497656,0,0,0,175.007062,6,0,8,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,176.0143291,{"$nulls":3},3,0.6666666666666666,1.3333333333333333,0,0.16666666666666666,0,0,0,0,0,0.3333333333333333,1.3333333333333333,-1,0.5,"C6H8O4S1","O4S1","CHOS","Lignin",6]
[176.0320876,0,0,0,0,0,0,0,864375.9999999999,0,0,0,850360,0,0,944127,0,0,0,175.02478842857144,6,0,8,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,176.0320876,{"$nulls":3},3,1,1.3333333333333333,0,0,0,0,0,0,0,0.6666666666666666,1.3333333333333333,-3,0.5,"C6H8O6","O6","CHO","Tannins",5]
[176.0473438,4673076,4672485.000000001,7094946,6127740,5832517.000000001,10977862,3687409,6734654,5656015,3772002,3902005,6623385,5308344,5015119,11477048,2552062,5770193,5197299.999999999,175.04006407142856,10,0,8,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,176.0473438,{"$nulls":3},7,0.3,0.8,0,0,0,0,0,0,0.6470588235294118,-0.2,0.8,4,0.7,"C10H8O3","O3","CHO","Lignin",6]
[176.0507145,0,0,0,0,0,1322095,0,0,0,0,0,0,0,0,1756039,0,0,0,175.043448,7,0,12,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,176.0507145,{"$nulls":3},2,0.42857142857142855,1.7142857142857142,0,0.14285714285714285,0,0,0,0,0,-0.5714285714285714,1.7142857142857142,-1,0.2857142857142857,"C7H12O3S1","O3S1","CHOS","N-FreeSatCom",4]
[176.0585772,0,0,0,999808.9999999999,0,0,0,873795,0,0,0,0,0,796051,1846026,0,876501,1232824,175.05132190909092,9,0,8,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,176.0585772,{"$nulls":3},7,0.2222222222222222,0.8888888888888888,0.2222222222222222,0,0,0,0,0,0.6666666666666666,0.2222222222222222,0.8888888888888888,5,0.7777777777777778,"C9H8O2N2","O2N2","CHON","Lignin",6]
[176.068473,0,0,0,0,0,906999,0,0,0,0,0,0,0,0,835855.0000000001,0,0,0,175.06120933333332,7,0,12,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,176.068473,{"$nulls":3},2,0.7142857142857143,1.7142857142857142,0,0,0,0,0,0,0,-0.2857142857142857,1.7142857142857142,-3,0.2857142857142857,"C7H12O5","O5","CHO","Carbohydrates",1]
[176.0837292,4814147,4535284,4523185,5245580,4326740,4897277,6303774,6638210,5709790,5146226,4739908.000000001,5649079,5627847,5903832,5340949,4127885,6114272,5586947,175.0764494,11,0,12,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,176.0837292,{"$nulls":3},6,0.18181818181818182,1.0909090909090908,0,0,0,0,0,0,0.5,-0.7272727272727273,1.0909090909090908,4,0.5454545454545454,"C11H12O2","O2","CHO","Lignin",6]
[176.1048584,0,0,0,0,0,837126,0,0,0,0,0,0,0,0,827998,0,0,924428,175.09758566666665,8,0,16,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,176.1048584,{"$nulls":3},1,0.5,2,0,0,0,0,0,0,0,-1,2,-3,0.125,"C8H16O4","O4","CHO","N-FreeSatCom",4]
[176.1201146,1692882,2446850.9999999995,1434048,2071707,1739876,1996557,2461455,2167005,2192877,2291329,2668115.9999999995,2131293,2440534,2629741,2047013,1403099,2231343,2801683,175.1128381578947,12,0,16,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,176.1201146,{"$nulls":3},5,0.08333333333333333,1.3333333333333333,0,0,0,0,0,0,0.391304347826087,-1.1666666666666667,1.3333333333333333,4,0.4166666666666667,"C12H16O1","O1","CHO","UnsatHydrocar",7]
[177.0425928,1294540.9999999998,1508477,1618880,1675941,1398379,4169876,1509644,2489314,2959981,1442433,1263902.0000000002,1739863,1761745,1804008,4192430,803533,1724910,2779804,176.03531188888883,9,0,7,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,177.0425928,{"$nulls":3},7,0.3333333333333333,0.7777777777777778,0.1111111111111111,0,0,0,0,0,0.6923076923076923,0.2222222222222222,0.7777777777777778,4,0.7777777777777778,"C9H7O3N1","O3N1","CHON","Lignin",6]
[177.04596349999997,0,0,0,0,0,1200278,0,0,0,0,0,0,0,0,0,0,0,0,176.038685,6,0,11,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,177.04596349999997,{"$nulls":3},2,0.5,1.8333333333333333,0.16666666666666666,0.16666666666666666,0,0,0,0,0,0,1.8333333333333333,-1,0.3333333333333333,"C6H11O3N1S1","O3N1S1","CHONS","N-ConSatCom",3]
[177.0789782,1937884,2013836,1799887,2870836,2104057.9999999995,3032484,1859739,2098033,2882684,2270993,1904878,2361062,2366432,1982582,3065790,1695132,2276734,2749611,176.0716929444444,10,0,11,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,177.0789782,{"$nulls":3},6,0.2,1.1,0.1,0,0,0,0,0,0.5,-0.4,1.1,4,0.6,"C10H11O2N1","O2N1","CHON","Lignin",6]
[177.1153636,842347,910490.9999999999,0,0,0,0,1148202,1125760,860875,0,853853,1096820,793646,0,0,1018922,1116173,905531,176.108110375,11,0,15,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,177.1153636,{"$nulls":3},5,0.09090909090909091,1.3636363636363635,0.09090909090909091,0,0,0,0,0,0.3684210526315789,-0.9090909090909091,1.3636363636363635,4,0.45454545454545453,"C11H15O1N1","O1N1","CHON","UnsatHydrocar",7]
[178.00884989999997,0,0,0,0,0,923181,0,0,0,0,0,0,0,0,1100618,0,823807,0,177.00155575000002,9,0,6,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,178.00884989999997,{"$nulls":3},7,0.2222222222222222,0.6666666666666666,0,0.1111111111111111,0,0,0,0,0.7142857142857143,0,0.6666666666666666,5,0.7777777777777778,"C9H6O2S1","O2S1","CHOS","ConAroStru",8]
[178.0266084,3289440,3588622,6022103,4062406,3870090,7177780,3089183,5664382,4444932,3242906,2819456,4171625,3333603,3225594,9817549,2144918,3700230,3793983.0000000005,177.01932470588235,9,0,6,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,178.0266084,{"$nulls":3},7,0.4444444444444444,0.6666666666666666,0,0,0,0,0,0,0.7142857142857143,0.2222222222222222,0.6666666666666666,3,0.7777777777777778,"C9H6O4","O4","CHO","ConAroStru",8]
[178.0299791,0,0,0,0,0,1613878,0,0,0,0,0,0,0,0,1356883,0,0,0,177.02267849999998,6,0,10,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,178.0299791,{"$nulls":3},2,0.6666666666666666,1.6666666666666667,0,0.16666666666666666,0,0,0,0,0,0,1.6666666666666667,-2,0.3333333333333333,"C6H10O4S1","O4S1","CHOS","Aminosugars",2]
[178.0378418,0,0,0,0,0,2623801,0,951810,1484937,0,0,0,0,0,2466774,0,0,1297987,177.03060262499997,8,0,6,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,178.0378418,{"$nulls":3},7,0.375,0.75,0.25,0,0,0,0,0,0.7777777777777778,0.75,0.75,4,0.875,"C8H6O3N2","O3N2","CHON","Lignin",6]
[178.04523529999997,0,0,0,0,0,1013180,0,0,0,0,0,876512,0,0,0,0,813454,0,177.03793600000003,10,0,10,0,1,0,0,0,1,0,0,0,0,0,0,0,0,null,178.04523529999997,{"$nulls":3},6,0.1,1,0,0.1,0,0,0,0,0.5294117647058824,-0.6,1,5,0.6,"C10H10O1S1","O1S1","CHOS","Lignin",6]
[178.0477376,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1069786,0,0,0,177.0404845,6,0,10,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,178.0477376,{"$nulls":3},2,1,1.6666666666666667,0,0,0,0,0,0,0,0.3333333333333333,1.6666666666666667,-4,0.3333333333333333,"C6H10O6","O6","CHO","Carbohydrates",1]
[178.0629938,6315381,4975645,6701542,6550998,5554330,11876140,5099054,7341709,8092099,6230954,4828560,6679911,6057714,5826185,14432492,4141732,6942484.999999999,7328581,177.05570221052633,10,0,10,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,178.0629938,{"$nulls":3},6,0.3,1,0,0,0,0,0,0,0.5294117647058824,-0.4,1,3,0.6,"C10H10O3","O3","CHO","Lignin",6]
[178.0663645,0,0,0,0,0,1245893,0,0,0,0,0,0,0,0,0,0,0,0,177.05905,7,0,14,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,178.0663645,{"$nulls":3},1,0.42857142857142855,2,0,0.14285714285714285,0,0,0,0,0,-0.8571428571428571,2,-2,0.14285714285714285,"C7H14O3S1","O3S1","CHOS","N-FreeSatCom",4]
[178.0742272,845363,0,862123,1013274,1122078,0,822003,0,1025688,0,786708,879228,0,855694,1352038,0,860314,807123,177.0669654666667,9,0,10,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,178.0742272,{"$nulls":3},6,0.2222222222222222,1.1111111111111112,0.2222222222222222,0,0,0,0,0,0.5,0,1.1111111111111112,4,0.6666666666666666,"C9H10O2N2","O2N2","CHON","Lignin",6]
[178.09937920000002,5767294,5347884.000000001,4434677,6425584,6279337,6226571,7439165,6542492,7246626,7459856,5589919,5754502,7095553,5160599.999999999,5675632,5888435,6610725,6692702,177.0921024705882,11,0,14,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,178.09937920000002,{"$nulls":3},5,0.18181818181818182,1.2727272727272727,0,0,0,0,0,0,0.4,-0.9090909090909091,1.2727272727272727,3,0.45454545454545453,"C11H14O2","O2","CHO","Lignin",6]
[178.1357646,1303180,1356858,1306884,1232500,1169976,913698,1821388,1317419,1351857,1223368,1470383,1405909,1349263,1238887,1601280,1423681,1474867,1502957,177.1284943888889,12,0,18,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,178.1357646,{"$nulls":3},4,0.08333333333333333,1.5,0,0,0,0,0,0,0.30434782608695654,-1.3333333333333333,1.5,3,0.3333333333333333,"C12H18O1","O1","CHO","UnsatHydrocar",7]
[179.00409889999997,0,0,0,0,0,905167,0,0,0,0,0,0,0,0,1439729,0,0,0,177.99681466666667,8,0,5,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,179.00409889999997,{"$nulls":3},7,0.25,0.625,0.125,0.125,0,0,0,0,0.8,0.5,0.625,5,0.875,"C8H5O2N1S1","O2N1S1","CHONS","ConAroStru",8]
[179.0218574,891316,949792.9999999999,913904,1186025,986155,3019735,1036597,1264156,1648286,0,855461,0,973911,812751,3377400,0,0,1717220,178.01457440000004,8,0,5,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,179.0218574,{"$nulls":3},7,0.5,0.625,0.125,0,0,0,0,0,0.8,0.75,0.625,3,0.875,"C8H5O4N1","O4N1","CHON","ConAroStru",8]
[179.0582428,1708291,1829295.0000000002,2108160,2457977,1546683,4719846,1599236,2502699,3045037,2054085,1528884,2036620,2240262,1886238,5790472,1329325.9999999998,2092720.0000000002,3392500,178.05094829411766,9,0,9,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,179.0582428,{"$nulls":3},6,0.3333333333333333,1,0.1111111111111111,0,0,0,0,0,0.5384615384615384,0,1,3,0.6666666666666666,"C9H9O3N1","O3N1","CHON","Lignin",6]
[179.0946282,1788306,1491518,1397518,2162824,1966666,2659572.9999999995,1917779,1851066,2251708.0000000005,1920980,1898563,2043291,2267925,2156077,2621975,2079547.9999999998,2058687,2688259,178.08733083333334,10,0,13,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,179.0946282,{"$nulls":3},5,0.2,1.3,0.1,0,0,0,0,0,0.375,-0.6,1.3,3,0.5,"C10H13O2N1","O2N1","CHON","Lignin",6]
[179.9881145,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1057042,0,0,0,178.9808165,8,0,4,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,179.9881145,{"$nulls":3},7,0.375,0.5,0,0.125,0,0,0,0,0.8181818181818182,0.5,0.5,4,0.875,"C8H4O3S1","O3S1","CHOS","ConAroStru",8]
[180.005873,0,942123,1325058.0000000002,1102212,915141,1394850,0,1511858,972209,0,0,0,0,0,2087833,0,823797,1179396,178.99862078571428,8,0,4,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,180.005873,{"$nulls":3},7,0.625,0.5,0,0,0,0,0,0,0.8181818181818182,0.75,0.5,2,0.875,"C8H4O5","O5","CHO","ConAroStru",8]
[180.0244999,0,0,0,1058828,0,1508089,0,864953.9999999999,0,0,0,0,0,0,1789089,0,0,0,179.01724685714285,9,0,8,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,180.0244999,{"$nulls":3},6,0.2222222222222222,0.8888888888888888,0,0.1111111111111111,0,0,0,0,0.5714285714285714,-0.2222222222222222,0.8888888888888888,4,0.6666666666666666,"C9H8O2S1","O2S1","CHOS","Lignin",6]
[180.0422584,4470928,4930362,7101713,5948692,5335252,12180898,3688402,7617985,5973568,4647897.999999999,4236752.000000001,5500058,4337172,5399468,13648377,3569585,4482628,5475988,179.0349836,9,0,8,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,180.0422584,{"$nulls":3},6,0.4444444444444444,0.8888888888888888,0,0,0,0,0,0,0.5714285714285714,0,0.8888888888888888,2,0.6666666666666666,"C9H8O4","O4","CHO","Lignin",6]
[180.0534918,0,0,835094,0,0,1659013,0,0,1127236.0000000002,0,0,0,0,0,1906861.0000000002,0,814536,870168,179.04624925,8,0,8,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,180.0534918,{"$nulls":3},6,0.375,1,0.25,0,0,0,0,0,0.5555555555555556,0.5,1,3,0.75,"C8H8O3N2","O3N2","CHON","Lignin",6]
[180.06088529999997,0,872993,835417,0,0,0,811738,977993,849926.9999999999,0,1146072.0000000002,996768.9999999999,0,0,0,1003896,1048843,0,179.0535909333333,10,0,12,0,1,0,0,0,1,0,0,0,0,0,0,0,0,null,180.06088529999997,{"$nulls":3},5,0.1,1.2,0,0.1,0,0,0,0,0.4117647058823529,-0.8,1.2,4,0.5,"C10H12O1S1","O1S1","CHOS","Lignin",6]
[180.07864379999998,6619806,6489416,5995296,6887715,5768675,10473792,7019105,7710672,9295950.000000002,7265513,5555680,6255017,7357986,6042811,13490584,5908671,7762515,8248483,179.07137139999998,10,0,12,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,180.07864379999998,{"$nulls":3},5,0.3,1.2,0,0,0,0,0,0,0.4117647058823529,-0.6,1.2,2,0.5,"C10H12O3","O3","CHO","Lignin",6]
[180.0898772,0,0,1018149,0,0,0,0,849749,866195,0,0,0,0,0,1419453,0,0,946471,179.08261000000002,9,0,12,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,180.0898772,{"$nulls":3},5,0.2222222222222222,1.3333333333333333,0.2222222222222222,0,0,0,0,0,0.3333333333333333,-0.2222222222222222,1.3333333333333333,3,0.5555555555555556,"C9H12O2N2","O2N2","CHON","Lignin",6]
[180.1150292,4039085,3820118.9999999995,3784239,3409202,3294706,3912095,6398576,4641759,4299613,4243704,4581359,4246455,4674353,4322506,5092296,5663437,5333602,4511921.999999999,179.10776326315792,11,0,16,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,180.1150292,{"$nulls":3},4,0.18181818181818182,1.4545454545454546,0,0,0,0,0,0,0.3,-1.0909090909090908,1.4545454545454546,2,0.36363636363636365,"C11H16O2","O2","CHO","Lignin",6]
[180.15141459999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,852609,179.144135,12,0,20,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,180.15141459999998,{"$nulls":3},3,0.08333333333333333,1.6666666666666667,0,0,0,0,0,0,0.21739130434782608,-1.5,1.6666666666666667,2,0.25,"C12H20O1","O1","CHO","N-FreeSatCom",4]
[181.0197489,0,0,0,0,0,1648150,0,0,0,0,0,0,0,0,2032197,0,0,0,180.01252150000002,8,0,7,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,181.0197489,{"$nulls":3},6,0.25,0.875,0.125,0.125,0,0,0,0,0.6,0.25,0.875,4,0.75,"C8H7O2N1S1","O2N1S1","CHONS","Lignin",6]
[181.0375074,0,0,0,0,0,3959582,0,0,2323156,0,0,1690922,0,0,4591436.999999999,0,1903449,1596917,180.03024171428572,8,0,7,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,181.0375074,{"$nulls":3},6,0.5,0.875,0.125,0,0,0,0,0,0.6,0.5,0.875,2,0.75,"C8H7O4N1","O4N1","CHON","Lignin",6]
[181.0487408,0,0,0,0,0,1613346,0,0,0,0,0,0,0,0,2122834,0,0,0,180.0414725,7,0,7,0,3,0,3,0,0,0,0,0,0,0,0,0,0,null,181.0487408,{"$nulls":3},6,0.42857142857142855,1,0.42857142857142855,0,0,0,0,0,0.6,1.1428571428571428,1,3,0.8571428571428571,"C7H7O3N3","O3N3","CHON","Lignin",6]
[181.07389279999998,1846572,1916051.0000000002,1413939,2363071,2320765,4877613.000000001,2202352,2238055,2985955,2039936,1885565,2382392,2020656,1563594,6954332,1708098,2411944,3523141,180.0666278125,9,0,11,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,181.07389279999998,{"$nulls":3},5,0.3333333333333333,1.2222222222222223,0.1111111111111111,0,0,0,0,0,0.38461538461538464,-0.2222222222222222,1.2222222222222223,2,0.5555555555555556,"C9H11O3N1","O3N1","CHON","Lignin",6]
[181.1102782,0,919905,835170,1205326,916876,1120700,1087871,1368566,925297,1129614,1033612.0000000001,1112775.0000000002,1096511.0000000002,1101657,1279723,1037744.0000000001,990519,909396,180.10299372222224,10,0,15,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,181.1102782,{"$nulls":3},4,0.2,1.5,0.1,0,0,0,0,0,0.25,-0.8,1.5,2,0.4,"C10H15O2N1","O2N1","CHON","Lignin",6]
[182.0037645,0,0,0,0,0,1741866.9999999998,0,0,0,0,0,0,0,0,2031331,0,0,0,180.996425125,8,0,6,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,182.0037645,{"$nulls":3},6,0.375,0.75,0,0.125,0,0,0,0,0.6363636363636364,0.25,0.75,3,0.75,"C8H6O3S1","O3S1","CHOS","Lignin",6]
[182.021523,3142307,4603463,6413360,4810819,4376831,5854386,3158889,5140711,4005216,2337536.0000000005,2501379,3146162,2733353,2801092,7603435,2230959,2566760,2654160.9999999995,181.01425688888884,8,0,6,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,182.021523,{"$nulls":3},6,0.625,0.75,0,0,0,0,0,0,0.6363636363636364,0.5,0.75,1,0.75,"C8H6O5","O5","CHO","Lignin",6]
[182.03275639999998,0,0,0,0,0,2033847,0,0,0,0,0,0,0,0,2488815,0,0,0,181.02547999999996,7,0,6,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,182.03275639999998,{"$nulls":3},6,0.5714285714285714,0.8571428571428571,0.2857142857142857,0,0,0,0,0,0.6666666666666666,1.1428571428571428,0.8571428571428571,2,0.8571428571428571,"C7H6O4N2","O4N2","CHON","Lignin",6]
[182.0401499,0,0,0,0,0,1912890.0000000002,0,0,0,0,0,0,0,0,2018674,0,0,0,181.03285833333334,9,0,10,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,182.0401499,{"$nulls":3},5,0.2222222222222222,1.1111111111111112,0,0.1111111111111111,0,0,0,0,0.42857142857142855,-0.4444444444444444,1.1111111111111112,3,0.5555555555555556,"C9H10O2S1","O2S1","CHOS","Lignin",6]
[182.0579084,4751281,4472405.999999999,6411838,5338450,5342478,17131547,5325687,6583030,6540143,5934607,4470290,5106881,5612855,5233362,17680663,3740093,5583735,6213600,181.05064368749998,9,0,10,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,182.0579084,{"$nulls":3},5,0.4444444444444444,1.1111111111111112,0,0,0,0,0,0,0.42857142857142855,-0.2222222222222222,1.1111111111111112,1,0.5555555555555556,"C9H10O4","O4","CHO","Lignin",6]
[182.06914179999998,0,0,0,0,0,0,0,0,0,0,0,0,973435,0,1619454,0,0,0,181.061813,8,0,10,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,182.06914179999998,{"$nulls":3},5,0.375,1.25,0.25,0,0,0,0,0,0.3333333333333333,0.25,1.25,2,0.625,"C8H10O3N2","O3N2","CHON","Lignin",6]
[182.07316459999998,0,0,0,811992,1120660,0,1025021,1204732,0,0,0,891079,823645,0,0,0,0,0,181.06590163636363,13,0,10,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,182.07316459999998,{"$nulls":3},9,0.07692307692307693,0.7692307692307693,0,0,0,0,0,0,0.68,-0.6153846153846154,0.7692307692307693,8,0.6923076923076923,"C13H10O1","O1","CHO","UnsatHydrocar",7]
[182.0942938,7483912,5628004,5156429.000000001,6458465,4685597,13681465,7824774,7706884.000000001,9908747,7935311,6477857,5535439,6418757,6465761,15684661,6641099,9883677,9077118,181.08702949999997,10,0,14,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,182.0942938,{"$nulls":3},4,0.3,1.4,0,0,0,0,0,0,0.29411764705882354,-0.8,1.4,1,0.4,"C10H14O3","O3","CHO","Lignin",6]
[182.10552719999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,852558,0,0,0,181.0982845,9,0,14,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,182.10552719999998,{"$nulls":3},4,0.2222222222222222,1.5555555555555556,0.2222222222222222,0,0,0,0,0,0.16666666666666666,-0.4444444444444444,1.5555555555555556,2,0.4444444444444444,"C9H14O2N2","O2N2","CHON","N-ConSatCom",3]
[182.1306792,2173646,2137970,1312474.9999999998,1513455,2036139,3061215,3125652,3179283,1931916,1999276,2035631,1940446,2019668,1652463,3215640,2615257,2915732,2177150,181.12339752631578,11,0,18,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,182.1306792,{"$nulls":3},3,0.18181818181818182,1.6363636363636365,0,0,0,0,0,0,0.2,-1.2727272727272727,1.6363636363636365,1,0.2727272727272727,"C11H18O2","O2","CHO","N-FreeSatCom",4]
[182.9990135,0,0,0,0,0,996801,0,1305262,0,0,0,0,0,834630,965187,0,1620464,0,181.99174014285714,7,0,5,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,182.9990135,{"$nulls":3},6,0.42857142857142855,0.7142857142857143,0.14285714285714285,0.14285714285714285,0,0,0,0,0.7142857142857143,0.8571428571428571,0.7142857142857143,3,0.8571428571428571,"C7H5O3N1S1","O3N1S1","CHONS","Lignin",6]
[183.016772,0,0,1066235,883350.0000000001,0,1719240,0,0,1080686,0,0,0,0,1198669,2285451.0000000005,0,0,1237997,182.00952858333335,7,0,5,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,183.016772,{"$nulls":3},6,0.7142857142857143,0.7142857142857143,0.14285714285714285,0,0,0,0,0,0.7142857142857143,1.1428571428571428,0.7142857142857143,1,0.8571428571428571,"C7H5O5N1","O5N1","CHON","Tannins",5]
[183.0353989,0,0,0,0,0,1417039,0,0,0,0,0,0,0,0,1139154,0,0,0,182.0280142,8,0,9,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,183.0353989,{"$nulls":3},5,0.25,1.125,0.125,0.125,0,0,0,0,0.4,0,1.125,3,0.625,"C8H9O2N1S1","O2N1S1","CHONS","Lignin",6]
[183.0531574,1409079,1171672,1690441,0,0,4697175,1138431,1787267.9999999998,2107644,0,1065510.9999999998,1340746,1268350,0,5326490,0,0,1794172,182.04588,8,0,9,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,183.0531574,{"$nulls":3},5,0.5,1.125,0.125,0,0,0,0,0,0.4,0.25,1.125,1,0.625,"C8H9O4N1","O4N1","CHON","Lignin",6]
[183.06841359999999,0,0,0,0,847269,0,0,0,0,0,0,0,0,0,0,0,0,0,182.0611328,12,0,9,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,183.06841359999999,{"$nulls":3},9,0.08333333333333333,0.75,0.08333333333333333,0,0,0,0,0,0.7142857142857143,-0.3333333333333333,0.75,8,0.75,"C12H9O1N1","O1N1","CHON","UnsatHydrocar",7]
[183.0895428,1359813,1330278,1175256,1398900,1548334,3168869,0,1778451,1512842,0,1342133.0000000002,0,1342668,0,3590825,1450950,1688468,0,182.0822822,9,0,13,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,183.0895428,{"$nulls":3},4,0.3333333333333333,1.4444444444444444,0.1111111111111111,0,0,0,0,0,0.23076923076923078,-0.4444444444444444,1.4444444444444444,1,0.4444444444444444,"C9H13O3N1","O3N1","CHON","Lignin",6]
[184.012021,0,0,0,1272165,1378845,0,939380,1546239,1977974.9999999998,1662878,995496,0,1219891,1366226,930344,949794,0,1283527,183.00475211764706,6,0,4,0,5,0,2,0,0,0,0,0,0,0,0,0,0,null,184.012021,{"$nulls":3},6,0.8333333333333334,0.6666666666666666,0.3333333333333333,0,0,0,0,0,1,2,0.6666666666666666,1,1,"C6H4O5N2","O5N2","CHON","Tannins",5]
[184.01941449999998,0,0,0,0,888608,3219420,1250422.9999999998,1448450,0,0,0,0,0,1740499.9999999998,3974699,0,996230,1165962.0000000002,183.0121130909091,8,0,8,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,184.01941449999998,{"$nulls":3},5,0.375,1,0,0.125,0,0,0,0,0.45454545454545453,0,1,2,0.625,"C8H8O3S1","O3S1","CHOS","Lignin",6]
[184.037173,1703603,1923920.9999999998,2705484,2316655,2339623,7204951,2176638,2268681,3092353,2170024,1506738,2375628,1929020,2417371.0000000005,7517571,1576875,2501901,2271250,183.02989044444445,8,0,8,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,184.037173,{"$nulls":3},5,0.625,1,0,0,0,0,0,0,0.45454545454545453,0.25,1,0,0.625,"C8H8O5","O5","CHO","Lignin",6]
[184.0484064,0,0,0,0,0,799208,0,0,0,0,0,0,0,0,1147831,0,0,0,183.04111239999997,7,0,8,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,184.0484064,{"$nulls":3},5,0.5714285714285714,1.1428571428571428,0.2857142857142857,0,0,0,0,0,0.3333333333333333,0.8571428571428571,1.1428571428571428,1,0.7142857142857143,"C7H8O4N2","O4N2","CHON","Lignin",6]
[184.0524292,992952.9999999999,0,1179602,0,0,0,0,0,1062791,992558,826425,0,0,0,1047865,0,0,0,183.04519277777777,12,0,8,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,184.0524292,{"$nulls":3},9,0.16666666666666666,0.6666666666666666,0,0,0,0,0,0,0.7272727272727273,-0.3333333333333333,0.6666666666666666,7,0.75,"C12H8O2","O2","CHO","ConAroStru",8]
[184.05579989999998,0,0,0,0,0,2103915,0,0,0,0,0,0,0,0,1728569.9999999998,0,0,0,183.04852499999998,9,0,12,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,184.05579989999998,{"$nulls":3},4,0.2222222222222222,1.3333333333333333,0,0.1111111111111111,0,0,0,0,0.2857142857142857,-0.6666666666666666,1.3333333333333333,2,0.4444444444444444,"C9H12O2S1","O2S1","CHOS","Lignin",6]
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[184.08881459999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1178791,183.081567,13,0,12,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,184.08881459999998,{"$nulls":3},8,0.07692307692307693,0.9230769230769231,0,0,0,0,0,0,0.6,-0.7692307692307693,0.9230769230769231,7,0.6153846153846154,"C13H12O1","O1","CHO","UnsatHydrocar",7]
[184.1099438,2688079,3234924,2277225,3090828,2858692,11433488,4675738,5209638,4307613,3720517,3420240,2589160,3009113,3475704,13487807,3830215,5516970,3333424,183.10267363157897,10,0,16,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,184.1099438,{"$nulls":3},3,0.3,1.6,0,0,0,0,0,0,0.17647058823529413,-1,1.6,0,0.3,"C10H16O3","O3","CHO","N-FreeSatCom",4]
[184.1463292,0,0,0,0,0,1286542.9999999998,0,1127220,0,0,0,0,0,0,1418208,0,955320,0,183.1390562857143,11,0,20,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,184.1463292,{"$nulls":3},2,0.18181818181818182,1.8181818181818181,0,0,0,0,0,0,0.1,-1.4545454545454546,1.8181818181818181,0,0.18181818181818182,"C11H20O2","O2","CHO","N-FreeSatCom",4]
[185.01466349999998,0,0,0,0,0,1228457,0,0,0,0,0,0,0,0,1913030,0,0,0,184.007419,7,0,7,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,185.01466349999998,{"$nulls":3},5,0.42857142857142855,1,0.14285714285714285,0.14285714285714285,0,0,0,0,0.42857142857142855,0.5714285714285714,1,2,0.7142857142857143,"C7H7O3N1S1","O3N1S1","CHONS","Lignin",6]
[185.032422,0,0,0,0,0,1098864,0,0,959109,0,0,0,0,0,1595725,0,0,0,184.025141375,7,0,7,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,185.032422,{"$nulls":3},5,0.7142857142857143,1,0.14285714285714285,0,0,0,0,0,0.42857142857142855,0.8571428571428571,1,0,0.7142857142857143,"C7H7O5N1","O5N1","CHON","Tannins",5]
[185.0476782,0,0,0,0,0,936950,0,0,0,0,0,0,0,0,1049683,0,0,0,184.0403993333333,11,0,7,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,185.0476782,{"$nulls":3},9,0.18181818181818182,0.6363636363636364,0.09090909090909091,0,0,0,0,0,0.7777777777777778,0,0.6363636363636364,7,0.8181818181818182,"C11H7O2N1","O2N1","CHON","ConAroStru",8]
[185.05104889999998,0,0,0,0,0,1165176.0000000002,0,0,0,0,0,0,0,0,962645,0,0,0,184.043812,8,0,11,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,185.05104889999998,{"$nulls":3},4,0.25,1.375,0.125,0.125,0,0,0,0,0.2,-0.25,1.375,2,0.5,"C8H11O2N1S1","O2N1S1","CHONS","Lignin",6]
[185.0688074,0,0,0,0,0,4108671,0,0,0,0,0,0,0,0,4335836,0,0,0,184.06152125000003,8,0,11,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,185.0688074,{"$nulls":3},4,0.5,1.375,0.125,0,0,0,0,0,0.2,0,1.375,0,0.5,"C8H11O4N1","O4N1","CHON","Lignin",6]
[185.08406359999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,851362,0,0,0,184.076819,12,0,11,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,185.08406359999998,{"$nulls":3},8,0.08333333333333333,0.9166666666666666,0.08333333333333333,0,0,0,0,0,0.6190476190476191,-0.5,0.9166666666666666,7,0.6666666666666666,"C12H11O1N1","O1N1","CHON","UnsatHydrocar",7]
[185.1051928,0,0,0,0,818891,1535117,0,838826,846818.0000000001,966861,0,0,0,0,1072235,0,0,0,184.09790799999996,9,0,15,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,185.1051928,{"$nulls":3},3,0.3333333333333333,1.6666666666666667,0.1111111111111111,0,0,0,0,0,0.07692307692307693,-0.6666666666666666,1.6666666666666667,0,0.3333333333333333,"C9H15O3N1","O3N1","CHON","N-ConSatCom",3]
[185.99867909999998,0,0,0,0,0,3644397,0,0,0,0,0,0,0,0,4623705.000000001,0,0,0,184.99146779999998,7,0,6,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,185.99867909999998,{"$nulls":3},5,0.5714285714285714,0.8571428571428571,0,0.14285714285714285,0,0,0,0,0.5,0.5714285714285714,0.8571428571428571,1,0.7142857142857143,"C7H6O4S1","O4S1","CHOS","Lignin",6]
[186.0164376,0,0,0,0,0,946676,0,0,0,0,0,0,0,0,848480,0,0,0,185.0091534,7,0,6,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,186.0164376,{"$nulls":3},5,0.8571428571428571,0.8571428571428571,0,0,0,0,0,0,0.5,0.8571428571428571,0.8571428571428571,-1,0.7142857142857143,"C7H6O6","O6","CHO","Tannins",5]
[186.0316938,0,0,0,1257213,0,845434,0,955662,0,0,0,0,0,0,1310565.9999999998,0,0,1094652,185.024437875,11,0,6,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,186.0316938,{"$nulls":3},9,0.2727272727272727,0.5454545454545454,0,0,0,0,0,0,0.7894736842105263,0,0.5454545454545454,6,0.8181818181818182,"C11H6O3","O3","CHO","ConAroStru",8]
[186.03506449999998,0,0,0,1374334,982963,3575291,2813560,903311,0,0,861254,963407,1330743,912539,3535720,2029835.9999999998,809883,0,185.0277755,8,0,10,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,186.03506449999998,{"$nulls":3},4,0.375,1.25,0,0.125,0,0,0,0,0.2727272727272727,-0.25,1.25,1,0.5,"C8H10O3S1","O3S1","CHOS","Lignin",6]
[186.052823,2279728,2839876,0,2517765,2504762,5374210,2368382.9999999995,3012118,2417807,2420287,2149580.9999999995,2439382,2224189.0000000005,2473697,5845871,2237714.9999999995,3298722,2792517,185.04553287500002,8,0,10,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,186.052823,{"$nulls":3},4,0.625,1.25,0,0,0,0,0,0,0.2727272727272727,0,1.25,-1,0.5,"C8H10O5","O5","CHO","Lignin",6]
[186.0640564,0,0,0,0,0,1055365.9999999998,0,0,0,0,0,0,0,0,945779,0,0,0,185.056782,7,0,10,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,186.0640564,{"$nulls":3},4,0.5714285714285714,1.4285714285714286,0.2857142857142857,0,0,0,0,0,0,0.5714285714285714,1.4285714285714286,0,0.5714285714285714,"C7H10O4N2","O4N2","CHON","Lignin",6]
[186.0680792,3153845,2655561,0,3261323,3650880,4206344,2367620,0,3381140.9999999995,3013701,0,3560155,3288387,3670759,4313461,2118041,0,4027467.0000000005,185.06082000000004,12,0,10,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,186.0680792,{"$nulls":3},8,0.16666666666666666,0.8333333333333334,0,0,0,0,0,0,0.6363636363636364,-0.5,0.8333333333333334,6,0.6666666666666666,"C12H10O2","O2","CHO","Lignin",6]
[186.07144989999998,0,0,0,0,0,829961,0,0,0,0,930324,0,808516,0,0,0,1082153,0,185.064223,9,0,14,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,186.07144989999998,{"$nulls":3},3,0.2222222222222222,1.5555555555555556,0,0.1111111111111111,0,0,0,0,0.14285714285714285,-0.8888888888888888,1.5555555555555556,1,0.3333333333333333,"C9H14O2S1","O2S1","CHOS","N-FreeSatCom",4]
[186.0892084,2641341,2358864.9999999995,1968995,2178963,2444360,18179046,2873996,6213412,4229789,3618893,2626907,2528484,2193739,3652847,20853907,2541472.0000000005,6672304,3456595,185.08193331578946,9,0,14,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,186.0892084,{"$nulls":3},3,0.4444444444444444,1.5555555555555556,0,0,0,0,0,0,0.14285714285714285,-0.6666666666666666,1.5555555555555556,-1,0.3333333333333333,"C9H14O4","O4","CHO","N-FreeSatCom",4]
[186.1044646,1710403,1820630.9999999998,1530345,2091929,1714126,0,2500241.9999999995,1595818,1406627,2021971,1919841,2185961,2346577,1891829,1261444,1854374,2317494,1720921,185.0972057647059,13,0,14,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,186.1044646,{"$nulls":3},7,0.07692307692307693,1.0769230769230769,0,0,0,0,0,0,0.52,-0.9230769230769231,1.0769230769230769,6,0.5384615384615384,"C13H14O1","O1","CHO","UnsatHydrocar",7]
[186.1255938,0,0,819057,0,0,3671838,887066,1883954,0,929755,0,0,0,895101,4629645,1100717,1686334,0,185.1183337777778,10,0,18,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,186.1255938,{"$nulls":3},2,0.3,1.8,0,0,0,0,0,0,0.058823529411764705,-1.2,1.8,-1,0.2,"C10H18O3","O3","CHO","N-FreeSatCom",4]
[187.03031349999998,0,0,0,0,0,1335550,0,0,0,0,0,0,0,0,1423228,0,0,0,186.023021,7,0,9,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,187.03031349999998,{"$nulls":3},4,0.42857142857142855,1.2857142857142858,0.14285714285714285,0.14285714285714285,0,0,0,0,0.14285714285714285,0.2857142857142857,1.2857142857142858,1,0.5714285714285714,"C7H9O3N1S1","O3N1S1","CHONS","Lignin",6]
[187.048072,0,0,0,0,0,1145091.9999999998,0,0,0,0,0,0,0,0,1317123,0,0,0,186.04081325,7,0,9,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,187.048072,{"$nulls":3},4,0.7142857142857143,1.2857142857142858,0.14285714285714285,0,0,0,0,0,0.14285714285714285,0.5714285714285714,1.2857142857142858,-1,0.5714285714285714,"C7H9O5N1","O5N1","CHON","Tannins",5]
[187.0633282,0,0,0,2338312,0,2450570.0000000005,0,2150677,2607887,0,1546707,0,2313143,0,3062281,0,2081318,2462681,186.05604472727273,11,0,9,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,187.0633282,{"$nulls":3},8,0.18181818181818182,0.8181818181818182,0.09090909090909091,0,0,0,0,0,0.6666666666666666,-0.18181818181818182,0.8181818181818182,6,0.7272727272727273,"C11H9O2N1","O2N1","CHON","Lignin",6]
[187.0844574,0,0,0,0,0,1340563,0,857372,889879,0,0,0,0,0,1728785,0,799022,0,186.0771933333333,8,0,13,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,187.0844574,{"$nulls":3},3,0.5,1.625,0.125,0,0,0,0,0,0,-0.25,1.625,-1,0.375,"C8H13O4N1","O4N1","CHON","N-ConSatCom",3]
[187.09971359999997,1291188.0000000002,1336898.0000000002,1365984,995606,848585,0,1615621,1091874,0,1392850,1080992.9999999998,1199778,1252676,1487467,1123736,1085836,1136820,1017319,186.0924541176471,12,0,13,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,187.09971359999997,{"$nulls":3},7,0.08333333333333333,1.0833333333333333,0.08333333333333333,0,0,0,0,0,0.5238095238095238,-0.6666666666666666,1.0833333333333333,6,0.5833333333333334,"C12H13O1N1","O1N1","CHON","UnsatHydrocar",7]
[187.1208428,0,0,0,0,0,895648,0,0,0,0,0,0,0,0,0,0,0,0,186.113514,9,0,17,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,187.1208428,{"$nulls":3},2,0.3333333333333333,1.8888888888888888,0.1111111111111111,0,0,0,0,0,0,-0.8888888888888888,1.8888888888888888,-1,0.2222222222222222,"C9H17O3N1","O3N1","CHON","N-ConSatCom",3]
[187.9601852,0,0,0,0,0,2647266,0,0,0,0,0,0,0,0,0,0,0,0,186.952911,6,0,4,0,3,0,0,0,2,0,0,0,0,0,0,0,0,null,187.9601852,{"$nulls":3},5,0.5,0.6666666666666666,0,0.3333333333333333,0,0,0,0,0.6,1,0.6666666666666666,2,0.8333333333333334,"C6H4O3S2","O3S2","CHOS","ConAroStru",8]
[187.9965706,0,0,0,0,0,1294960,0,0,0,0,0,0,0,0,851744,0,0,0,186.98931466666667,7,0,8,0,2,0,0,0,2,0,0,0,0,0,0,0,0,null,187.9965706,{"$nulls":3},4,0.2857142857142857,1.1428571428571428,0,0.2857142857142857,0,0,0,0,0.25,0,1.1428571428571428,2,0.5714285714285714,"C7H8O2S2","O2S2","CHOS","Lignin",6]
[188.0109584,0,0,0,0,0,0,0,0,0,0,0,0,0,0,956806,0,0,0,187.00370599999997,10,0,4,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,188.0109584,{"$nulls":3},9,0.4,0.4,0,0,0,0,0,0,0.875,0.4,0.4,5,0.9,"C10H4O4","O4","CHO","ConAroStru",8]
[188.0143291,0,0,0,0,0,2966774,0,0,0,0,0,0,0,0,2889607,0,0,0,187.00706100000002,7,0,8,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,188.0143291,{"$nulls":3},4,0.5714285714285714,1.1428571428571428,0,0.14285714285714285,0,0,0,0,0.25,0.2857142857142857,1.1428571428571428,0,0.5714285714285714,"C7H8O4S1","O4S1","CHOS","Lignin",6]
[188.0320876,0,0,0,0,1023782,1723901,0,0,0,0,0,1105087,0,0,2170766,0,0,1151192,187.024787,7,0,8,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,188.0320876,{"$nulls":3},4,0.8571428571428571,1.1428571428571428,0,0,0,0,0,0,0.25,0.5714285714285714,1.1428571428571428,-2,0.5714285714285714,"C7H8O6","O6","CHO","Tannins",5]
[188.0473438,3955085,3909910,6197568,5340538.999999999,4770348,6285952,2999649,7062964,5137024,4126778.9999999995,3600712,5547973,4680481,4943818.999999999,7311160,2937692,4485276,4555102,187.04006494117647,11,0,8,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,188.0473438,{"$nulls":3},8,0.2727272727272727,0.7272727272727273,0,0,0,0,0,0,0.6842105263157895,-0.18181818181818182,0.7272727272727273,5,0.7272727272727273,"C11H8O3","O3","CHO","Lignin",6]
[188.0507145,0,815191,0,0,0,0,0,0,0,0,0,0,0,0,1700629.9999999998,0,0,0,187.0434085,8,0,12,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,188.0507145,{"$nulls":3},3,0.375,1.5,0,0.125,0,0,0,0,0.09090909090909091,-0.5,1.5,0,0.375,"C8H12O3S1","O3S1","CHOS","Lignin",6]
[188.0585772,0,0,0,0,0,1837831,0,0,1366788,852287,0,809033,1067685,0,2100633,0,0,1784163,187.05133424999997,10,0,8,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,188.0585772,{"$nulls":3},8,0.2,0.8,0.2,0,0,0,0,0,0.7142857142857143,0.2,0.8,6,0.8,"C10H8O2N2","O2N2","CHON","Lignin",6]
[188.068473,0,0,0,1847170,1865779,7250955,0,2851594,2184839.9999999995,1710403,0,0,1437544,1807571,6737565,1788771,2731172,1892198,187.06117835714284,8,0,12,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,188.068473,{"$nulls":3},3,0.625,1.5,0,0,0,0,0,0,0.09090909090909091,-0.25,1.5,-2,0.375,"C8H12O5","O5","CHO","Lignin",6]
[188.0837292,5453466,5341475,5347662,6282114,6043193,3837457.0000000005,5588591,7036686,5749646,6854920,5540694,5780689.999999999,6303790,6166912,4270243,5310126,7244937,5049197,187.07645155555554,12,0,12,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,188.0837292,{"$nulls":3},7,0.16666666666666666,1,0,0,0,0,0,0,0.5454545454545454,-0.6666666666666666,1,5,0.5833333333333334,"C12H12O2","O2","CHO","Lignin",6]
[188.1048584,1749026,1739178,822501,1117968,1620801,8204971,1943158,3538712,2130966,1639760,1199453,1343322,0,1968864,8718438,1202031.9999999998,3060657,1617397,187.09757978947368,9,0,16,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,188.1048584,{"$nulls":3},2,0.4444444444444444,1.7777777777777777,0,0,0,0,0,0,0,-0.8888888888888888,1.7777777777777777,-2,0.2222222222222222,"C9H16O4","O4","CHO","N-FreeSatCom",4]
[188.1201146,2289319.0000000005,1721392,1648091,2115222,2031813.9999999998,1146783,2840444,2296093.0000000005,1545499,2014294.0000000002,2550883,2160159,2147387.0000000005,2255334,1211057.0000000002,2274677,2500535,1826171,187.11284211764706,13,0,16,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,188.1201146,{"$nulls":3},6,0.07692307692307693,1.2307692307692308,0,0,0,0,0,0,0.44,-1.0769230769230769,1.2307692307692308,5,0.46153846153846156,"C13H16O1","O1","CHO","UnsatHydrocar",7]
[188.14124379999998,0,0,0,0,0,1330983,0,0,0,0,0,0,0,0,1503674,0,0,0,187.13393560000003,10,0,20,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,188.14124379999998,{"$nulls":3},1,0.3,2,0,0,0,0,0,0,0,-1.4,2,-2,0.1,"C10H20O3","O3","CHO","N-FreeSatCom",4]
[189.0425928,1609457,1334772,0,2156010,0,4697978,0,3128942,2860527,0,1699002,0,2092937,0,6573600,1188790.0000000002,2865424,2930659,188.03532092307694,10,0,7,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,189.0425928,{"$nulls":3},8,0.3,0.7,0.1,0,0,0,0,0,0.7333333333333333,0.2,0.7,5,0.8,"C10H7O3N1","O3N1","CHON","Lignin",6]
[189.0789782,2109566,2445953.0000000005,2305977,2172407,2484903,2717831,2108885,3205755,2797565,1987261,2440135.9999999995,2452289,2944406,2487876,2685871,0,2831133,3107057,188.07169968749997,11,0,11,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,189.0789782,{"$nulls":3},7,0.18181818181818182,1,0.09090909090909091,0,0,0,0,0,0.5555555555555556,-0.36363636363636365,1,5,0.6363636363636364,"C11H11O2N1","O2N1","CHON","Lignin",6]
[189.1153636,928779,899726,0,981637,1188660,0,1119714,0,0,827339,1127125,989518,837283,1103185,0,0,999595,0,188.1081213529412,12,0,15,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,189.1153636,{"$nulls":3},6,0.08333333333333333,1.25,0.08333333333333333,0,0,0,0,0,0.42857142857142855,-0.8333333333333334,1.25,5,0.5,"C12H15O1N1","O1N1","CHON","UnsatHydrocar",7]
[189.13649279999998,0,0,0,0,0,909085,0,0,0,0,0,0,0,0,0,0,0,0,188.12932,9,0,19,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,189.13649279999998,{"$nulls":3},1,0.3333333333333333,2.111111111111111,0.1111111111111111,0,0,0,0,0,0,-1.1111111111111112,2.111111111111111,-2,0.1111111111111111,"C9H19O3N1","O3N1","CHON","N-ConSatCom",3]
[190.0122206,0,0,0,0,0,854497,0,0,0,0,0,0,0,0,939998,0,0,0,189.004929,7,0,10,0,2,0,0,0,2,0,0,0,0,0,0,0,0,null,190.0122206,{"$nulls":3},3,0.2857142857142857,1.4285714285714286,0,0.2857142857142857,0,0,0,0,0,-0.2857142857142857,1.4285714285714286,1,0.42857142857142855,"C7H10O2S2","O2S2","CHOS","Lignin",6]
[190.0266084,3097931,3413959,5811724,3984462,3623932,4351718,2056229,4984526,4037972,2782235,2426146,3905176,3143654,3287960,7136204,2128389.9999999995,3150970,2873951,189.01935270588237,10,0,6,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,190.0266084,{"$nulls":3},8,0.4,0.6,0,0,0,0,0,0,0.75,0.2,0.6,4,0.8,"C10H6O4","O4","CHO","ConAroStru",8]
[190.0299791,0,0,0,0,0,4591846.999999999,0,0,0,0,0,0,0,0,4614565.000000001,0,0,0,189.0227185,7,0,10,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,190.0299791,{"$nulls":3},3,0.5714285714285714,1.4285714285714286,0,0.14285714285714285,0,0,0,0,0,0,1.4285714285714286,-1,0.42857142857142855,"C7H10O4S1","O4S1","CHOS","Lignin",6]
[190.0378418,0,0,899024,0,0,0,0,930130,0,0,0,0,0,840220,2344104,0,817150,0,189.03054033333333,9,0,6,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,190.0378418,{"$nulls":3},8,0.3333333333333333,0.6666666666666666,0.2222222222222222,0,0,0,0,0,0.8181818181818182,0.6666666666666666,0.6666666666666666,5,0.8888888888888888,"C9H6O3N2","O3N2","CHON","ConAroStru",8]
[190.0477376,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1352619,0,919937,918759,189.04045290000002,7,0,10,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,190.0477376,{"$nulls":3},3,0.8571428571428571,1.4285714285714286,0,0,0,0,0,0,0,0.2857142857142857,1.4285714285714286,-3,0.42857142857142855,"C7H10O6","O6","CHO","Tannins",5]
[190.0629938,7076696,6919124,9116697,8895451,7039753,11695443,6907698,9011419,8274785,7348776,6221359,8049829,7701827,7162021,14056040,5150994,10205049,8810582,189.05573318749998,11,0,10,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,190.0629938,{"$nulls":3},7,0.2727272727272727,0.9090909090909091,0,0,0,0,0,0,0.5789473684210527,-0.36363636363636365,0.9090909090909091,4,0.6363636363636364,"C11H10O3","O3","CHO","Lignin",6]
[190.0742272,0,0,0,0,0,2254584,0,0,0,1066731.9999999998,0,0,0,0,2356918,0,0,1909489,189.066902,10,0,10,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,190.0742272,{"$nulls":3},7,0.2,1,0.2,0,0,0,0,0,0.5714285714285714,0,1,5,0.7,"C10H10O2N2","O2N2","CHON","Lignin",6]
[190.084123,0,0,0,0,0,2487291,0,1716194,0,0,0,0,0,2613420,2359993.9999999995,0,3447439,0,189.0768548571429,8,0,14,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,190.084123,{"$nulls":3},2,0.625,1.75,0,0,0,0,0,0,0,-0.5,1.75,-3,0.25,"C8H14O5","O5","CHO","Aminosugars",2]
[190.09937920000002,7630112,7192849,5311526,7449908,7184397,4236033,9615704,7320296,7647426,7953623,8680158,6374579,8961245.000000002,7580101.000000001,5275072,7851147,8464787,8399729,189.09212066666663,12,0,14,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,190.09937920000002,{"$nulls":3},6,0.16666666666666666,1.1666666666666667,0,0,0,0,0,0,0.45454545454545453,-0.8333333333333334,1.1666666666666667,4,0.5,"C12H14O2","O2","CHO","Lignin",6]
[190.1205084,0,0,0,0,0,0,0,0,0,0,0,0,0,0,971592,0,0,0,189.113325,9,0,18,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,190.1205084,{"$nulls":3},1,0.4444444444444444,2,0,0,0,0,0,0,0,-1.1111111111111112,2,-3,0.1111111111111111,"C9H18O4","O4","CHO","N-FreeSatCom",4]
[190.1357646,1963121,1779436,1696051,1332981,1831203,2120718,2901067,2166901,2131066.9999999995,1984835,1861705,1349695,2088460.0000000002,1742527,2361294,1651882,2046754,1705864,189.12849799999998,13,0,18,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,190.1357646,{"$nulls":3},5,0.07692307692307693,1.3846153846153846,0,0,0,0,0,0,0.36,-1.2307692307692308,1.3846153846153846,4,0.38461538461538464,"C13H18O1","O1","CHO","UnsatHydrocar",7]
[191.0218574,0,0,1055722,1137199,0,1967568,0,1339819,1311927,0,0,977275,1093441,965879,1876390,0,1114594,1140057.0000000002,190.01461644444444,9,0,5,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,191.0218574,{"$nulls":3},8,0.4444444444444444,0.5555555555555556,0.1111111111111111,0,0,0,0,0,0.8333333333333334,0.6666666666666666,0.5555555555555556,4,0.8888888888888888,"C9H5O4N1","O4N1","CHON","ConAroStru",8]
[191.0429866,0,0,0,0,0,818263,0,0,0,0,0,0,0,0,0,0,0,0,190.035719,6,0,9,0,6,0,1,0,0,0,0,0,0,0,0,0,0,null,191.0429866,{"$nulls":3},3,1,1.5,0.16666666666666666,0,0,0,0,0,0,1,1.5,-3,0.5,"C6H9O6N1","O6N1","CHON","Tannins",5]
[191.0582428,2423213,3015715,3017847,3813564,3418984,6401629,2540682.9999999995,3995447,4161219,2416785,2789267,3772424,3494477,3035140,6478644,2185566,3947503,4589543,190.05098505555557,10,0,9,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,191.0582428,{"$nulls":3},7,0.3,0.9,0.1,0,0,0,0,0,0.6,0,0.9,4,0.7,"C10H9O3N1","O3N1","CHON","Lignin",6]
[191.0694762,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1054648,0,0,0,190.0620985,9,0,9,0,2,0,3,0,0,0,0,0,0,0,0,0,0,null,191.0694762,{"$nulls":3},7,0.2222222222222222,1,0.3333333333333333,0,0,0,0,0,0.6,0.4444444444444444,1,5,0.7777777777777778,"C9H9O2N3","O2N3","CHON","Lignin",6]
[191.0946282,2722234,3180847,3286915,3152583.9999999995,2856308,2214378,3668631,2628164,3344080,2612126,3142304,3091733,3498586,3109392,2149570,2315497.9999999995,3164668,3299572,190.0873667777778,11,0,13,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,191.0946282,{"$nulls":3},6,0.18181818181818182,1.1818181818181819,0.09090909090909091,0,0,0,0,0,0.4444444444444444,-0.5454545454545454,1.1818181818181819,4,0.5454545454545454,"C11H13O2N1","O2N1","CHON","Lignin",6]
[191.1310136,0,861627,0,0,0,0,0,0,910173,0,1007660.0000000001,1144994,0,0,0,844662,0,0,190.1237422307692,12,0,17,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,191.1310136,{"$nulls":3},5,0.08333333333333333,1.4166666666666667,0.08333333333333333,0,0,0,0,0,0.3333333333333333,-1,1.4166666666666667,4,0.4166666666666667,"C12H17O1N1","O1N1","CHON","UnsatHydrocar",7]
[191.9373413,0,0,0,0,0,818134.0000000001,0,0,0,0,0,0,0,0,0,0,0,0,190.930227,5,0,4,0,2,0,0,0,3,0,0,0,0,0,0,0,0,null,191.9373413,{"$nulls":3},4,0.4,0.8,0,0.6,0,0,0,0,0,1.2,0.8,2,0.8,"C5H4O2S3","O2S3","CHOS","Lignin",6]
[191.96461559999997,0,0,0,0,0,0,0,2189422,0,0,0,0,0,0,0,0,0,0,190.957521,5,0,5,0,4,0,0,0,1,0,0,1,0,0,0,0,0,null,191.96461559999997,{"$nulls":3},4,0.8,1,0,0.2,0.2,0,0,0,0,0,1,0,0.8,"C5H5O4S1P1","O4S1P1","CHOSP","Tannins",5]
[192.005873,1057708,987610,1610429,1331332,1369390,1456942,0,1596539,1593614,998883,944478,1365844,0,831051,1619615,0,1312576,1213641,190.99861131578947,9,0,4,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,192.005873,{"$nulls":3},8,0.5555555555555556,0.4444444444444444,0,0,0,0,0,0,0.8461538461538461,0.6666666666666666,0.4444444444444444,3,0.8888888888888888,"C9H4O5","O5","CHO","ConAroStru",8]
[192.00924369999998,0,0,0,0,0,0,0,0,0,0,0,0,0,0,816416,0,0,0,191.002092,6,0,8,0,5,0,0,0,1,0,0,0,0,0,0,0,0,null,192.00924369999998,{"$nulls":3},3,0.8333333333333334,1.3333333333333333,0,0.16666666666666666,0,0,0,0,0,0.6666666666666666,1.3333333333333333,-2,0.5,"C6H8O5S1","O5S1","CHOS","Tannins",5]
[192.0244999,0,0,0,1062922,0,2188469,0,855937.9999999999,900244,880553,0,0,851927,823634,2023846,0,859590.0000000001,875856,191.01723569999996,10,0,8,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,192.0244999,{"$nulls":3},7,0.2,0.8,0,0.1,0,0,0,0,0.625,-0.2,0.8,5,0.7,"C10H8O2S1","O2S1","CHOS","Lignin",6]
[192.0422584,6023672,6238310,10171081,7957264,7467451,16412884.000000002,6020569,9457544,7455259,6372592,5476075,7282017,6366621,7231832,19153364,4545438.999999999,8539724,6715735,191.0349902142857,10,0,8,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,192.0422584,{"$nulls":3},7,0.4,0.8,0,0,0,0,0,0,0.625,0,0.8,3,0.7,"C10H8O4","O4","CHO","Lignin",6]
[192.04562909999999,0,0,0,0,0,3048637,0,877321,0,0,0,0,0,0,2261422,0,0,0,191.03837066666665,7,0,12,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,192.04562909999999,{"$nulls":3},2,0.5714285714285714,1.7142857142857142,0,0.14285714285714285,0,0,0,0,0,-0.2857142857142857,1.7142857142857142,-2,0.2857142857142857,"C7H12O4S1","O4S1","CHOS","Aminosugars",2]
[192.0534918,945724,0,0,1278996,941310,2513855,873692,1132683,1733023,852788,943599,0,867104,1037660,0,0,1094224,1851483,191.04621718750002,9,0,8,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,192.0534918,{"$nulls":3},7,0.3333333333333333,0.8888888888888888,0.2222222222222222,0,0,0,0,0,0.6363636363636364,0.4444444444444444,0.8888888888888888,4,0.7777777777777778,"C9H8O3N2","O3N2","CHON","Lignin",6]
[192.06088529999997,0,0,0,0,0,0,0,0,0,0,880753,0,0,0,0,0,840403,0,191.053591,11,0,12,0,1,0,0,0,1,0,0,0,0,0,0,0,0,null,192.06088529999997,{"$nulls":3},6,0.09090909090909091,1.0909090909090908,0,0.09090909090909091,0,0,0,0,0.47368421052631576,-0.7272727272727273,1.0909090909090908,5,0.5454545454545454,"C11H12O1S1","O1S1","CHOS","UnsatHydrocar",7]
[192.0633876,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,837716,0,191.05611157142857,7,0,12,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,192.0633876,{"$nulls":3},2,0.8571428571428571,1.7142857142857142,0,0,0,0,0,0,0,0,1.7142857142857142,-4,0.2857142857142857,"C7H12O6","O6","CHO","Carbohydrates",1]
[192.07864379999998,9526788.000000002,8545905,8164054,9391900,8148935,11896430.000000002,8429029,10732436,10730022.999999998,9091325,7839992,7973230,9702825,8476004,12679153,7841707,10531417,10080612,191.07137600000004,11,0,12,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,192.07864379999998,{"$nulls":3},6,0.2727272727272727,1.0909090909090908,0,0,0,0,0,0,0.47368421052631576,-0.5454545454545454,1.0909090909090908,3,0.5454545454545454,"C11H12O3","O3","CHO","Lignin",6]
[192.08201449999999,0,0,0,0,0,976713,0,1165589,0,0,0,0,0,0,951612,0,0,0,191.07474833333333,8,0,16,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,192.08201449999999,{"$nulls":3},1,0.375,2,0,0.125,0,0,0,0,0,-1,2,-2,0.125,"C8H16O3S1","O3S1","CHOS","N-FreeSatCom",4]
[192.0898772,1370760,978933,933209,1121568,1063115,0,1119081,0,1614891,903041,1295995,1711729,1516461,0,1740607.0000000002,0,1446237,1632104,191.08261553846154,10,0,12,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,192.0898772,{"$nulls":3},6,0.2,1.2,0.2,0,0,0,0,0,0.42857142857142855,-0.2,1.2,4,0.6,"C10H12O2N2","O2N2","CHON","Lignin",6]
[192.099773,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1466209,0,191.092516,8,0,16,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,192.099773,{"$nulls":3},1,0.625,2,0,0,0,0,0,0,0,-0.75,2,-4,0.125,"C8H16O5","O5","CHO","Aminosugars",2]
[192.1150292,5960720,6823995,4426978,5843753,5019604,4519637,9652143,7610255,7646270,7555314,7523806,5495162,8073528,7074869,7362060,6924214,7983529,7800724,191.10776533333333,12,0,16,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,192.1150292,{"$nulls":3},5,0.16666666666666666,1.3333333333333333,0,0,0,0,0,0,0.36363636363636365,-1,1.3333333333333333,3,0.4166666666666667,"C12H16O2","O2","CHO","Lignin",6]
[192.15141459999998,1064476,1078280.9999999998,0,1111093,0,0,1575933,924204,933952,818326,1032848,957063,0,1138301,853589.9999999999,1689794,1068147,1087359,191.14412294117648,13,0,20,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,192.15141459999998,{"$nulls":3},4,0.07692307692307693,1.5384615384615385,0,0,0,0,0,0,0.28,-1.3846153846153846,1.5384615384615385,3,0.3076923076923077,"C13H20O1","O1","CHO","N-FreeSatCom",4]
[193.0197489,0,0,0,1046874,0,1804305,0,0,973033,0,0,0,0,0,2299166,0,0,904638,192.0125177777778,9,0,7,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,193.0197489,{"$nulls":3},7,0.2222222222222222,0.7777777777777778,0.1111111111111111,0.1111111111111111,0,0,0,0,0.6666666666666666,0.2222222222222222,0.7777777777777778,5,0.7777777777777778,"C9H7O2N1S1","O2N1S1","CHONS","Lignin",6]
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[197.0436554,0,0,0,0,0,0,0,0,0,0,0,0,0,0,938207.0000000001,0,0,0,196.0365025,7,0,7,0,4,0,3,0,0,0,0,0,0,0,0,0,0,null,197.0436554,{"$nulls":3},6,0.5714285714285714,1,0.42857142857142855,0,0,0,0,0,0.5,1.4285714285714286,1,2,0.8571428571428571,"C7H7O4N3","O4N3","CHON","Lignin",6]
[197.05104889999998,0,0,0,0,0,816652,0,0,0,0,0,0,0,0,1736674.0000000002,0,0,0,196.04381214285715,9,0,11,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,197.05104889999998,{"$nulls":3},5,0.2222222222222222,1.2222222222222223,0.1111111111111111,0.1111111111111111,0,0,0,0,0.3333333333333333,-0.2222222222222222,1.2222222222222223,3,0.5555555555555556,"C9H11O2N1S1","O2N1S1","CHONS","Lignin",6]
[197.0688074,0,0,0,2256230,0,6688338,0,2935244,2985615,0,0,0,0,0,8473076.000000002,0,2716392,2767193,196.06153087499996,9,0,11,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,197.0688074,{"$nulls":3},5,0.4444444444444444,1.2222222222222223,0.1111111111111111,0,0,0,0,0,0.3333333333333333,0,1.2222222222222223,1,0.5555555555555556,"C9H11O4N1","O4N1","CHON","Lignin",6]
[197.08406359999998,0,828264,0,0,0,0,0,904400,1038740,0,0,0,0,0,0,0,0,0,196.07678140000002,13,0,11,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,197.08406359999998,{"$nulls":3},9,0.07692307692307693,0.8461538461538461,0.07692307692307693,0,0,0,0,0,0.6521739130434783,-0.46153846153846156,0.8461538461538461,8,0.6923076923076923,"C13H11O1N1","O1N1","CHON","UnsatHydrocar",7]
[197.1051928,1451822,1857645.9999999998,1788202,1181809,1886229,2866526,2266914,2150359,1357210,1580700,2114913,1743729,1614449,1848906,3255541,1779107,2213363,1472613,196.0979058235294,10,0,15,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,197.1051928,{"$nulls":3},4,0.3,1.5,0.1,0,0,0,0,0,0.2,-0.6,1.5,1,0.4,"C10H15O3N1","O3N1","CHON","Lignin",6]
[197.99867909999998,0,0,0,0,0,1713528,0,0,0,0,0,0,0,0,1886514,0,892688,0,196.99145183333334,8,0,6,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,197.99867909999998,{"$nulls":3},6,0.5,0.75,0,0.125,0,0,0,0,0.6,0.5,0.75,2,0.75,"C8H6O4S1","O4S1","CHOS","Lignin",6]
[198.0164376,1606714,2166128,3734079,1672835,2279206,3875198,1674418,2490343,2001077.0000000002,1263552,1365624,2074384.0000000002,1259780,1490914,4804408.000000001,824742,1332502,1697820,197.00915833333335,8,0,6,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,198.0164376,{"$nulls":3},6,0.75,0.75,0,0,0,0,0,0,0.6,0.75,0.75,0,0.75,"C8H6O6","O6","CHO","Tannins",5]
[198.027671,0,0,817474,1147142,1044265,1333633,0,981098.0000000001,1497016,0,0,0,1037191,1484518,1619900,919978,1151258,1649056,197.02039471428571,7,0,6,0,5,0,2,0,0,0,0,0,0,0,0,0,0,null,198.027671,{"$nulls":3},6,0.7142857142857143,0.8571428571428571,0.2857142857142857,0,0,0,0,0,0.6,1.4285714285714286,0.8571428571428571,1,0.8571428571428571,"C7H6O5N2","O5N2","CHON","Tannins",5]
[198.03506449999998,0,0,998596,0,1016747,3637636,0,0,0,948934,0,914069,0,0,4062783,1251243.9999999998,1208092,1019618,197.02779455555554,9,0,10,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,198.03506449999998,{"$nulls":3},5,0.3333333333333333,1.1111111111111112,0,0.1111111111111111,0,0,0,0,0.38461538461538464,-0.2222222222222222,1.1111111111111112,2,0.5555555555555556,"C9H10O3S1","O3S1","CHOS","Lignin",6]
[198.052823,4519236,4002170,4744778,4202382,3920177,15248970,3870525,5334769,5447616,3665355,3592835,4062747,4351759,4099822,16284137,3186609,5130274,5371304,197.04553826315788,9,0,10,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,198.052823,{"$nulls":3},5,0.5555555555555556,1.1111111111111112,0,0,0,0,0,0,0.38461538461538464,0,1.1111111111111112,0,0.5555555555555556,"C9H10O5","O5","CHO","Lignin",6]
[198.0640564,0,0,0,0,0,1555085,0,0,1142212,0,0,0,0,864113,1627081,0,0,0,197.056774,8,0,10,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,198.0640564,{"$nulls":3},5,0.5,1.25,0.25,0,0,0,0,0,0.25,0.5,1.25,1,0.625,"C8H10O4N2","O4N2","CHON","Lignin",6]
[198.0714499,0,1575423,0,0,0,1741967,0,958583,0,0,1484681,1379361,0,0,1756875,0,1049511,0,197.06420742857148,10,0,14,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,198.0714499,{"$nulls":3},4,0.2,1.4,0,0.1,0,0,0,0,0.25,-0.8,1.4,2,0.4,"C10H14O2S1","O2S1","CHOS","Lignin",6]
[198.08920840000002,9748798,8988063,6059605,7630489,6765372,30429792,12391733,13536541,13264328,10597930,8889032,7287079,9270364,9736225,36889603,10465933,15628181,11215610,197.0819321333333,10,0,14,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,198.08920840000002,{"$nulls":3},4,0.4,1.4,0,0,0,0,0,0,0.25,-0.6,1.4,0,0.4,"C10H14O4","O4","CHO","Lignin",6]
[198.1004418,0,0,0,0,0,819224,0,0,0,0,0,0,0,0,0,0,0,0,197.093147,9,0,14,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,198.1004418,{"$nulls":3},4,0.3333333333333333,1.5555555555555556,0.2222222222222222,0,0,0,0,0,0.09090909090909091,-0.2222222222222222,1.5555555555555556,1,0.4444444444444444,"C9H14O3N2","O3N2","CHON","N-ConSatCom",3]
[198.1044646,0,0,0,1461917,0,0,0,0,0,2041052,0,0,0,0,0,0,0,0,197.0972825,14,0,14,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,198.1044646,{"$nulls":3},8,0.07142857142857142,1,0,0,0,0,0,0,0.5555555555555556,-0.8571428571428571,1,7,0.5714285714285714,"C14H14O1","O1","CHO","UnsatHydrocar",7]
[198.1255938,3120474,3452815,2243679,2561443,3151942,6987168,6136147,5357319,2426711,3575522,3230873,3036210,2702117,3108612,9814044,4229829,5504057,2799809,197.11831623529412,11,0,18,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,198.1255938,{"$nulls":3},3,0.2727272727272727,1.6363636363636365,0,0,0,0,0,0,0.15789473684210525,-1.0909090909090908,1.6363636363636365,0,0.2727272727272727,"C11H18O3","O3","CHO","N-FreeSatCom",4]
[198.1368272,0,0,0,0,0,981668,0,0,0,0,0,0,0,0,1025122,0,0,0,197.12951,10,0,18,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,198.1368272,{"$nulls":3},3,0.2,1.8,0.2,0,0,0,0,0,0,-0.8,1.8,1,0.3,"C10H18O2N2","O2N2","CHON","N-ConSatCom",3]
[198.1619792,0,0,0,0,0,0,0,1253393,0,0,0,0,0,0,846955,0,1060868,0,197.15474999999998,12,0,22,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,198.1619792,{"$nulls":3},2,0.16666666666666666,1.8333333333333333,0,0,0,0,0,0,0.09090909090909091,-1.5,1.8333333333333333,0,0.16666666666666666,"C12H22O2","O2","CHO","N-FreeSatCom",4]
[199.0116866,0,0,0,0,0,0,0,0,0,0,0,0,0,0,882964.9999999999,0,0,0,198.0043958,7,0,5,0,6,0,1,0,0,0,0,0,0,0,0,0,0,null,199.0116866,{"$nulls":3},6,0.8571428571428571,0.7142857142857143,0.14285714285714285,0,0,0,0,0,0.6666666666666666,1.4285714285714286,0.7142857142857143,0,0.8571428571428571,"C7H5O6N1","O6N1","CHON","Tannins",5]
[199.03031349999998,0,0,0,0,0,1725625,0,0,0,0,0,0,0,0,2471579,0,0,0,198.0230628,8,0,9,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,199.03031349999998,{"$nulls":3},5,0.375,1.125,0.125,0.125,0,0,0,0,0.3333333333333333,0.25,1.125,2,0.625,"C8H9O3N1S1","O3N1S1","CHONS","Lignin",6]
[199.048072,0,1256590,0,1247155,1205461,2897087,0,1197844,1555951,0,0,0,1073589,0,2780834,0,1310298,1428215,198.04078249999998,8,0,9,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,199.048072,{"$nulls":3},5,0.625,1.125,0.125,0,0,0,0,0,0.3333333333333333,0.5,1.125,0,0.625,"C8H9O5N1","O5N1","CHON","Lignin",6]
[199.0633282,0,0,0,2257591,1527897,1829187,0,1954840,2499315.9999999995,0,0,1986388,2168760.9999999995,0,2230951,1123658,1984351,2085628,198.05605341666669,12,0,9,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,199.0633282,{"$nulls":3},9,0.16666666666666666,0.75,0.08333333333333333,0,0,0,0,0,0.7,-0.16666666666666666,0.75,7,0.75,"C12H9O2N1","O2N1","CHON","Lignin",6]
[199.06669889999998,0,0,0,0,0,969156,0,0,0,0,0,0,0,0,1098152,0,0,0,198.059397,9,0,13,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,199.06669889999998,{"$nulls":3},4,0.2222222222222222,1.4444444444444444,0.1111111111111111,0.1111111111111111,0,0,0,0,0.16666666666666666,-0.4444444444444444,1.4444444444444444,2,0.4444444444444444,"C9H13O2N1S1","O2N1S1","CHONS","Lignin",6]
[199.0844574,1258349,0,0,1557693,1302367,5685962,1459562,0,1807866,1534352,0,1558619,1410752,904357,6067374,0,1925221,1640067,198.07718615384616,9,0,13,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,199.0844574,{"$nulls":3},4,0.4444444444444444,1.4444444444444444,0.1111111111111111,0,0,0,0,0,0.16666666666666666,-0.2222222222222222,1.4444444444444444,0,0.4444444444444444,"C9H13O4N1","O4N1","CHON","Lignin",6]
[199.09971359999997,831025,0,0,846402,1303652,0,0,1036195,1059711,0,1099197,0,1163460.0000000002,0,0,0,1540714,0,198.09242488888887,13,0,13,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,199.09971359999997,{"$nulls":3},8,0.07692307692307693,1,0.07692307692307693,0,0,0,0,0,0.5652173913043478,-0.6153846153846154,1,7,0.6153846153846154,"C13H13O1N1","O1N1","CHON","UnsatHydrocar",7]
[199.1208428,0,897250,856839,0,0,1105877,1016181,0,0,842651,922115,0,0,0,1342651,992602,0,961807,198.11357946666666,10,0,17,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,199.1208428,{"$nulls":3},3,0.3,1.7,0.1,0,0,0,0,0,0.06666666666666667,-0.8,1.7,0,0.3,"C10H17O3N1","O3N1","CHON","N-ConSatCom",3]
[199.9965706,0,0,0,0,0,867936.0000000001,0,0,0,0,0,0,0,0,1044714.0000000001,0,0,0,198.98922449999998,8,0,8,0,2,0,0,0,2,0,0,0,0,0,0,0,0,null,199.9965706,{"$nulls":3},5,0.25,1,0,0.25,0,0,0,0,0.4,0,1,3,0.625,"C8H8O2S2","O2S2","CHOS","Lignin",6]
[200.0143291,0,0,999435,905290,825194,5216742,0,900648,0,1024944.0000000001,0,0,0,1084090,4967921,0,1354500,1126967,199.00707817647057,8,0,8,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,200.0143291,{"$nulls":3},5,0.5,1,0,0.125,0,0,0,0,0.4,0.25,1,1,0.625,"C8H8O4S1","O4S1","CHOS","Lignin",6]
[200.0320876,0,963609,1365648,1483471,1047982.9999999999,2631147,1336954,1606956.9999999998,1096726,1364021,1018830,1388924,1108242,1265727,2173430,0,1655562,1164477,199.0247979,8,0,8,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,200.0320876,{"$nulls":3},5,0.75,1,0,0,0,0,0,0,0.4,0.5,1,-1,0.625,"C8H8O6","O6","CHO","Tannins",5]
[200.0473438,0,2771357,0,3519187,0,2812656,0,3336242,2966298,0,2522833.9999999995,3114624,2741335,2438723,2505212,0,2922639,2709314,199.04007825,12,0,8,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,200.0473438,{"$nulls":3},9,0.25,0.6666666666666666,0,0,0,0,0,0,0.7142857142857143,-0.16666666666666666,0.6666666666666666,6,0.75,"C12H8O3","O3","CHO","ConAroStru",8]
[200.0507145,915741,2712734,3955606,0,2219125,2823409,10635134.999999998,1495347,0,0,2916051,4068225,0,0,2850301,9922107.000000002,0,0,199.04343699999998,9,0,12,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,200.0507145,{"$nulls":3},4,0.3333333333333333,1.3333333333333333,0,0.1111111111111111,0,0,0,0,0.23076923076923078,-0.4444444444444444,1.3333333333333333,1,0.4444444444444444,"C9H12O3S1","O3S1","CHOS","Lignin",6]
[200.0585772,0,0,0,0,0,0,0,879413,1545758,0,0,0,0,0,1331200,0,0,1173638,199.05134299999997,11,0,8,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,200.0585772,{"$nulls":3},9,0.18181818181818182,0.7272727272727273,0.18181818181818182,0,0,0,0,0,0.75,0.18181818181818182,0.7272727272727273,7,0.8181818181818182,"C11H8O2N2","O2N2","CHON","Lignin",6]
[200.068473,5118850.999999999,4288931,4018843,5386969,4109690,23630617,5359492,7206712,7947297,5609281,3907033,4649351,4458845,5439818,24455517,4326364,8210581,6515273,199.06118725000002,9,0,12,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,200.068473,{"$nulls":3},4,0.5555555555555556,1.3333333333333333,0,0,0,0,0,0,0.23076923076923078,-0.2222222222222222,1.3333333333333333,-1,0.4444444444444444,"C9H12O5","O5","CHO","Lignin",6]
[200.0797064,0,0,0,0,0,1313273,0,0,0,0,0,0,0,0,1068167,0,0,813517,199.072424,8,0,12,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,200.0797064,{"$nulls":3},4,0.5,1.5,0.25,0,0,0,0,0,0,0.25,1.5,0,0.5,"C8H12O4N2","O4N2","CHON","Lignin",6]
[200.0837292,0,6085015,5131935.999999999,4759773,4896638,2894843,0,5985084,3933221,0,0,7519683,4992865,6405569,3241224,0,5678746,3878478,199.07646014285712,13,0,12,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,200.0837292,{"$nulls":3},8,0.15384615384615385,0.9230769230769231,0,0,0,0,0,0,0.5833333333333334,-0.6153846153846154,0.9230769230769231,6,0.6153846153846154,"C13H12O2","O2","CHO","Lignin",6]
[200.0870999,0,0,0,0,0,0,835114,0,0,0,1022686,0,0,0,912393,0,0,0,199.07982800000002,10,0,16,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,200.0870999,{"$nulls":3},3,0.2,1.6,0,0.1,0,0,0,0,0.125,-1,1.6,1,0.3,"C10H16O2S1","O2S1","CHOS","N-FreeSatCom",4]
[200.1048584,4421005,3955627.9999999995,3380902,3527395,4129156,26503725,7672695,11967517,6151723,6408012,4347618.999999999,4161426,3986023,6373716,32286327,6215910,12947953,5424213,199.09757944444445,10,0,16,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,200.1048584,{"$nulls":3},3,0.4,1.6,0,0,0,0,0,0,0.125,-0.8,1.6,-1,0.3,"C10H16O4","O4","CHO","N-FreeSatCom",4]
[200.1201146,1255313,1441072,1296681.9999999998,1520744,1390952,0,1828499,1495878,1039920,1468753,1909096,1653782,1704940,1364313,0,1588202,1930149,1416538,199.11281961111112,14,0,16,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,200.1201146,{"$nulls":3},7,0.07142857142857142,1.1428571428571428,0,0,0,0,0,0,0.48148148148148145,-1,1.1428571428571428,6,0.5,"C14H16O1","O1","CHO","UnsatHydrocar",7]
[200.14124379999998,0,872758,0,0,0,2400012,1007737,1580876,0,0,836462,0,0,818015,2972700,0,1579051,0,199.1339851538461,11,0,20,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,200.14124379999998,{"$nulls":3},2,0.2727272727272727,1.8181818181818181,0,0,0,0,0,0,0.05263157894736842,-1.2727272727272727,1.8181818181818181,-1,0.18181818181818182,"C11H20O3","O3","CHO","N-FreeSatCom",4]
[201.0095781,0,0,0,0,0,1415440,0,0,0,0,0,0,0,0,1606213,0,0,0,200.00227766666669,7,0,7,0,4,0,1,0,1,0,0,0,0,0,0,0,0,null,201.0095781,{"$nulls":3},5,0.5714285714285714,1,0.14285714285714285,0.14285714285714285,0,0,0,0,0.3333333333333333,0.8571428571428571,1,1,0.7142857142857143,"C7H7O4N1S1","O4N1S1","CHONS","Lignin",6]
[201.0425928,0,0,1212850,0,0,1774874,0,1472329,2384446.9999999995,0,0,1071403,1357938,1298022,2120785,0,0,1675911,200.03530911111113,11,0,7,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,201.0425928,{"$nulls":3},9,0.2727272727272727,0.6363636363636364,0.09090909090909091,0,0,0,0,0,0.7647058823529411,0.18181818181818182,0.6363636363636364,6,0.8181818181818182,"C11H7O3N1","O3N1","CHON","ConAroStru",8]
[201.04596349999997,0,0,0,0,0,1980699,0,0,0,0,0,0,0,0,1905490,0,0,0,200.03869633333332,8,0,11,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,201.04596349999997,{"$nulls":3},4,0.375,1.375,0.125,0.125,0,0,0,0,0.1111111111111111,0,1.375,1,0.5,"C8H11O3N1S1","O3N1S1","CHONS","Lignin",6]
[201.06372199999998,0,0,0,904818,0,1450272,0,919246,901701,0,0,0,0,0,1799768.0000000002,0,0,852686,200.05641633333335,8,0,11,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,201.06372199999998,{"$nulls":3},4,0.625,1.375,0.125,0,0,0,0,0,0.1111111111111111,0.25,1.375,-1,0.5,"C8H11O5N1","O5N1","CHON","Lignin",6]
[201.0789782,2595994,2913966,3213500,2757878,2786710,2260517,2475680.0000000005,3376723,2614345,2372469,2781435,3735734,3301245,3273841,2532957,2055018,3345608,3177875,200.07170666666664,12,0,11,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,201.0789782,{"$nulls":3},8,0.16666666666666666,0.9166666666666666,0.08333333333333333,0,0,0,0,0,0.6,-0.3333333333333333,0.9166666666666666,6,0.6666666666666666,"C12H11O2N1","O2N1","CHON","Lignin",6]
[201.10010739999998,0,0,0,0,0,2501931,0,1205721,0,0,0,0,0,0,2518628,976496,1195854,0,200.0928351,9,0,15,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,201.10010739999998,{"$nulls":3},3,0.4444444444444444,1.6666666666666667,0.1111111111111111,0,0,0,0,0,0,-0.4444444444444444,1.6666666666666667,-1,0.3333333333333333,"C9H15O4N1","O4N1","CHON","N-ConSatCom",3]
[201.1153636,0,1031096,0,942720,0,0,1057066,881629,0,904320,1417221,0,1038983,0,0,0,1085523,899359,200.10808764285713,13,0,15,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,201.1153636,{"$nulls":3},7,0.07692307692307693,1.1538461538461537,0.07692307692307693,0,0,0,0,0,0.4782608695652174,-0.7692307692307693,1.1538461538461537,6,0.5384615384615384,"C13H15O1N1","O1N1","CHON","UnsatHydrocar",7]
[201.9935937,0,0,0,0,0,0,0,0,0,0,0,0,0,0,977939,0,0,0,200.9863365,7,0,6,0,5,0,0,0,1,0,0,0,0,0,0,0,0,null,201.9935937,{"$nulls":3},5,0.7142857142857143,0.8571428571428571,0,0.14285714285714285,0,0,0,0,0.42857142857142855,0.8571428571428571,0.8571428571428571,0,0.7142857142857143,"C7H6O5S1","O5S1","CHOS","Tannins",5]
[202.0122206,0,0,0,0,0,1171768,0,0,0,0,0,0,0,0,887321,0,0,0,201.004911,8,0,10,0,2,0,0,0,2,0,0,0,0,0,0,0,0,null,202.0122206,{"$nulls":3},4,0.25,1.25,0,0.25,0,0,0,0,0.2,-0.25,1.25,2,0.5,"C8H10O2S2","O2S2","CHOS","Lignin",6]
[202.02660840000001,1841562,1166500,2673095.0000000005,2265980.0000000005,2067099,2392380,1301158,2364503,2069594.9999999998,1758353,1381510,1765838,1703814,1675649,3494814,923107,1613028,1896389,201.01934029411763,11,0,6,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,202.02660840000001,{"$nulls":3},9,0.36363636363636365,0.5454545454545454,0,0,0,0,0,0,0.7777777777777778,0.18181818181818182,0.5454545454545454,5,0.8181818181818182,"C11H6O4","O4","CHO","ConAroStru",8]
[202.0299791,0,0,0,0,0,3878716.9999999995,0,0,0,0,0,0,0,0,4198047.000000001,0,1226341,0,201.02273480000002,8,0,10,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,202.0299791,{"$nulls":3},4,0.5,1.25,0,0.125,0,0,0,0,0.2,0,1.25,0,0.5,"C8H10O4S1","O4S1","CHOS","Lignin",6]
[202.0378418,0,0,0,0,0,815679.0000000001,0,0,1001438,0,0,0,0,0,1132194,0,0,0,201.0306016,10,0,6,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,202.0378418,{"$nulls":3},9,0.3,0.6,0.2,0,0,0,0,0,0.8461538461538461,0.6,0.6,6,0.9,"C10H6O3N2","O3N2","CHON","ConAroStru",8]
[202.0477376,1306016,1305385,1202636,1511938,1206433,3747394,1479851,1439069,1449313,0,1113868,860372,1433356,1281799,3673765,1286376,1345386,1495243,201.0404591111111,8,0,10,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,202.0477376,{"$nulls":3},4,0.75,1.25,0,0,0,0,0,0,0.2,0.25,1.25,-2,0.5,"C8H10O6","O6","CHO","Tannins",5]
[202.0629938,7989330,7920472,10501559,7474950,9138009,8090544,7023343,9653456,8380136,7005596,7406864,9533142,9141172,8795825,9017253,4675819.999999999,10078212,8011105,201.05571168421054,12,0,10,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,202.0629938,{"$nulls":3},8,0.25,0.8333333333333334,0,0,0,0,0,0,0.6190476190476191,-0.3333333333333333,0.8333333333333334,5,0.6666666666666666,"C12H10O3","O3","CHO","Lignin",6]
[202.0663645,0,907758.0000000001,0,0,0,1739464,0,1030626,0,0,1297169,0,0,0,1671083,0,1302256,0,201.059073,9,0,14,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,202.0663645,{"$nulls":3},3,0.3333333333333333,1.5555555555555556,0,0.1111111111111111,0,0,0,0,0.07692307692307693,-0.6666666666666666,1.5555555555555556,0,0.3333333333333333,"C9H14O3S1","O3S1","CHOS","N-FreeSatCom",4]
[202.0742272,1021863.0000000001,0,1512916,1806857.0000000002,1338536,1879114,886835,1686884,1666025,1078175,1362963,1247964,1510675,1149966,2610350,0,1520626,1962835.9999999998,201.0669626428571,11,0,10,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,202.0742272,{"$nulls":3},8,0.18181818181818182,0.9090909090909091,0.18181818181818182,0,0,0,0,0,0.625,0,0.9090909090909091,6,0.7272727272727273,"C11H10O2N2","O2N2","CHON","Lignin",6]
[202.084123,2859178,2203314,2746583,2553612,2407083,19168955,2937269,5525863,4463212,3921826,2743830,2312415,2011286,4339601,20689556,2928626,6528757,3211223,201.07686437499999,9,0,14,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,202.084123,{"$nulls":3},3,0.5555555555555556,1.5555555555555556,0,0,0,0,0,0,0.07692307692307693,-0.4444444444444444,1.5555555555555556,-2,0.3333333333333333,"C9H14O5","O5","CHO","Aminosugars",2]
[202.09937920000002,6740198,6667702,7070667,6400431,7054349,3099985,8023427,8245348,6940541,7380790,9010377,8731820,7323336,7693125,3123895,4839158,8382107,5199580,201.09211674999997,13,0,14,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,202.09937920000002,{"$nulls":3},7,0.15384615384615385,1.0769230769230769,0,0,0,0,0,0,0.5,-0.7692307692307693,1.0769230769230769,5,0.5384615384615384,"C13H14O2","O2","CHO","Lignin",6]
[202.1205084,1416115,2212796,1693921,0,1479733,11552209,1672511,4167025,1461110,1621805,1953056,1255530,840352,2184090.9999999995,14142028,1959675,4707072,942755,201.1132392222222,10,0,18,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,202.1205084,{"$nulls":3},2,0.4,1.8,0,0,0,0,0,0,0,-1,1.8,-2,0.2,"C10H18O4","O4","CHO","N-FreeSatCom",4]
[202.1357646,1326135,1297471.9999999998,1116901,1191450,1456313,1017564,2139844,1573877,1550842,1355954,1231012,1462894,1729956,1596832,1282243,963775,1373700,1747688,201.1285093157895,14,0,18,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,202.1357646,{"$nulls":3},6,0.07142857142857142,1.2857142857142858,0,0,0,0,0,0,0.4074074074074074,-1.1428571428571428,1.2857142857142858,5,0.42857142857142855,"C14H18O1","O1","CHO","UnsatHydrocar",7]
[202.15689379999998,0,0,0,0,0,0,0,1084410,0,0,0,0,0,0,0,0,1049610,0,201.1496226666667,11,0,22,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,202.15689379999998,{"$nulls":3},1,0.2727272727272727,2,0,0,0,0,0,0,0,-1.4545454545454546,2,-2,0.09090909090909091,"C11H22O3","O3","CHO","N-FreeSatCom",4]
[203.0218574,0,0,971994,0,0,852188,0,0,879478,0,0,0,0,0,1066476,0,0,999169,202.01457418181818,10,0,5,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,203.0218574,{"$nulls":3},9,0.4,0.5,0.1,0,0,0,0,0,0.8571428571428571,0.6,0.5,5,0.9,"C10H5O4N1","O4N1","CHON","ConAroStru",8]
[203.0252281,0,0,0,0,0,1009629,0,0,0,0,0,0,0,0,1066349,0,0,0,202.017981,7,0,9,0,4,0,1,0,1,0,0,0,0,0,0,0,0,null,203.0252281,{"$nulls":3},4,0.5714285714285714,1.2857142857142858,0.14285714285714285,0.14285714285714285,0,0,0,0,0,0.5714285714285714,1.2857142857142858,0,0.5714285714285714,"C7H9O4N1S1","O4N1S1","CHONS","Lignin",6]
[203.0582428,2891948,2640553,3939812,3882515,3255474,5940583,2403005,4854381,4604287.999999999,3080898,2832931,3808507,3957922,3041955.9999999995,7332344.000000001,2008300,4017684,4587532.999999999,202.05097888235295,11,0,9,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,203.0582428,{"$nulls":3},8,0.2727272727272727,0.8181818181818182,0.09090909090909091,0,0,0,0,0,0.6470588235294118,0,0.8181818181818182,5,0.7272727272727273,"C11H9O3N1","O3N1","CHON","Lignin",6]
[203.0616135,0,0,0,0,0,1369192,0,0,0,0,0,0,0,0,1193721,0,0,0,202.0543295,8,0,13,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,203.0616135,{"$nulls":3},3,0.375,1.625,0.125,0.125,0,0,0,0,0,-0.25,1.625,0,0.375,"C8H13O3N1S1","O3N1S1","CHONS","N-ConSatCom",3]
[203.079372,0,0,0,0,0,984173,0,0,0,0,0,0,0,0,1045071,0,0,0,202.07210874999998,8,0,13,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,203.079372,{"$nulls":3},3,0.625,1.625,0.125,0,0,0,0,0,0,0,1.625,-2,0.375,"C8H13O5N1","O5N1","CHON","Aminosugars",2]
[203.0946282,2648246,3202995,3062766,3122717,3234748,1999985,2997959,4073079,2730634,2135885,3592237,3505414,3198892,3688110,2614019.9999999995,2912757,3370527,3522585,202.08736216666668,12,0,13,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,203.0946282,{"$nulls":3},7,0.16666666666666666,1.0833333333333333,0.08333333333333333,0,0,0,0,0,0.5,-0.5,1.0833333333333333,5,0.5833333333333334,"C12H13O2N1","O2N1","CHON","Lignin",6]
[203.1157574,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1016842.9999999999,0,0,0,202.108514,9,0,17,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,203.1157574,{"$nulls":3},2,0.4444444444444444,1.8888888888888888,0.1111111111111111,0,0,0,0,0,0,-0.6666666666666666,1.8888888888888888,-2,0.2222222222222222,"C9H17O4N1","O4N1","CHON","N-ConSatCom",3]
[203.1310136,967871,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,839977,0,202.12377149999998,13,0,17,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,203.1310136,{"$nulls":3},6,0.07692307692307693,1.3076923076923077,0.07692307692307693,0,0,0,0,0,0.391304347826087,-0.9230769230769231,1.3076923076923077,5,0.46153846153846156,"C13H17O1N1","O1N1","CHON","UnsatHydrocar",7]
[204.005873,0,0,0,0,0,0,0,0,1055369.0000000002,0,0,0,0,0,1393715,0,0,0,202.99860385714285,10,0,4,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,204.005873,{"$nulls":3},9,0.5,0.4,0,0,0,0,0,0,0.8666666666666667,0.6,0.4,4,0.9,"C10H4O5","O5","CHO","ConAroStru",8]
[204.00924369999998,0,0,0,0,0,2258806,0,0,0,0,0,0,0,0,1767092,0,0,0,203.002019,7,0,8,0,5,0,0,0,1,0,0,0,0,0,0,0,0,null,204.00924369999998,{"$nulls":3},4,0.7142857142857143,1.1428571428571428,0,0.14285714285714285,0,0,0,0,0.14285714285714285,0.5714285714285714,1.1428571428571428,-1,0.5714285714285714,"C7H8O5S1","O5S1","CHOS","Tannins",5]
[204.0244999,0,0,0,0,0,909242,0,0,0,0,0,0,0,0,1123769,0,0,0,203.0172614,11,0,8,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,204.0244999,{"$nulls":3},8,0.18181818181818182,0.7272727272727273,0,0.09090909090909091,0,0,0,0,0.6666666666666666,-0.18181818181818182,0.7272727272727273,6,0.7272727272727273,"C11H8O2S1","O2S1","CHOS","Lignin",6]
[204.0270022,0,0,0,0,0,844667.0000000001,0,0,0,0,0,0,0,0,999353,0,0,0,203.0197108,7,0,8,0,7,0,0,0,0,0,0,0,0,0,0,0,0,null,204.0270022,{"$nulls":3},4,1,1.1428571428571428,0,0,0,0,0,0,0.14285714285714285,0.8571428571428571,1.1428571428571428,-3,0.5714285714285714,"C7H8O7","O7","CHO","Tannins",5]
[204.0422584,6312877,7074718,10667246.999999998,8047897,7510455,14850072,5577155,10166642,8149139,6322145,5861166,8594454,6667180,6373814,18476742,5007076,8475954,7863618,203.03499105555557,11,0,8,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,204.0422584,{"$nulls":3},8,0.36363636363636365,0.7272727272727273,0,0,0,0,0,0,0.6666666666666666,0,0.7272727272727273,4,0.7272727272727273,"C11H8O4","O4","CHO","Lignin",6]
[204.04562909999999,0,870175,0,0,0,5432448,0,0,0,941666,0,0,0,0,5744960,0,1075251,0,203.03836199999998,8,0,12,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,204.04562909999999,{"$nulls":3},3,0.5,1.5,0,0.125,0,0,0,0,0,-0.25,1.5,-1,0.375,"C8H12O4S1","O4S1","CHOS","Lignin",6]
[204.0534918,1525680,0,0,0,892857,3475587,0,1598453.0000000002,2778774,1341668,838449,0,0,1133881,4627266,0,1415733,2138438,203.0462311,10,0,8,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,204.0534918,{"$nulls":3},8,0.3,0.8,0.2,0,0,0,0,0,0.6923076923076923,0.4,0.8,5,0.8,"C10H8O3N2","O3N2","CHON","Lignin",6]
[204.0633876,0,0,0,979230,0,2001541,933833,1389687,0,0,0,0,0,824251,1879366,0,1408824,0,203.05611740000003,8,0,12,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,204.0633876,{"$nulls":3},3,0.75,1.5,0,0,0,0,0,0,0,0,1.5,-3,0.375,"C8H12O6","O6","CHO","Tannins",5]
[204.07864379999998,12100461,11721538,9863416,12584265,11848581,10291244,11345869,13632251,12311246,11859574,10287928,12851549,12501366,11598738,12133854,10186195,13983768,10095949,203.07136933333334,12,0,12,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,204.07864379999998,{"$nulls":3},7,0.25,1,0,0,0,0,0,0,0.5238095238095238,-0.5,1,4,0.5833333333333334,"C12H12O3","O3","CHO","Lignin",6]
[204.08201449999999,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1939532,0,0,0,203.074716,9,0,16,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,204.08201449999999,{"$nulls":3},2,0.3333333333333333,1.7777777777777777,0,0.1111111111111111,0,0,0,0,0,-0.8888888888888888,1.7777777777777777,-1,0.2222222222222222,"C9H16O3S1","O3S1","CHOS","N-FreeSatCom",4]
[204.0898772,1445561,1582506,1720315,1966117,1703875,1640717,0,1644926,1949088,1624559,1928763,0,1952953,1682371,2524238,1405680,2214720,2815313,203.0826044375,11,0,12,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,204.0898772,{"$nulls":3},7,0.18181818181818182,1.0909090909090908,0.18181818181818182,0,0,0,0,0,0.5,-0.18181818181818182,1.0909090909090908,5,0.6363636363636364,"C11H12O2N2","O2N2","CHON","Lignin",6]
[204.099773,950076,0,0,0,0,4368016,0,1906945,1081891,1060081.0000000002,0,0,0,1458629,4513618,0,1801026,0,203.09249953846154,9,0,16,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,204.099773,{"$nulls":3},2,0.5555555555555556,1.7777777777777777,0,0,0,0,0,0,0,-0.6666666666666666,1.7777777777777777,-3,0.2222222222222222,"C9H16O5","O5","CHO","Aminosugars",2]
[204.1150292,8020352,8721236,5379330,7656413,8323864,3277204,10755762,10121230,7763171,8393932,9551948.999999998,7782066,9296265,8366438,4165462.9999999995,8033510,10098221,8377449,203.10775699999996,13,0,16,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,204.1150292,{"$nulls":3},6,0.15384615384615385,1.2307692307692308,0,0,0,0,0,0,0.4166666666666667,-0.9230769230769231,1.2307692307692308,4,0.46153846153846156,"C13H16O2","O2","CHO","Lignin",6]
[204.1361584,0,0,0,0,0,1218458,0,0,0,0,0,0,0,0,1237214,0,0,0,203.128904,10,0,20,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,204.1361584,{"$nulls":3},1,0.4,2,0,0,0,0,0,0,0,-1.2,2,-3,0.1,"C10H20O4","O4","CHO","N-FreeSatCom",4]
[204.15141459999998,891081,1183929,1071884,1060789,864019,2017950,1920224,890638,1322674,999360,1006859,1278005,1177033,1609684,2352995,1017215,1001233,1564516,203.1441548888889,14,0,20,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,204.15141459999998,{"$nulls":3},5,0.07142857142857142,1.4285714285714286,0,0,0,0,0,0,0.3333333333333333,-1.2857142857142858,1.4285714285714286,4,0.35714285714285715,"C14H20O1","O1","CHO","UnsatHydrocar",7]
[205.0157261,0,0,0,0,0,0,0,0,0,0,0,0,908975,0,0,0,0,0,204.00843400000002,5,0,7,0,4,0,3,0,1,0,0,0,0,0,0,0,0,null,205.0157261,{"$nulls":3},4,0.8,1.4,0.6,0.2,0,0,0,0,0,2.4,1.4,0,0.8,"C5H7O4N3S1","O4N3S1","CHONS","Tannins",5]
[205.0197489,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1267200.0000000002,0,0,859825,204.01248825,10,0,7,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,205.0197489,{"$nulls":3},8,0.2,0.7,0.1,0.1,0,0,0,0,0.7142857142857143,0.2,0.7,6,0.8,"C10H7O2N1S1","O2N1S1","CHONS","Lignin",6]
[205.0375074,1871788,1987216,3294713,2941980,2234681,7734467,2337479,3839093,4253605,1878271,1621303,2888751.9999999995,2825909,2297030,8838354,2001115,3682383,3759735,204.0302313529412,10,0,7,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,205.0375074,{"$nulls":3},8,0.4,0.7,0.1,0,0,0,0,0,0.7142857142857143,0.4,0.7,4,0.8,"C10H7O4N1","O4N1","CHON","Lignin",6]
[205.0408781,0,0,0,0,0,987543,0,0,0,0,0,0,0,0,999687.0000000001,0,0,0,204.03359799999998,7,0,11,0,4,0,1,0,1,0,0,0,0,0,0,0,0,null,205.0408781,{"$nulls":3},3,0.5714285714285714,1.5714285714285714,0.14285714285714285,0.14285714285714285,0,0,0,0,0,0.2857142857142857,1.5714285714285714,-1,0.42857142857142855,"C7H11O4N1S1","O4N1S1","CHONS","Aminosugars",2]
[205.0487408,0,0,0,0,0,1131546,0,0,0,0,0,0,0,0,1165449,0,0,1017850,204.04144125,9,0,7,0,3,0,3,0,0,0,0,0,0,0,0,0,0,null,205.0487408,{"$nulls":3},8,0.3333333333333333,0.7777777777777778,0.3333333333333333,0,0,0,0,0,0.7777777777777778,0.8888888888888888,0.7777777777777778,5,0.8888888888888888,"C9H7O3N3","O3N3","CHON","Lignin",6]
[205.07389279999998,4336309.000000001,3886744.9999999995,4324866,6049317,4137666.9999999995,7793057,4671185,5652606,5700527,4153608.9999999995,4656193.000000001,4929851,5457087,4243664,9537642,3735524,5411930,5789314,204.06662006250002,11,0,11,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,205.07389279999998,{"$nulls":3},7,0.2727272727272727,1,0.09090909090909091,0,0,0,0,0,0.5294117647058824,-0.18181818181818182,1,4,0.6363636363636364,"C11H11O3N1","O3N1","CHON","Lignin",6]
[205.0851262,0,0,0,0,0,0,0,0,0,850956,0,0,0,0,0,0,0,0,204.0778485,10,0,11,0,2,0,3,0,0,0,0,0,0,0,0,0,0,null,205.0851262,{"$nulls":3},7,0.2,1.1,0.3,0,0,0,0,0,0.5,0.2,1.1,5,0.7,"C10H11O2N3","O2N3","CHON","Lignin",6]
[205.1102782,2731454,3058594,2527244,2651951,2851532,1790891,3196634,3605638.9999999995,2698425,2698772,3655242,3337029,3630792,3067098,2544798,2692589,3150948,2732685,204.10300460000002,12,0,15,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,205.1102782,{"$nulls":3},6,0.16666666666666666,1.25,0.08333333333333333,0,0,0,0,0,0.4,-0.6666666666666666,1.25,4,0.5,"C12H15O2N1","O2N1","CHON","Lignin",6]
[206.0037645,0,0,0,0,0,0,0,0,0,0,0,0,0,0,903616,0,0,0,204.9964878,10,0,6,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,206.0037645,{"$nulls":3},8,0.3,0.6,0,0.1,0,0,0,0,0.7333333333333333,0.2,0.6,5,0.8,"C10H6O3S1","O3S1","CHOS","ConAroStru",8]
[206.021523,4178852,4430204,7585531,4954904,4266421,9220447,3418053,7071600,4942511.999999999,3467798,3075896,5043268.000000001,3894199,3917775.9999999995,11466832,2465483,4481381,4510629,205.01424976470588,10,0,6,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,206.021523,{"$nulls":3},8,0.5,0.6,0,0,0,0,0,0,0.7333333333333333,0.4,0.6,3,0.8,"C10H6O5","O5","CHO","ConAroStru",8]
[206.02489369999998,0,0,0,0,0,2403750.9999999995,0,0,0,0,0,0,0,0,2231495,0,0,0,205.01763275000002,7,0,10,0,5,0,0,0,1,0,0,0,0,0,0,0,0,null,206.02489369999998,{"$nulls":3},3,0.7142857142857143,1.4285714285714286,0,0.14285714285714285,0,0,0,0,0,0.2857142857142857,1.4285714285714286,-2,0.42857142857142855,"C7H10O5S1","O5S1","CHOS","Tannins",5]
[206.03275639999998,0,0,1279998.0000000002,0,0,2757802,0,0,1772211,0,0,0,0,0,3481290,0,0,1916840.0000000002,205.025501375,9,0,6,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,206.03275639999998,{"$nulls":3},8,0.4444444444444444,0.6666666666666666,0.2222222222222222,0,0,0,0,0,0.8,0.8888888888888888,0.6666666666666666,4,0.8888888888888888,"C9H6O4N2","O4N2","CHON","ConAroStru",8]
[206.0401499,906280,1087872,0,861468,1061305,1421612,998729,1111541,1062197,0,1421373,987849,1628860,0,1576140,0,1635434,0,205.03290806666666,11,0,10,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,206.0401499,{"$nulls":3},7,0.18181818181818182,0.9090909090909091,0,0.09090909090909091,0,0,0,0,0.5555555555555556,-0.36363636363636365,0.9090909090909091,5,0.6363636363636364,"C11H10O2S1","O2S1","CHOS","Lignin",6]
[206.0579084,9408941,8709508,12156677,12755006,9523134,26210930,8610254,14030713,12825728,9139744.000000002,8516930.000000002,10034766,10565055.999999998,10074585,29923559.999999996,6935252,13664111,10575792,205.05062453333338,11,0,10,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,206.0579084,{"$nulls":3},7,0.36363636363636365,0.9090909090909091,0,0,0,0,0,0,0.5555555555555556,-0.18181818181818182,0.9090909090909091,3,0.6363636363636364,"C11H10O4","O4","CHO","Lignin",6]
[206.06127909999998,0,0,0,0,0,4515505,0,0,0,0,0,0,0,0,4656083,0,0,0,205.05400600000002,8,0,14,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,206.06127909999998,{"$nulls":3},2,0.5,1.75,0,0.125,0,0,0,0,0,-0.5,1.75,-2,0.25,"C8H14O4S1","O4S1","CHOS","N-FreeSatCom",4]
[206.06914179999998,0,0,0,0,0,3428020,0,0,0,0,1281989,1539281,0,0,3452886,0,1732211,0,205.06186200000002,10,0,10,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,206.06914179999998,{"$nulls":3},7,0.3,1,0.2,0,0,0,0,0,0.5384615384615384,0.2,1,4,0.7,"C10H10O3N2","O3N2","CHON","Lignin",6]
[206.0765353,0,1185033,0,0,0,0,0,1080702,0,0,0,0,0,0,0,0,0,0,205.069281,12,0,14,0,1,0,0,0,1,0,0,0,0,0,0,0,0,null,206.0765353,{"$nulls":3},6,0.08333333333333333,1.1666666666666667,0,0.08333333333333333,0,0,0,0,0.42857142857142855,-0.8333333333333334,1.1666666666666667,5,0.5,"C12H14O1S1","O1S1","CHOS","UnsatHydrocar",7]
[206.0790376,0,0,0,0,0,0,0,0,0,0,0,0,0,0,964953,0,3298165,0,205.07177725000003,8,0,14,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,206.0790376,{"$nulls":3},2,0.75,1.75,0,0,0,0,0,0,0,-0.25,1.75,-4,0.25,"C8H14O6","O6","CHO","Carbohydrates",1]
[206.0942938,13875044,12127629,9856782,14052176,13290122,11361413,15398359,15695106,15583892,15659117,13019467,13658821,16050327,12367331,12676095,12391132,15177594,15233446,205.0870095625,12,0,14,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,206.0942938,{"$nulls":3},6,0.25,1.1666666666666667,0,0,0,0,0,0,0.42857142857142855,-0.6666666666666666,1.1666666666666667,3,0.5,"C12H14O3","O3","CHO","Lignin",6]
[206.09766449999998,0,0,0,0,0,941947,0,1041539,0,0,0,0,0,0,0,0,944763,0,205.09034259999999,9,0,18,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,206.09766449999998,{"$nulls":3},1,0.3333333333333333,2,0,0.1111111111111111,0,0,0,0,0,-1.1111111111111112,2,-2,0.1111111111111111,"C9H18O3S1","O3S1","CHOS","N-FreeSatCom",4]
[206.1055272,0,1458320,0,0,0,1051069,0,0,0,0,0,0,0,0,1392865,1149151,0,1845182,205.0982981666667,11,0,14,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,206.1055272,{"$nulls":3},6,0.18181818181818182,1.2727272727272727,0.18181818181818182,0,0,0,0,0,0.375,-0.36363636363636365,1.2727272727272727,4,0.5454545454545454,"C11H14O2N2","O2N2","CHON","Lignin",6]
[206.115423,0,0,0,0,0,0,0,1144200,0,0,0,0,0,0,0,0,1480960,0,205.1081803333333,9,0,18,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,206.115423,{"$nulls":3},1,0.5555555555555556,2,0,0,0,0,0,0,0,-0.8888888888888888,2,-4,0.1111111111111111,"C9H18O5","O5","CHO","Aminosugars",2]
[206.1306792,6163062,5053334,3865368,5176627,4650961,4168388,8434751,5232012,7649447,6462594,5246805.000000001,4660834,7015721,5700325,4993002,5209829,7108895,6009798,205.1234076,13,0,18,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,206.1306792,{"$nulls":3},5,0.15384615384615385,1.3846153846153846,0,0,0,0,0,0,0.3333333333333333,-1.0769230769230769,1.3846153846153846,3,0.38461538461538464,"C13H18O2","O2","CHO","Lignin",6]
[206.16706459999997,1086024,901278,0,987324,0,1017933.9999999999,0,1403157,3730647,889663,1004126,1101676,1169245,1234935,1212789,1064302,1869198,3305425,205.1598032352941,14,0,22,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,206.16706459999997,{"$nulls":3},4,0.07142857142857142,1.5714285714285714,0,0,0,0,0,0,0.25925925925925924,-1.4285714285714286,1.5714285714285714,3,0.2857142857142857,"C14H22O1","O1","CHO","N-FreeSatCom",4]
[207.016772,0,0,1284604.9999999998,955410,1057455,2202037,0,1722987,1731002,0,0,0,1102264.0000000002,995801,3256584,0,953339,1461074,206.00950855555556,9,0,5,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,207.016772,{"$nulls":3},8,0.5555555555555556,0.5555555555555556,0.1111111111111111,0,0,0,0,0,0.8181818181818182,0.8888888888888888,0.5555555555555556,3,0.8888888888888888,"C9H5O5N1","O5N1","CHON","ConAroStru",8]
[207.0353989,0,999786,0,823318,0,1817274,0,0,0,0,0,0,1217213,0,2273294,0,943744,845144,206.02811507692306,10,0,9,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,207.0353989,{"$nulls":3},7,0.2,0.9,0.1,0.1,0,0,0,0,0.5714285714285714,0,0.9,5,0.7,"C10H9O2N1S1","O2N1S1","CHONS","Lignin",6]
[207.0531574,3082915,2942062,2766086,4037659,2810040,10566284,2502602,4498036,5683140,2426421.9999999995,2725954,2965857,3980482,2821858,12190439,2348482.0000000005,4477061,5211869,206.0458825882353,10,0,9,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,207.0531574,{"$nulls":3},7,0.4,0.9,0.1,0,0,0,0,0,0.5714285714285714,0.2,0.9,3,0.7,"C10H9O4N1","O4N1","CHON","Lignin",6]
[207.06439079999998,0,0,0,0,0,861122,0,0,0,0,0,0,0,0,0,0,0,0,206.057054,9,0,9,0,3,0,3,0,0,0,0,0,0,0,0,0,0,null,207.06439079999998,{"$nulls":3},7,0.3333333333333333,1,0.3333333333333333,0,0,0,0,0,0.5555555555555556,0.6666666666666666,1,4,0.7777777777777778,"C9H9O3N3","O3N3","CHON","Lignin",6]
[207.08954279999998,4028587.9999999995,5459062,4619280,5276708,4742337,6415519,5532883,7191026,5492174,4698945,5426251,5325163,5677771,4990188,6319359,4729803,7207858,5162216,206.08226057142855,11,0,13,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,207.08954279999998,{"$nulls":3},6,0.2727272727272727,1.1818181818181819,0.09090909090909091,0,0,0,0,0,0.4117647058823529,-0.36363636363636365,1.1818181818181819,3,0.5454545454545454,"C11H13O3N1","O3N1","CHON","Lignin",6]
[207.1259282,1733813,1499007,2885145,2462765,2108874,9883699,2413788.0000000005,1513990,1549527,1514826,1640020,3078261,3218644,2244341.9999999995,12116885,2077395,1757721,1550579,206.1186476,12,0,17,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,207.1259282,{"$nulls":3},5,0.16666666666666666,1.4166666666666667,0.08333333333333333,0,0,0,0,0,0.3,-0.8333333333333334,1.4166666666666667,3,0.4166666666666667,"C12H17O2N1","O2N1","CHON","Lignin",6]
[207.16231359999998,0,0,0,5086774,0,1069533.0000000002,0,0,0,0,0,0,6623931,0,1162166.0000000002,0,0,1037310,206.15507042857138,13,0,21,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,207.16231359999998,{"$nulls":3},4,0.07692307692307693,1.6153846153846154,0.07692307692307693,0,0,0,0,0,0.21739130434782608,-1.2307692307692308,1.6153846153846154,3,0.3076923076923077,"C13H21O1N1","O1N1","CHON","N-ConSatCom",3]
[207.98639980000002,0,0,0,0,0,1413306,0,0,0,0,0,0,0,0,1240126,0,0,0,206.97909199999998,6,0,8,0,4,0,0,0,2,0,0,0,0,0,0,0,0,null,207.98639980000002,{"$nulls":3},3,0.6666666666666666,1.3333333333333333,0,0.3333333333333333,0,0,0,0,0,0.6666666666666666,1.3333333333333333,-1,0.5,"C6H8O4S2","O4S2","CHOS","Lignin",6]
[208.0007876,1454218,1109064,1704568,1246469,1442338,2174654,0,1362143,1382206,976956,0,1163364,914099,988379,2450754,857762,1666186,1539577,206.99349568421053,9,0,4,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,208.0007876,{"$nulls":3},8,0.6666666666666666,0.4444444444444444,0,0,0,0,0,0,0.8333333333333334,0.8888888888888888,0.4444444444444444,2,0.8888888888888888,"C9H4O6","O6","CHO","ConAroStru",8]
[208.0041583,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1125060,0,0,0,206.9969115,6,0,8,0,6,0,0,0,1,0,0,0,0,0,0,0,0,null,208.0041583,{"$nulls":3},3,1,1.3333333333333333,0,0.16666666666666666,0,0,0,0,0,1,1.3333333333333333,-3,0.5,"C6H8O6S1","O6S1","CHOS","Tannins",5]
[208.01941449999998,2682766,1235916,1038589,1418249,2933158,3669699,1926843,2910051,1375170,4334657,1342006,1004392.9999999999,1728184,8201796,4477001,1667750,3006351,1562367,207.0121374375,10,0,8,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,208.01941449999998,{"$nulls":3},7,0.3,0.8,0,0.1,0,0,0,0,0.6,0,0.8,4,0.7,"C10H8O3S1","O3S1","CHOS","Lignin",6]
[208.02278520000002,0,0,0,0,0,1352644,0,0,0,0,0,0,0,0,1072457,0,0,0,207.015509,7,0,12,0,3,0,0,0,2,0,0,0,0,0,0,0,0,null,208.02278520000002,{"$nulls":3},2,0.42857142857142855,1.7142857142857142,0,0.2857142857142857,0,0,0,0,0,-0.2857142857142857,1.7142857142857142,-1,0.2857142857142857,"C7H12O3S2","O3S2","CHOS","N-FreeSatCom",4]
[208.037173,5338514.999999999,5636945,9599743,5994254,5950891,20303001,4858303.999999999,10336325,7447751,5338694.000000001,4409658.999999999,6187118,4645820,5699045,21328603,4074667,7814548,6354436,207.02987952631577,10,0,8,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,208.037173,{"$nulls":3},7,0.5,0.8,0,0,0,0,0,0,0.6,0.2,0.8,2,0.7,"C10H8O5","O5","CHO","Lignin",6]
[208.0405437,0,0,0,0,0,1675208,0,0,0,0,0,0,0,0,849742.9999999999,0,0,0,207.0332395,7,0,12,0,5,0,0,0,1,0,0,0,0,0,0,0,0,null,208.0405437,{"$nulls":3},2,0.7142857142857143,1.7142857142857142,0,0.14285714285714285,0,0,0,0,0,0,1.7142857142857142,-3,0.2857142857142857,"C7H12O5S1","O5S1","CHOS","Carbohydrates",1]
[208.0484064,0,0,0,896144,0,3193802.0000000005,0,0,0,0,0,1145969,0,0,2809426,0,0,0,207.04111125,9,0,8,0,4,0,2,0,0,0,0,0,0,0,0,0,0,null,208.0484064,{"$nulls":3},7,0.4444444444444444,0.8888888888888888,0.2222222222222222,0,0,0,0,0,0.6,0.6666666666666666,0.8888888888888888,3,0.7777777777777778,"C9H8O4N2","O4N2","CHON","Lignin",6]
[208.05579989999998,1008791,1478613,1397510,1287698,1220399,1202764,1336515.9999999998,1649004,0,1143499,1721663,1319027,1101889,1336041,963156.0000000001,1373103,2042777,0,207.04854305882353,11,0,12,0,2,0,0,0,1,0,0,0,0,0,0,0,0,null,208.05579989999998,{"$nulls":3},6,0.18181818181818182,1.0909090909090908,0,0.09090909090909091,0,0,0,0,0.4444444444444444,-0.5454545454545454,1.0909090909090908,4,0.5454545454545454,"C11H12O2S1","O2S1","CHOS","Lignin",6]
[208.0735584,11933595,10272601,11495691,14005025,10371507,23583149,12324808,16683479,16445478,12947634,11685633,10216567,14009991,12054510,25451506,9535667.000000002,16755405,14468935,207.06628493333338,11,0,12,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,208.0735584,{"$nulls":3},6,0.36363636363636365,1.0909090909090908,0,0,0,0,0,0,0.4444444444444444,-0.36363636363636365,1.0909090909090908,2,0.5454545454545454,"C11H12O4","O4","CHO","Lignin",6]
[208.0769291,0,0,0,0,0,1399762,0,0,0,0,0,0,0,0,1181275,0,0,0,207.06967799999998,8,0,16,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,208.0769291,{"$nulls":3},1,0.5,2,0,0.125,0,0,0,0,0,-0.75,2,-3,0.125,"C8H16O4S1","O4S1","CHOS","N-FreeSatCom",4]
[208.08479179999998,0,1191003,0,0,1591478,2334675.9999999995,0,1547379,0,1529811,1181254,0,0,0,2844253,1016246.0000000001,0,0,207.077495375,10,0,12,0,3,0,2,0,0,0,0,0,0,0,0,0,0,null,208.08479179999998,{"$nulls":3},6,0.3,1.2,0.2,0,0,0,0,0,0.38461538461538464,0,1.2,3,0.6,"C10H12O3N2","O3N2","CHON","Lignin",6]
[208.08881459999998,0,0,971279,830490,0,0,0,0,851925,0,0,0,979977,0,0,0,1174178,0,207.08156244444447,15,0,12,0,1,0,0,0,0,0,0,0,0,0,0,0,0,null,208.08881459999998,{"$nulls":3},10,0.06666666666666667,0.8,0,0,0,0,0,0,0.6551724137931034,-0.6666666666666666,0.8,9,0.6666666666666666,"C15H12O1","O1","CHO","UnsatHydrocar",7]
[208.09468760000001,3947937.0000000005,828254,0,2009884,3660729,0,0,1285622,0,0,0,0,2433739,1887475,0,0,1332132,0,207.08738587500002,8,0,16,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,208.09468760000001,{"$nulls":3},1,0.75,2,0,0,0,0,0,0,0,-0.5,2,-5,0.125,"C8H16O6","O6","CHO","Carbohydrates",1]
[208.1099438,12716985,13641125,9978532,11924787,11848940,11828159,18815897,14661609,14202809,14319174,14321299,12461841,14599322,14090994,14149641,15318368,16364897,14331740,207.1026676875,12,0,16,0,3,0,0,0,0,0,0,0,0,0,0,0,0,null,208.1099438,{"$nulls":3},5,0.25,1.3333333333333333,0,0,0,0,0,0,0.3333333333333333,-0.8333333333333334,1.3333333333333333,2,0.4166666666666667,"C12H16O3","O3","CHO","Lignin",6]
[208.1211772,0,0,0,0,945471,0,0,952508,0,0,0,0,0,854138,1575785,0,0,0,207.113902125,11,0,16,0,2,0,2,0,0,0,0,0,0,0,0,0,0,null,208.1211772,{"$nulls":3},5,0.18181818181818182,1.4545454545454546,0.18181818181818182,0,0,0,0,0,0.25,-0.5454545454545454,1.4545454545454546,3,0.45454545454545453,"C11H16O2N2","O2N2","CHON","Lignin",6]
[208.1463292,2948525,2634088.9999999995,2207005,2110761,2470341,2661349,4219355,3349634.9999999995,3854052,2625379.9999999995,3005270,2525067,3098584,2840321,3303025,3599556,4277682,3956772,207.13905366666665,13,0,20,0,2,0,0,0,0,0,0,0,0,0,0,0,0,null,208.1463292,{"$nulls":3},4,0.15384615384615385,1.5384615384615385,0,0,0,0,0,0,0.25,-1.2307692307692308,1.5384615384615385,2,0.3076923076923077,"C13H20O2","O2","CHO","N-FreeSatCom",4]
[209.01466349999998,0,0,0,939707,0,3770314,0,917206.9999999999,1560517,0,0,0,0,0,5183877,0,905502,1275429,208.00737237500005,9,0,7,0,3,0,1,0,1,0,0,0,0,0,0,0,0,null,209.01466349999998,{"$nulls":3},7,0.3333333333333333,0.7777777777777778,0.1111111111111111,0.1111111111111111,0,0,0,0,0.6363636363636364,0.4444444444444444,0.7777777777777778,4,0.7777777777777778,"C9H7O3N1S1","O3N1S1","CHONS","Lignin",6]
[209.032422,941441,846898,1723644,1673728,1157404,5000655,890932,2218587,2549194,1329238,0,1407482,1626039,1811942,5781898,951122,1559971,2484523,208.02513512500002,9,0,7,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,209.032422,{"$nulls":3},7,0.5555555555555556,0.7777777777777778,0.1111111111111111,0,0,0,0,0,0.6363636363636364,0.6666666666666666,0.7777777777777778,2,0.7777777777777778,"C9H7O5N1","O5N1","CHON","Lignin",6]
[209.05104889999998,0,0,0,0,0,957267.9999999999,0,886751.0000000001,0,0,0,0,0,0,1241616,0,1010216,0,208.0437993636364,10,0,11,0,2,0,1,0,1,0,0,0,0,0,0,0,0,null,209.05104889999998,{"$nulls":3},6,0.2,1.1,0.1,0.1,0,0,0,0,0.42857142857142855,-0.2,1.1,4,0.6,"C10H11O2N1S1","O2N1S1","CHONS","Lignin",6]
[209.0688074,2963594,3133498,2994693,3484680,3094693,7888345,3149501,4289124.000000001,5161428,3291488,2860091,3088772,3791040,2877936,10062055,2475162,4222125,5319990,208.06153184615383,10,0,11,0,4,0,1,0,0,0,0,0,0,0,0,0,0,null,209.0688074,{"$nulls":3},6,0.4,1.1,0.1,0,0,0,0,0,0.42857142857142855,0,1.1,2,0.6,"C10H11O4N1","O4N1","CHON","Lignin",6]
[209.08004079999998,0,0,0,0,0,1592539,0,0,0,0,0,0,0,0,1381785,0,0,0,208.072748,9,0,11,0,3,0,3,0,0,0,0,0,0,0,0,0,0,null,209.08004079999998,{"$nulls":3},6,0.3333333333333333,1.2222222222222223,0.3333333333333333,0,0,0,0,0,0.3333333333333333,0.4444444444444444,1.2222222222222223,3,0.6666666666666666,"C9H11O3N3","O3N3","CHON","Lignin",6]
[209.08406359999998,0,0,0,823564,0,0,0,0,991447,0,0,0,0,0,0,0,889521,0,208.0767885,14,0,11,0,1,0,1,0,0,0,0,0,0,0,0,0,0,null,209.08406359999998,{"$nulls":3},10,0.07142857142857142,0.7857142857142857,0.07142857142857142,0,0,0,0,0,0.68,-0.42857142857142855,0.7857142857142857,9,0.7142857142857143,"C14H11O1N1","O1N1","CHON","UnsatHydrocar",7]
[209.1051928,3637907,3618882,3397134,3281937,4257966,4398562,4400838,4466285,3705309,3478377,4190276,3318669.9999999995,3738312.9999999995,3919097,5234593,3649443,4208823,3664704,208.0978944736842,11,0,15,0,3,0,1,0,0,0,0,0,0,0,0,0,0,null,209.1051928,{"$nulls":3},5,0.2727272727272727,1.3636363636363635,0.09090909090909091,0,0,0,0,0,0.29411764705882354,-0.5454545454545454,1.3636363636363635,2,0.45454545454545453,"C11H15O3N1","O3N1","CHON","Lignin",6]
[209.1415782,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,837547,0,0,208.13432966666667,12,0,19,0,2,0,1,0,0,0,0,0,0,0,0,0,0,null,209.1415782,{"$nulls":3},4,0.16666666666666666,1.5833333333333333,0.08333333333333333,0,0,0,0,0,0.2,-1,1.5833333333333333,2,0.3333333333333333,"C12H19O2N1","O2N1","CHON","N-ConSatCom",3]
[209.99867909999998,0,0,0,0,0,2741708,938015,0,0,0,0,0,0,0,3059899,0,0,0,208.99141366666666,9,0,6,0,4,0,0,0,1,0,0,0,0,0,0,0,0,null,209.99867909999998,{"$nulls":3},7,0.4444444444444444,0.6666666666666666,0,0.1111111111111111,0,0,0,0,0.6666666666666666,0.4444444444444444,0.6666666666666666,3,0.7777777777777778,"C9H6O4S1","O4S1","CHOS","ConAroStru",8]
[210.0020498,0,0,0,0,0,0,0,0,0,0,0,0,0,0,841659,0,0,0,208.994732,6,0,10,0,4,0,0,0,2,0,0,0,0,0,0,0,0,null,210.0020498,{"$nulls":3},2,0.6666666666666666,1.6666666666666667,0,0.3333333333333333,0,0,0,0,0,0.3333333333333333,1.6666666666666667,-2,0.3333333333333333,"C6H10O4S2","O4S2","CHOS","Aminosugars",2]
[210.00991249999998,0,0,0,0,0,904911,0,0,0,0,0,0,0,0,938942,0,0,0,209.00262700000002,8,0,6,0,3,0,2,0,1,0,0,0,0,0,0,0,0,null,210.00991249999998,{"$nulls":3},7,0.375,0.75,0.25,0.125,0,0,0,0,0.7142857142857143,1,0.75,4,0.875,"C8H6O3N2S1","O3N2S1","CHONS","Lignin",6]
[210.0164376,2304618,2165518.0000000005,4570353,2771435,2600840,4029136,2208163,3388232,2764487,1986399,1610532,2580097,1761451,2291170.0000000005,4961472,1825140,1460908,2095947.0000000002,209.00916205882353,9,0,6,0,6,0,0,0,0,0,0,0,0,0,0,0,0,null,210.0164376,{"$nulls":3},7,0.6666666666666666,0.6666666666666666,0,0,0,0,0,0,0.6666666666666666,0.6666666666666666,0.6666666666666666,1,0.7777777777777778,"C9H6O6","O6","CHO","ConAroStru",8]
[210.027671,0,0,0,0,0,845011,0,0,0,0,0,0,0,0,0,0,0,0,209.020319,8,0,6,0,5,0,2,0,0,0,0,0,0,0,0,0,0,null,210.027671,{"$nulls":3},7,0.625,0.75,0.25,0,0,0,0,0,0.7142857142857143,1.25,0.75,2,0.875,"C8H6O5N2","O5N2","CHON","Lignin",6]
[210.03506449999998,1068397.9999999998,1204882,1036917,1039728,915852,3099349,938535,1699661,0,1112419.9999999998,1028392,1166982,1196080.0000000002,1067239,3052230,838520,1889713,1131985,209.02778400000005,10,0,10,0,3,0,0,0,1,0,0,0,0,0,0,0,0,null,210.03506449999998,{"$nulls":3},6,0.3,1,0,0.1,0,0,0,0,0.4666666666666667,-0.2,1,3,0.6,"C10H10O3S1","O3S1","CHOS","Lignin",6]
[210.052823,6038387,6518038,8576762,7652084,6858641,23059383,6277548,14009233,9641680,7436905,5716781,7814795.000000001,6899124,10305238,26682577,5685372,11021303,7763030,209.04554273684212,10,0,10,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,210.052823,{"$nulls":3},6,0.5,1,0,0,0,0,0,0,0.4666666666666667,0,1,1,0.6,"C10H10O5","O5","CHO","Lignin",6]
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[210.99392809999998,0,0,0,0,0,1602509,0,0,1067711,0,0,0,0,0,2096114,0,0,0,209.98667319999998,8,0,5,0,4,0,1,0,1,0,0,0,0,0,0,0,0,null,210.99392809999998,{"$nulls":3},7,0.5,0.625,0.125,0.125,0,0,0,0,0.75,1,0.625,3,0.875,"C8H5O4N1S1","O4N1S1","CHONS","ConAroStru",8]
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[298.152871,0,1060288,0,1025656,1038375,2977317,1899595,1276395,0,0,1635099,0,0,1302217,3532102,0,1346894,1188696,297.1456317692308,14,0,22,0,5,0,2,0,0,0,0,0,0,0,0,0,0,null,298.152871,{"$nulls":3},5,0.35714285714285715,1.5714285714285714,0.14285714285714285,0,0,0,0,0,0.05263157894736842,-0.42857142857142855,1.5714285714285714,0,0.35714285714285715,"C14H22O5N2","O5N2","CHON","N-ConSatCom",3]
[300.0373864,0,0,1191601,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,299.030213,16,0,13,0,2,0,0,0,1,0,0,1,0,0,0,0,0,null,300.0373864,{"$nulls":3},11,0.125,0.8125,0,0.0625,0.0625,0,0,0,0.6153846153846154,-0.75,0.8125,9,0.6875,"C16H13O2S1P1","O2S1P1","CHOSP","Lignin",6]
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[315.20457200000004,0,0,0,0,0,3966493,0,1296419,0,0,0,0,0,0,4608073,0,0,0,314.1972616666667,16,0,29,0,5,0,1,0,0,0,0,0,0,0,0,0,0,null,315.20457200000004,{"$nulls":3},3,0.3125,1.8125,0.0625,0,0,0,0,0,0,-1,1.8125,-2,0.1875,"C16H29O5N1","O5N1","CHON","N-ConSatCom",3]
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[330.1427002,0,1215836.9999999998,0,1364832,0,1672501,1798139,1723973,0,0,1272668.0000000002,1377895,0,1521037,2060919,0,1642253,0,329.1354589230769,14,0,22,0,7,0,2,0,0,0,0,0,0,0,0,0,0,null,330.1427002,{"$nulls":3},5,0.5,1.5714285714285714,0.14285714285714285,0,0,0,0,0,0,-0.14285714285714285,1.5714285714285714,-2,0.35714285714285715,"C14H22O7N2","O7N2","CHON","N-ConSatCom",3]
[332.0024436,0,0,0,0,0,1189088,1323600.9999999998,0,0,0,1603780,0,0,0,1827982.0000000002,0,1405561,0,330.9951792857143,12,0,12,0,7,0,0,0,2,0,0,0,0,0,0,0,0,null,332.0024436,{"$nulls":3},7,0.5833333333333334,1,0,0.16666666666666666,0,0,0,0,0.23076923076923078,0.5,1,0,0.5833333333333334,"C12H12O7S2","O7S2","CHOS","Lignin",6]
[332.256273,0,0,0,0,0,0,0,0,0,3313133,0,0,0,3889300,0,0,0,0,331.249007,18,0,36,0,5,0,0,0,0,0,0,0,0,0,0,0,0,null,332.256273,{"$nulls":3},1,0.2777777777777778,2,0,0,0,0,0,0,0,-1.4444444444444444,2,-4,0.05555555555555555,"C18H36O5","O5","CHO","N-FreeSatCom",4]
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[337.96511599999997,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2275287.9999999995,0,0,336.957855,10,0,11,0,5,0,0,0,0,0,0,0,0,0,0,0,1,null,337.96511599999997,{"$nulls":3},5,0.5,1.1,0,0,0,0,0,0.1,0.3333333333333333,0,1.2000000000000002,0,0.5,"C10H11O5I1","O5I1","CHOI","Lignin",6]
[338.1576814,1941221,0,0,2624435,2103050,0,0,3089752,0,0,0,0,2531317,7071211,0,0,5086984,0,337.150430125,14,0,26,0,9,0,0,0,0,0,0,0,0,0,0,0,0,null,338.1576814,{"$nulls":3},2,0.6428571428571429,1.8571428571428572,0,0,0,0,0,0,0,-0.5714285714285714,1.8571428571428572,-7,0.14285714285714285,"C14H26O9","O9","CHO","Aminosugars",2]
[338.2457084,0,0,0,0,0,3095620,0,1832858,0,0,0,0,0,0,4440396,0,1769294,0,337.23842260000004,20,0,34,0,4,0,0,0,0,0,0,0,0,0,0,0,0,null,338.2457084,{"$nulls":3},4,0.2,1.7,0,0,0,0,0,0,0.1111111111111111,-1.3,1.7,0,0.2,"C20H34O4","O4","CHO","N-FreeSatCom",4]
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[371.949466,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,3172495,0,0,370.942169,13,0,9,0,5,0,0,0,0,0,0,0,0,0,0,0,1,null,371.949466,{"$nulls":3},9,0.38461538461538464,0.6923076923076923,0,0,0,0,0,0.07692307692307693,0.6190476190476191,0.15384615384615385,0.7692307692307692,4,0.6923076923076923,"C13H9O5I1","O5I1","CHOI","ConAroStru",8]
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[374.9966438000001,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1554813,0,0,373.989534,16,0,10,0,6,0,1,0,1,0,0,1,0,0,0,0,0,null,374.9966438000001,{"$nulls":3},13,0.375,0.625,0.0625,0.0625,0.0625,0,0,0,0.7,0.125,0.625,7,0.8125,"C16H10O6N1S1P1","O6N1S1P1","CHONSP","ConAroStru",8]
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[400.19532899999996,0,0,0,0,0,0,0,3728950,0,0,0,0,0,0,0,0,0,0,399.188053,17,0,36,0,6,0,0,0,2,0,0,0,0,0,0,0,0,null,400.19532899999996,{"$nulls":3},0,0.35294117647058826,2.1176470588235294,0,0.11764705882352941,0,0,0,0,0,-1.1764705882352942,2.1176470588235294,-6,0,"C17H36O6S2","O6S2","CHOS","N-FreeSatCom",4]
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[405.1093511,0,0,0,0,0,0,0,0,0,2022224,0,0,0,0,1752002,0,0,0,404.1022155,16,0,23,0,9,0,1,0,1,0,0,0,0,0,0,0,0,null,405.1093511,{"$nulls":3},6,0.5625,1.4375,0.0625,0.0625,0,0,0,0,0,0,1.4375,-3,0.375,"C16H23O9N1S1","O9N1S1","CHONS","Lignin",6]
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[411.9476447,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2854438,0,0,410.940437,15,0,9,0,8,0,0,0,2,0,0,1,0,0,0,0,0,null,411.9476447,{"$nulls":3},12,0.5333333333333333,0.6,0,0.13333333333333333,0.06666666666666667,0,0,0,0.625,0.4,0.6,4,0.8,"C15H9O8S2P1","O8S2P1","CHOSP","ConAroStru",8]
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[466.2930522,0,0,0,0,0,5912811,0,2436662,0,0,0,0,0,0,7146150,0,3202253,0,465.28565360000005,26,0,42,0,7,0,0,0,0,0,0,0,0,0,0,0,0,null,466.2930522,{"$nulls":3},6,0.2692307692307692,1.6153846153846154,0,0,0,0,0,0,0.1111111111111111,-1.0769230769230769,1.6153846153846154,-1,0.23076923076923078,"C26H42O7","O7","CHO","N-FreeSatCom",4]
[468.18178750000004,2814867,3426429,0,3502194,0,2875138,3685596,0,3429200.9999999995,2858647,4080006.0000000005,2860188,3048208,2761537,3155197,3442362,4039605,3599452,467.17448774999997,23,0,32,0,8,0,0,0,1,0,0,0,0,0,0,0,0,null,468.18178750000004,{"$nulls":3},8,0.34782608695652173,1.391304347826087,0,0.043478260869565216,0,0,0,0,0.16666666666666666,-0.6086956521739131,1.391304347826087,0,0.34782608695652173,"C23H32O8S1","O8S1","CHOS","Lignin",6]
[468.2148022,3276771,0,2505983,0,0,0,0,3182686,2913188,2785517,0,2543343,3157859,0,0,0,3835915,3393712,467.20749987499994,27,0,32,0,7,0,0,0,0,0,0,0,0,0,0,0,0,null,468.2148022,{"$nulls":3},12,0.25925925925925924,1.1851851851851851,0,0,0,0,0,0,0.3617021276595745,-0.6666666666666666,1.1851851851851851,5,0.4444444444444444,"C27H32O7","O7","CHO","Lignin",6]
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[476.99205880000005,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,6322580,0,0,475.984795,16,0,16,0,8,0,1,0,0,0,0,0,0,0,0,0,1,null,476.99205880000005,{"$nulls":3},9,0.5,1,0.0625,0,0,0,0,0.0625,0.36363636363636365,0.25,1.0625,1,0.5625,"C16H16O8N1I1","O8N1I1","CHONI","Lignin",6]
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[576.1267752,4672994,7013789,9050126,4074838.0000000005,7256192,0,0,7228651,5380802,0,5756664,7972697,0,5240375,0,0,4646563,0,575.1195875384615,30,0,24,0,12,0,0,0,0,0,0,0,0,0,0,0,0,null,576.1267752,{"$nulls":3},19,0.4,0.8,0,0,0,0,0,0,0.5416666666666666,0,0.8,7,0.6333333333333333,"C30H24O12","O12","CHO","Lignin",6]
[577.2159241999999,5898485,5409954,0,3843183,5967919,0,7543492,5086274,4378775,5331800,6983171,5875298,5609292,5575937,0,5449143,5347812,5478159,576.2087189411766,28,0,35,0,12,0,1,0,0,0,0,0,0,0,0,0,0,null,577.2159241999999,{"$nulls":3},12,0.42857142857142855,1.25,0.03571428571428571,0,0,0,0,0,0.23809523809523808,-0.2857142857142857,1.25,0,0.42857142857142855,"C28H35O12N1","O12N1","CHON","Lignin",6]
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[581.2195699,0,0,0,0,0,0,0,0,0,0,0,0,0,0,3957901.9999999995,0,0,0,580.2117057222221,30,0,35,0,7,0,3,0,1,0,0,0,0,0,0,0,0,null,581.2195699,{"$nulls":3},15,0.23333333333333334,1.1666666666666667,0.1,0.03333333333333333,0,0,0,0,0.3333333333333333,-0.3333333333333333,1.1666666666666667,8,0.5,"C30H35O7N3S1","O7N3S1","CHONS","Lignin",6]
[582.1485732,0,0,4175447,0,0,0,0,0,0,0,0,0,0,4038349,0,0,0,0,581.141105090909,28,0,26,0,12,0,2,0,0,0,0,0,0,0,0,0,0,null,582.1485732,{"$nulls":3},17,0.42857142857142855,0.9285714285714286,0.07142857142857142,0,0,0,0,0,0.45,0.14285714285714285,0.9285714285714286,5,0.6071428571428571,"C28H26O12N2","O12N2","CHON","Lignin",6]
[583.2716053,0,0,4400659,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,582.2637838181819,31,0,41,0,6,0,3,0,1,0,0,0,0,0,0,0,0,null,583.2716053,{"$nulls":3},13,0.1935483870967742,1.3225806451612903,0.0967741935483871,0.03225806451612903,0,0,0,0,0.25,-0.5806451612903226,1.3225806451612903,7,0.41935483870967744,"C31H41O6N3S1","O6N3S1","CHONS","Lignin",6]
[585.1118534,6634163,7151112,12543902,6602379,8763047.999999998,0,6008738,8003580,4207099,6004757,7065533,12050417,7161672,7150929,0,4280187,6821162,5569858,584.1044792631579,27,0,23,0,14,0,1,0,0,0,0,0,0,0,0,0,0,null,585.1118534,{"$nulls":3},17,0.5185185185185185,0.8518518518518519,0.037037037037037035,0,0,0,0,0,0.47368421052631576,0.2962962962962963,0.8518518518518519,3,0.6296296296296297,"C27H23O14N1","O14N1","CHON","Lignin",6]
[586.1686398,14366804,20993035,21699048,11232316,15979763,4629617,20809900,12617182,9234074,20145308,23941017.999999996,23904243,12846247,15248088,4755775,11984158,12729092,8927851,585.1614043000001,29,0,30,0,13,0,0,0,0,0,0,0,0,0,0,0,0,null,586.1686398,{"$nulls":3},15,0.4482758620689655,1.0344827586206897,0,0,0,0,0,0,0.37777777777777777,-0.13793103448275862,1.0344827586206897,2,0.5172413793103449,"C29H30O13","O13","CHO","Lignin",6]
[587.1387368000001,0,0,0,4217009,0,0,0,0,3786774.0000000005,4510963,0,0,5011662,0,0,0,0,5697120,586.1313600000001,26,0,25,0,13,0,3,0,0,0,0,0,0,0,0,0,0,null,587.1387368000001,{"$nulls":3},16,0.5,0.9615384615384616,0.11538461538461539,0,0,0,0,0,0.3939393939393939,0.38461538461538464,0.9615384615384616,3,0.6153846153846154,"C26H25O13N3","O13N3","CHON","Lignin",6]
[588.293446,0,5625491,4913901,0,4176197,0,7764384,5581153,4673447.000000001,4175139,5392494,5505170,3900189,5451187,4749918,6361118,5877366,0,587.286202352941,32,0,44,0,10,0,0,0,0,0,0,0,0,0,0,0,0,null,588.293446,{"$nulls":3},11,0.3125,1.375,0,0,0,0,0,0,0.2222222222222222,-0.75,1.375,1,0.34375,"C32H44O10","O10","CHO","Lignin",6]
[591.1012888,0,0,5175342,4076108,4077008,0,0,3970254,0,0,0,4817766,0,0,0,0,0,0,590.0939996666666,29,0,21,0,13,0,1,0,0,0,0,0,0,0,0,0,0,null,591.1012888,{"$nulls":3},20,0.4482758620689655,0.7241379310344828,0.034482758620689655,0,0,0,0,0,0.5813953488372093,0.27586206896551724,0.7241379310344828,7,0.6896551724137931,"C29H21O13N1","O13N1","CHON","Lignin",6]
[592.1614459,0,0,0,0,0,0,5053177.999999999,0,0,0,0,0,0,0,0,4308921.999999999,0,0,591.1544719999999,28,0,32,0,12,0,0,0,1,0,0,0,0,0,0,0,0,null,592.1614459,{"$nulls":3},13,0.42857142857142855,1.1428571428571428,0,0.03571428571428571,0,0,0,0,0.2857142857142857,-0.21428571428571427,1.1428571428571428,1,0.4642857142857143,"C28H32O12S1","O12S1","CHOS","Lignin",6]
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[596.0802189999999,9220369,11134024,28267531,8793455,17700816,0,7742169,11321564,4350835,6552824,9813616,13797012,5794464,7472035,4573426,4445632,8095189,5561983,595.0728093157895,28,0,20,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,596.0802189999999,{"$nulls":3},19,0.5357142857142857,0.7142857142857143,0,0,0,0,0,0,0.5609756097560976,0.35714285714285715,0.7142857142857143,4,0.6785714285714286,"C28H20O15","O15","CHO","Lignin",6]
[596.2257606,0,4232692,5888416,4285211.999999999,4300196,3829690.9999999995,5661846,4453007,5001481,0,5744668,4740161,4520001.000000001,4193618,0,4320105,4829064,3954711,595.2184395294116,32,0,36,0,11,0,0,0,0,0,0,0,0,0,0,0,0,null,596.2257606,{"$nulls":3},15,0.34375,1.125,0,0,0,0,0,0,0.3584905660377358,-0.4375,1.125,4,0.46875,"C32H36O11","O11","CHO","Lignin",6]
[598.1322544,18918315,23343677,35405365,10716330,26330219,0,13884159,18893889.999999996,7726456,11187851,24352415,26664715,10228011,19134836,5811760,9039078,17212980,6479019,597.1248948499999,29,0,26,0,14,0,0,0,0,0,0,0,0,0,0,0,0,null,598.1322544,{"$nulls":3},17,0.4827586206896552,0.896551724137931,0,0,0,0,0,0,0.45454545454545453,0.06896551724137931,0.896551724137931,3,0.5862068965517241,"C29H26O14","O14","CHO","Lignin",6]
[600.2029167000001,0,0,0,0,0,0,4324012,0,0,0,0,0,0,0,0,0,0,0,599.195035,31,0,36,0,10,0,0,0,1,0,0,0,0,0,0,0,0,null,600.2029167000001,{"$nulls":3},14,0.3225806451612903,1.1612903225806452,0,0.03225806451612903,0,0,0,0,0.32,-0.45161290322580644,1.1612903225806452,4,0.45161290322580644,"C31H36O10S1","O10S1","CHOS","Lignin",6]
[602.1060398,0,0,7716897,0,4792760,0,0,4223026,0,0,0,6828371.000000001,0,0,0,0,0,0,601.0986755000001,31,0,22,0,13,0,0,0,0,0,0,0,0,0,0,0,0,null,602.1060398,{"$nulls":3},21,0.41935483870967744,0.7096774193548387,0,0,0,0,0,0,0.5918367346938775,0.12903225806451613,0.7096774193548387,8,0.6774193548387096,"C31H22O13","O13","CHO","Lignin",6]
[602.2210689999999,4983934,4540401.000000001,0,0,0,3750708,5835026,5010796,3944403,4767466,5181985.000000001,0,0,4493320.999999999,0,4491496,0,0,601.2140284375,27,0,38,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,602.2210689999999,{"$nulls":3},9,0.5555555555555556,1.4074074074074074,0,0,0,0,0,0,0.07692307692307693,-0.2962962962962963,1.4074074074074074,-6,0.3333333333333333,"C27H38O15","O15","CHO","Lignin",6]
[604.1216898,4168720,6380450,7397133,5448767,7092136,0,0,5199177,0,0,0,8064600,4463291,0,0,0,4090455,0,603.1142978461539,31,0,24,0,13,0,0,0,0,0,0,0,0,0,0,0,0,null,604.1216898,{"$nulls":3},20,0.41935483870967744,0.7741935483870968,0,0,0,0,0,0,0.5510204081632653,0.06451612903225806,0.7741935483870968,7,0.6451612903225806,"C31H24O13","O13","CHO","Lignin",6]
[606.1697024000001,0,0,0,0,0,0,4123336,0,0,0,0,5198591,0,5019896.000000001,0,0,0,4129877,605.1624224545454,27,0,30,0,14,0,2,0,0,0,0,0,0,0,0,0,0,null,606.1697024000001,{"$nulls":3},14,0.5185185185185185,1.1111111111111112,0.07407407407407407,0,0,0,0,0,0.2777777777777778,0.14814814814814814,1.1111111111111112,0,0.5185185185185185,"C27H30O14N2","O14N2","CHON","Lignin",6]
[608.1166044,7569165,11698939,22155096,6351568,12302543,0,7198277,11210953,0,6247909,10079473,19302759,6632445,9266229,0,5423861,8066547,0,607.1093228235295,30,0,24,0,14,0,0,0,0,0,0,0,0,0,0,0,0,null,608.1166044,{"$nulls":3},19,0.4666666666666667,0.8,0,0,0,0,0,0,0.5217391304347826,0.13333333333333333,0.8,5,0.6333333333333333,"C30H24O14","O14","CHO","Lignin",6]
[610.189769,24409359.000000004,18273672,13518807,18627512,12500195,5207251,22234553,13169669,17584420,25519401,19632395,13547870,19005562,17817907,5745552,21054527,12855616,20342556,609.1825388499999,28,0,34,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,610.189769,{"$nulls":3},12,0.5357142857142857,1.2142857142857142,0,0,0,0,0,0,0.21951219512195122,-0.14285714285714285,1.2142857142857142,-3,0.42857142857142855,"C28H34O15","O15","CHO","Lignin",6]
[610.2989252,4041487,5648189,4747505,0,4281836,4375997,8977208,5033217,0,4233975,6086922,5284447,4341493,7244027,5799019,10241714.999999998,6548031,3882072.9999999995,609.2916326875002,31,0,46,0,12,0,0,0,0,0,0,0,0,0,0,0,0,null,610.2989252,{"$nulls":3},9,0.3870967741935484,1.4838709677419355,0,0,0,0,0,0,0.12,-0.7096774193548387,1.4838709677419355,-3,0.2903225806451613,"C31H46O12","O12","CHO","Lignin",6]
[612.293446,0,0,0,0,0,0,6243716,0,0,0,0,0,0,0,0,0,0,0,611.2860148999999,34,0,44,0,10,0,0,0,0,0,0,0,0,0,0,0,0,null,612.293446,{"$nulls":3},13,0.29411764705882354,1.2941176470588236,0,0,0,0,0,0,0.27586206896551724,-0.7058823529411765,1.2941176470588236,3,0.38235294117647056,"C34H44O10","O10","CHO","Lignin",6]
[614.2938398,0,0,0,0,0,0,4534027,0,0,0,0,0,0,0,4653586,4882496,0,0,613.2866347,30,0,46,0,13,0,0,0,0,0,0,0,0,0,0,0,0,null,614.2938398,{"$nulls":3},8,0.43333333333333335,1.5333333333333334,0,0,0,0,0,0,0.06382978723404255,-0.6666666666666666,1.5333333333333334,-5,0.26666666666666666,"C30H46O13","O13","CHO","N-FreeSatCom",4]
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[618.1737252,0,0,4701847,0,4711832,0,0,0,0,0,0,0,0,0,0,0,0,0,617.1664020000001,33,0,30,0,12,0,0,0,0,0,0,0,0,0,0,0,0,null,618.1737252,{"$nulls":3},19,0.36363636363636365,0.9090909090909091,0,0,0,0,0,0,0.48148148148148145,-0.18181818181818182,0.9090909090909091,7,0.5757575757575758,"C33H30O12","O12","CHO","Lignin",6]
[619.2628741999999,0,0,4467672,0,0,0,5369619,4380031,0,0,4462969,0,4770355,0,0,5422425,0,0,618.2556278461539,31,0,41,0,12,0,1,0,0,0,0,0,0,0,0,0,0,null,619.2628741999999,{"$nulls":3},12,0.3870967741935484,1.3225806451612903,0.03225806451612903,0,0,0,0,0,0.20833333333333334,-0.45161290322580644,1.3225806451612903,0,0.3870967741935484,"C31H41O12N1","O12N1","CHON","Lignin",6]
[622.095869,8040124.999999999,8545542,21869938,6117036,10010212,0,4922296.999999999,8745201,0,5033632.999999999,6915343,12134698,5450752,7952958,0,0,6776509,0,621.0885791666666,30,0,22,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,622.095869,{"$nulls":3},20,0.5,0.7333333333333333,0,0,0,0,0,0,0.5555555555555556,0.26666666666666666,0.7333333333333333,5,0.6666666666666666,"C30H22O15","O15","CHO","Lignin",6]
[624.1115189999999,8919982,11588208,28189675.000000004,9323215,19948116,0,8046970,10722763,0,6965953,10672654,16320194,6617012,9226325,0,4900040,9032630,4660870,623.104282,30,0,24,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,624.1115189999999,{"$nulls":3},19,0.5,0.8,0,0,0,0,0,0,0.5111111111111111,0.2,0.8,4,0.6333333333333333,"C30H24O15","O15","CHO","Lignin",6]
[626.0543982,5003120,4751019,9351269,0,4821049,0,0,4188522,0,0,0,4518695,0,0,0,0,0,0,625.0471814,28,0,18,0,17,0,0,0,0,0,0,0,0,0,0,0,0,null,626.0543982,{"$nulls":3},20,0.6071428571428571,0.6428571428571429,0,0,0,0,0,0,0.5897435897435898,0.5714285714285714,0.6428571428571429,3,0.7142857142857143,"C28H18O17","O17","CHO","ConAroStru",8]
[626.1384024,0,0,5107965,0,4479164,0,0,0,0,0,0,4858798,0,0,0,0,0,0,625.131165,29,0,26,0,14,0,2,0,0,0,0,0,0,0,0,0,0,null,626.1384024,{"$nulls":3},18,0.4827586206896552,0.896551724137931,0.06896551724137931,0,0,0,0,0,0.45,0.27586206896551724,0.896551724137931,4,0.6206896551724138,"C29H26O14N2","O14N2","CHON","Lignin",6]
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[706.3564398,0,4055343.0000000005,5411360,0,0,4441991,6689150,4392892,3987282,0,4243481,4156961,0,3993530,6738107,7597410,4749433,0,705.3491511428572,37,0,54,0,13,0,0,0,0,0,0,0,0,0,0,0,0,null,706.3564398,{"$nulls":3},11,0.35135135135135137,1.4594594594594594,0,0,0,0,0,0,0.14754098360655737,-0.7567567567567568,1.4594594594594594,-2,0.2972972972972973,"C37H54O13","O13","CHO","Lignin",6]
[710.1482982,5344127,4749337,11140408,3934551,8543130,0,6738949,5227643,0,0,0,8100669,0,4080880,0,0,5906011,0,709.1408407142857,34,0,30,0,17,0,0,0,0,0,0,0,0,0,0,0,0,null,710.1482982,{"$nulls":3},20,0.5,0.8823529411764706,0,0,0,0,0,0,0.45098039215686275,0.11764705882352941,0.8823529411764706,3,0.5882352941176471,"C34H30O17","O17","CHO","Lignin",6]
[712.236719,8687993,7798399,8638871,7149582.999999999,7151779,0,16487627,6818220.999999999,5513613,8739490.000000002,10618846,8581285,8089581,7725667,0,9569667.999999998,8809529,6768433,711.2295105294118,36,0,40,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,712.236719,{"$nulls":3},17,0.4166666666666667,1.1111111111111112,0,0,0,0,0,0,0.3333333333333333,-0.2777777777777778,1.1111111111111112,2,0.4722222222222222,"C36H40O15","O15","CHO","Lignin",6]
[714.2007274,4820976.999999999,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,713.19402325,31,0,38,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,714.2007274,{"$nulls":3},13,0.6129032258064516,1.2258064516129032,0,0,0,0,0,0,0.16279069767441862,0,1.2258064516129032,-6,0.41935483870967744,"C31H38O19","O19","CHO","Lignin",6]
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[722.1482982,0,4368377,8911549,0,7462222.999999999,0,4267304,5479770,0,0,4253161,6581662,0,0,0,0,0,0,721.1408928333332,35,0,30,0,17,0,0,0,0,0,0,0,0,0,0,0,0,null,722.1482982,{"$nulls":3},21,0.4857142857142857,0.8571428571428571,0,0,0,0,0,0,0.4716981132075472,0.11428571428571428,0.8571428571428571,4,0.6,"C35H30O17","O17","CHO","Lignin",6]
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[725.1591972,0,0,5313183.999999999,0,4402772,0,0,0,0,0,0,0,0,0,0,0,0,0,724.151848,34,0,31,0,17,0,1,0,0,0,0,0,0,0,0,0,0,null,725.1591972,{"$nulls":3},20,0.5,0.9117647058823529,0.029411764705882353,0,0,0,0,0,0.42857142857142855,0.17647058823529413,0.9117647058823529,3,0.5882352941176471,"C34H31O17N1","O17N1","CHON","Lignin",6]
[728.2358727000001,4133559.9999999995,0,0,0,0,0,5127067,0,0,0,0,0,0,0,0,0,0,0,727.22911575,34,0,48,0,11,0,0,0,3,0,0,0,0,0,0,0,0,null,728.2358727000001,{"$nulls":3},11,0.3235294117647059,1.411764705882353,0,0.08823529411764706,0,0,0,0,0.09803921568627451,-0.5882352941176471,1.411764705882353,0,0.3235294117647059,"C34H48O11S3","O11S3","CHOS","Lignin",6]
[731.1769724,0,0,0,0,4565482,0,0,0,0,0,0,0,0,0,0,0,0,0,730.1704111666667,27,0,33,0,19,0,5,0,0,0,0,0,0,0,0,0,0,null,731.1769724,{"$nulls":3},14,0.7037037037037037,1.2222222222222223,0.18518518518518517,0,0,0,0,0,0,0.7407407407407407,1.2222222222222223,-5,0.5185185185185185,"C27H33O19N5","O19N5","CHON","Tannins",5]
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[734.2421982,20987540,18627557,12330498,11404756,15506571,3883605,23707400,6993443,16042622.000000002,22874500,18582592,10486047,18243161,10199814,4771322,21749964,14203120,12168896,733.23498065,35,0,42,0,17,0,0,0,0,0,0,0,0,0,0,0,0,null,734.2421982,{"$nulls":3},15,0.4857142857142857,1.2,0,0,0,0,0,0,0.24528301886792453,-0.22857142857142856,1.2,-2,0.42857142857142855,"C35H42O17","O17","CHO","Lignin",6]
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[744.1690336,0,0,4217390,0,0,0,0,3640510,0,0,0,0,0,0,0,0,0,0,743.16119225,38,0,32,0,16,0,0,0,0,0,0,0,0,0,0,0,0,null,744.1690336,{"$nulls":3},23,0.42105263157894735,0.8421052631578947,0,0,0,0,0,0,0.5,0,0.8421052631578947,7,0.6052631578947368,"C38H32O16","O16","CHO","Lignin",6]
[745.1854117999999,0,4184296,0,0,0,0,0,0,0,0,0,0,0,0,3276874,0,0,0,744.1782160000001,34,0,35,0,18,0,1,0,0,0,0,0,0,0,0,0,0,null,745.1854117999999,{"$nulls":3},18,0.5294117647058824,1.0294117647058822,0.029411764705882353,0,0,0,0,0,0.3333333333333333,0.11764705882352941,1.0294117647058822,0,0.5294117647058824,"C34H35O18N1","O18N1","CHON","Lignin",6]
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[754.195642,3779388,0,0,4910048,0,0,4190410,0,0,4423332.000000001,0,0,0,0,0,0,0,0,753.1886230000001,33,0,38,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,754.195642,{"$nulls":3},15,0.6060606060606061,1.1515151515151516,0,0,0,0,0,0,0.21739130434782608,0.06060606060606061,1.1515151515151516,-5,0.45454545454545453,"C33H38O20","O20","CHO","Lignin",6]
[754.283669,5817052,7172949,4698870,5512071,6056083,0,8886373,4566062,5892326,7304778,8163633.000000001,5283651,7624725,6580544,0,6938848,5268968,5138402,753.27628725,39,0,46,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,754.283669,{"$nulls":3},17,0.38461538461538464,1.1794871794871795,0,0,0,0,0,0,0.30158730158730157,-0.41025641025641024,1.1794871794871795,2,0.4358974358974359,"C39H46O15","O15","CHO","Lignin",6]
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[761.1803263999999,0,0,0,0,0,0,4604171,0,0,0,0,0,0,0,0,0,0,0,760.172681,34,0,35,0,19,0,1,0,0,0,0,0,0,0,0,0,0,null,761.1803263999999,{"$nulls":3},18,0.5588235294117647,1.0294117647058822,0.029411764705882353,0,0,0,0,0,0.3191489361702128,0.17647058823529413,1.0294117647058822,-1,0.5294117647058824,"C34H35O19N1","O19N1","CHON","Lignin",6]
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[766.377569,0,0,0,0,0,0,4522328,0,0,0,3771843,0,0,0,0,4531414,0,0,765.3704836,39,0,58,0,15,0,0,0,0,0,0,0,0,0,0,0,0,null,766.377569,{"$nulls":3},11,0.38461538461538464,1.4871794871794872,0,0,0,0,0,0,0.1111111111111111,-0.717948717948718,1.4871794871794872,-4,0.28205128205128205,"C39H58O15","O15","CHO","Lignin",6]
[767.3443145,0,0,0,0,0,0,0,0,0,0,4028996.9999999995,0,0,0,0,0,0,0,766.337105,42,0,58,0,6,0,1,0,2,0,0,1,0,0,0,0,0,null,767.3443145,{"$nulls":3},15,0.14285714285714285,1.380952380952381,0.023809523809523808,0.047619047619047616,0.023809523809523808,0,0,0,0.22857142857142856,-1.0476190476190477,1.380952380952381,9,0.35714285714285715,"C42H58O6N1S2P1","O6N1S2P1","CHONSP","Lignin",6]
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[894.2793712,4229306,0,0,0,0,0,3202969,0,3376609,4957223,0,0,4182270,0,0,3580890,0,2857545,893.2716771666666,41,0,50,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,894.2793712,{"$nulls":3},17,0.5365853658536586,1.2195121951219512,0,0,0,0,0,0,0.2,-0.14634146341463414,1.2195121951219512,-5,0.4146341463414634,"C41H50O22","O22","CHO","Lignin",6]
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[946.4206958,3008906,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,945.4136154,49,0,70,0,14,0,0,0,2,0,0,0,0,0,0,0,0,null,946.4206958,{"$nulls":3},15,0.2857142857142857,1.4285714285714286,0,0.04081632653061224,0,0,0,0,0.15,-0.7755102040816326,1.4285714285714286,1,0.30612244897959184,"C49H70O14S2","O14S2","CHOS","Lignin",6]
[948.2908042,3192328,0,0,2661932,0,0,0,0,0,3749533,0,0,0,0,0,0,0,3435282,947.2836492222222,45,0,56,0,18,0,0,0,2,0,0,0,0,0,0,0,0,null,948.2908042,{"$nulls":3},18,0.4,1.2444444444444445,0,0.044444444444444446,0,0,0,0,0.20588235294117646,-0.35555555555555557,1.2444444444444445,0,0.4,"C45H56O18S2","O18S2","CHOS","Lignin",6]
[948.3271896000001,3237367,0,0,0,0,0,3860418,0,0,4519567.000000001,0,0,3759068,0,0,0,0,2894575,947.3201131111111,46,0,60,0,17,0,0,0,2,0,0,0,0,0,0,0,0,null,948.3271896000001,{"$nulls":3},17,0.3695652173913043,1.3043478260869565,0,0.043478260869565216,0,0,0,0,0.18309859154929578,-0.4782608695652174,1.3043478260869565,0,0.3695652173913043,"C46H60O17S2","O17S2","CHOS","Lignin",6]
[948.3627066,3208678,0,0,0,0,0,2807709,0,0,3041921,3304507,0,0,3221971,0,3471294,0,0,947.3558436999999,46,0,60,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,948.3627066,{"$nulls":3},17,0.45652173913043476,1.3043478260869565,0,0,0,0,0,0,0.18309859154929578,-0.391304347826087,1.3043478260869565,-4,0.3695652173913043,"C46H60O21","O21","CHO","Lignin",6]
[948.399092,0,0,0,0,0,0,2822007,0,0,2857587,0,0,0,0,0,0,0,0,947.392662,47,0,64,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,948.399092,{"$nulls":3},16,0.425531914893617,1.3617021276595744,0,0,0,0,0,0,0.16216216216216217,-0.5106382978723404,1.3617021276595744,-4,0.3404255319148936,"C47H64O20","O20","CHO","Lignin",6]
[950.2700688,5539096,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,949.262035,44,0,54,0,19,0,0,0,2,0,0,0,0,0,0,0,0,null,950.2700688,{"$nulls":3},18,0.4318181818181818,1.2272727272727273,0,0.045454545454545456,0,0,0,0,0.2,-0.2727272727272727,1.2272727272727273,-1,0.4090909090909091,"C44H54O19S2","O19S2","CHOS","Lignin",6]
[950.3064542,0,0,0,0,0,0,3314707,0,0,3263408,0,0,0,0,0,0,0,0,949.2995912999999,45,0,58,0,18,0,0,0,2,0,0,0,0,0,0,0,0,null,950.3064542,{"$nulls":3},17,0.4,1.288888888888889,0,0.044444444444444446,0,0,0,0,0.17647058823529413,-0.4,1.288888888888889,-1,0.37777777777777777,"C45H58O18S2","O18S2","CHOS","Lignin",6]
[950.3428396,0,0,0,2663846,0,0,3161072,0,0,0,3347528,0,2875674,0,0,3708441,0,0,949.3357915,46,0,62,0,17,0,0,0,2,0,0,0,0,0,0,0,0,null,950.3428396,{"$nulls":3},16,0.3695652173913043,1.3478260869565217,0,0.043478260869565216,0,0,0,0,0.15492957746478872,-0.5217391304347826,1.3478260869565217,-1,0.34782608695652173,"C46H62O17S2","O17S2","CHOS","Lignin",6]
[950.3817273,0,0,0,0,0,0,3507148,0,0,0,0,0,0,0,0,0,0,0,949.3734939999999,43,0,66,0,21,0,0,0,1,0,0,0,0,0,0,0,0,null,950.3817273,{"$nulls":3},11,0.4883720930232558,1.5348837209302326,0,0.023255813953488372,0,0,0,0,0,-0.5116279069767442,1.5348837209302326,-10,0.2558139534883721,"C43H66O21S1","O21S1","CHOS","N-FreeSatCom",4]
[952.1909504,0,0,2804791,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,951.1837793333334,44,0,40,0,24,0,0,0,0,0,0,0,0,0,0,0,0,null,952.1909504,{"$nulls":3},25,0.5454545454545454,0.9090909090909091,0,0,0,0,0,0,0.40625,0.18181818181818182,0.9090909090909091,1,0.5681818181818182,"C44H40O24","O24","CHO","Lignin",6]
[952.2637212,0,0,2916351,0,0,0,0,0,0,0,0,2844800,0,0,0,0,0,0,951.2565999999999,46,0,48,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,952.2637212,{"$nulls":3},23,0.4782608695652174,1.0434782608695652,0,0,0,0,0,0,0.34285714285714286,-0.08695652173913043,1.0434782608695652,1,0.5,"C46H48O22","O22","CHO","Lignin",6]
[952.3001065999999,0,6178858,0,0,0,0,0,2799590,0,0,3114187,0,0,0,0,0,0,0,951.2919522500001,47,0,52,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,952.3001065999999,{"$nulls":3},22,0.44680851063829785,1.1063829787234043,0,0,0,0,0,0,0.3150684931506849,-0.2127659574468085,1.1063829787234043,1,0.46808510638297873,"C47H52O21","O21","CHO","Lignin",6]
[952.3225733999999,0,0,0,0,0,0,2782367,0,0,0,0,0,0,0,0,0,0,0,951.3158548000001,45,0,52,0,19,0,4,0,0,0,0,0,0,0,0,0,0,null,952.3225733999999,{"$nulls":3},22,0.4222222222222222,1.1555555555555554,0.08888888888888889,0,0,0,0,0,0.2698412698412698,-0.044444444444444446,1.1555555555555554,3,0.4888888888888889,"C45H52O19N4","O19N4","CHON","Lignin",6]
[952.336492,2899753,0,0,0,0,0,3150994,0,0,0,2843816,0,3033787,3164796,0,0,0,0,951.329497875,48,0,56,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,952.336492,{"$nulls":3},21,0.4166666666666667,1.1666666666666667,0,0,0,0,0,0,0.2894736842105263,-0.3333333333333333,1.1666666666666667,1,0.4375,"C48H56O20","O20","CHO","Lignin",6]
[952.3576212,0,3159005,0,0,0,0,0,0,0,3107056,0,0,0,0,0,0,0,0,951.3507153333334,45,0,60,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,952.3576212,{"$nulls":3},16,0.4888888888888889,1.3333333333333333,0,0,0,0,0,0,0.14705882352941177,-0.35555555555555557,1.3333333333333333,-6,0.35555555555555557,"C45H60O22","O22","CHO","Lignin",6]
[952.3728774,0,0,0,0,0,0,0,0,0,2779371,0,0,0,0,0,0,0,0,951.3662897500001,49,0,60,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,952.3728774,{"$nulls":3},20,0.3877551020408163,1.2244897959183674,0,0,0,0,0,0,0.26582278481012656,-0.4489795918367347,1.2244897959183674,1,0.40816326530612246,"C49H60O19","O19","CHO","Lignin",6]
[953.3810129,0,0,0,0,0,0,0,3090782,0,0,0,0,0,0,0,0,0,0,952.37293,45,0,64,0,19,0,1,0,0,0,0,1,0,0,0,0,0,null,953.3810129,{"$nulls":3},15,0.4222222222222222,1.4222222222222223,0.022222222222222223,0,0.022222222222222223,0,0,0,0.1044776119402985,-0.6222222222222222,1.4222222222222223,-4,0.3333333333333333,"C45H64O19N1P1","O19N1P1","CHONP","Lignin",6]
[954.2429858,0,0,0,0,0,0,0,0,0,0,0,0,2917619,0,0,0,0,0,953.235978,45,0,46,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,954.2429858,{"$nulls":3},23,0.5111111111111111,1.0222222222222221,0,0,0,0,0,0,0.34328358208955223,0,1.0222222222222221,0,0.5111111111111111,"C45H46O23","O23","CHO","Lignin",6]
[954.2793712,2831415,0,0,0,2924892,0,0,0,0,0,2772380,2748932,0,0,0,0,0,0,953.2728005384615,46,0,50,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,954.2793712,{"$nulls":3},22,0.4782608695652174,1.0869565217391304,0,0,0,0,0,0,0.3142857142857143,-0.13043478260869565,1.0869565217391304,0,0.4782608695652174,"C46H50O22","O22","CHO","Lignin",6]
[954.3157566,3732522,0,0,0,0,0,4057509,0,0,3503748,3190140,3204583,3763388,0,0,0,0,0,953.3089991818182,47,0,54,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,954.3157566,{"$nulls":3},21,0.44680851063829785,1.148936170212766,0,0,0,0,0,0,0.2876712328767123,-0.2553191489361702,1.148936170212766,0,0.44680851063829785,"C47H54O21","O21","CHO","Lignin",6]
[954.3368858,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2786621,0,953.3300807500001,44,0,58,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,954.3368858,{"$nulls":3},16,0.5227272727272727,1.3181818181818181,0,0,0,0,0,0,0.13846153846153847,-0.2727272727272727,1.3181818181818181,-7,0.36363636363636365,"C44H58O23","O23","CHO","Lignin",6]
[954.352142,0,0,0,0,2748703,0,4225413,0,2993430,3260025,0,0,2796705,3305779,0,0,0,3211802,953.3453213076923,48,0,58,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,954.352142,{"$nulls":3},20,0.4166666666666667,1.2083333333333333,0,0,0,0,0,0,0.2631578947368421,-0.375,1.2083333333333333,0,0.4166666666666667,"C48H58O20","O20","CHO","Lignin",6]
[954.3885273999999,0,0,0,2849264,0,0,2990438,0,3324153,0,2978105,0,0,0,0,2766768,0,0,953.3816893,49,0,62,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,954.3885273999999,{"$nulls":3},19,0.3877551020408163,1.2653061224489797,0,0,0,0,0,0,0.24050632911392406,-0.4897959183673469,1.2653061224489797,0,0.3877551020408163,"C49H62O19","O19","CHO","Lignin",6]
[954.4249127999999,0,0,0,0,0,0,0,0,2723036,0,0,0,0,0,0,0,0,2729440,953.4177166666667,50,0,66,0,18,0,0,0,0,0,0,0,0,0,0,0,0,null,954.4249127999999,{"$nulls":3},18,0.36,1.32,0,0,0,0,0,0,0.21951219512195122,-0.6,1.32,0,0.36,"C50H66O18","O18","CHO","Lignin",6]
[954.7360931,0,0,0,0,0,2767013,0,0,0,0,0,0,0,0,0,0,0,0,953.728808,49,0,103,0,11,0,4,0,0,0,0,1,0,0,0,0,0,null,954.7360931,{"$nulls":3},1,0.22448979591836735,2.1020408163265305,0.08163265306122448,0,0.02040816326530612,0,0,0,0,-1.510204081632653,2.1020408163265305,-10,0.02040816326530612,"C49H103O11N4P1","O11N4P1","CHONP","N-ConSatCom",3]
[956.2222504,0,0,3846294,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,955.2145373333334,44,0,44,0,24,0,0,0,0,0,0,0,0,0,0,0,0,null,956.2222504,{"$nulls":3},23,0.5454545454545454,1,0,0,0,0,0,0,0.34375,0.09090909090909091,1,-1,0.5227272727272727,"C44H44O24","O24","CHO","Lignin",6]
[956.2586358,3496308,0,0,0,0,0,2865983,0,0,0,0,0,0,0,0,3000282,0,0,955.251567857143,45,0,48,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,956.2586358,{"$nulls":3},22,0.5111111111111111,1.0666666666666667,0,0,0,0,0,0,0.31343283582089554,-0.044444444444444446,1.0666666666666667,-1,0.4888888888888889,"C45H48O23","O23","CHO","Lignin",6]
[956.2950212,3694951,0,4171876,0,2795263,0,3556129,0,0,3165253,3608251,4039662,0,0,0,3466163,0,3321870,955.2883607142859,46,0,52,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,956.2950212,{"$nulls":3},21,0.4782608695652174,1.1304347826086956,0,0,0,0,0,0,0.2857142857142857,-0.17391304347826086,1.1304347826086956,-1,0.45652173913043476,"C46H52O22","O22","CHO","Lignin",6]
[956.3314066,3015003,2957765,0,4597502,2814692,0,3656451,0,3639057,4596795,3706524,3904466.0000000005,3559165,0,0,4293518,3570215.9999999995,3988466,955.3246397142858,47,0,56,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,956.3314066,{"$nulls":3},20,0.44680851063829785,1.1914893617021276,0,0,0,0,0,0,0.2602739726027397,-0.2978723404255319,1.1914893617021276,-1,0.425531914893617,"C47H56O21","O21","CHO","Lignin",6]
[956.367792,0,0,0,2909916,0,0,5149413.999999999,0,3534580,3933233,3763838,0,3835620,0,0,3787623,0,0,955.3610404615386,48,0,60,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,956.367792,{"$nulls":3},19,0.4166666666666667,1.25,0,0,0,0,0,0,0.23684210526315788,-0.4166666666666667,1.25,-1,0.3958333333333333,"C48H60O20","O20","CHO","Lignin",6]
[956.4041774,0,0,0,0,0,0,3052232,0,0,0,0,3610524,0,0,0,0,2984426,0,955.397344875,49,0,64,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,956.4041774,{"$nulls":3},18,0.3877551020408163,1.3061224489795917,0,0,0,0,0,0,0.21518987341772153,-0.5306122448979592,1.3061224489795917,-1,0.3673469387755102,"C49H64O19","O19","CHO","Lignin",6]
[956.405515,0,0,0,0,0,0,0,0,0,0,0,0,0,3516458,0,0,0,0,955.3988993333332,50,0,60,0,15,0,4,0,0,0,0,0,0,0,0,0,0,null,956.405515,{"$nulls":3},23,0.3,1.2,0.08,0,0,0,0,0,0.2987012987012987,-0.36,1.2,8,0.46,"C50H60O15N4","O15N4","CHON","Lignin",6]
[956.4407791000001,2779446,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,955.4343683999999,43,0,76,0,15,0,2,0,3,0,0,0,0,0,0,0,0,null,956.4407791000001,{"$nulls":3},7,0.3488372093023256,1.7674418604651163,0.046511627906976744,0.06976744186046512,0,0,0,0,0,-0.7906976744186046,1.7674418604651163,-8,0.16279069767441862,"C43H76O15N2S3","O15N2S3","CHONS","N-ConSatCom",3]
[957.3251543,0,0,0,0,0,0,0,0,0,3035951,0,0,0,0,0,0,0,0,956.3183036666666,40,0,64,0,19,0,1,0,2,0,0,1,0,0,0,0,0,null,957.3251543,{"$nulls":3},10,0.475,1.6,0.025,0.05,0.025,0,0,0,0,-0.6,1.6,-9,0.25,"C40H64O19N1S2P1","O19N1S2P1","CHONSP","N-ConSatCom",3]
[958.1803858000001,0,0,3091325,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,957.172839,46,0,38,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,958.1803858000001,{"$nulls":3},28,0.5,0.8260869565217391,0,0,0,0,0,0,0.4782608695652174,0.17391304347826086,0.8260869565217391,5,0.6086956521739131,"C46H38O23","O23","CHO","Lignin",6]
[958.2167712,0,0,2792295,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,957.209058,47,0,42,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,958.2167712,{"$nulls":3},27,0.46808510638297873,0.8936170212765957,0,0,0,0,0,0,0.4444444444444444,0.0425531914893617,0.8936170212765957,5,0.574468085106383,"C47H42O22","O22","CHO","Lignin",6]
[958.2379004000001,0,0,0,0,0,0,0,0,0,0,0,2978421,0,0,0,0,0,0,957.2311655,44,0,46,0,24,0,0,0,0,0,0,0,0,0,0,0,0,null,958.2379004000001,{"$nulls":3},22,0.5454545454545454,1.0454545454545454,0,0,0,0,0,0,0.3125,0.045454545454545456,1.0454545454545454,-2,0.5,"C44H46O24","O24","CHO","Lignin",6]
[958.2742858,3778273,3163012,0,0,0,0,3269901,0,0,0,0,3520092,0,0,0,0,0,0,957.2673979166666,45,0,50,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,958.2742858,{"$nulls":3},21,0.5111111111111111,1.1111111111111112,0,0,0,0,0,0,0.2835820895522388,-0.08888888888888889,1.1111111111111112,-2,0.4666666666666667,"C45H50O23","O23","CHO","Lignin",6]
[958.3106712,4814550,4616039.000000001,3664681,0,0,0,3958001,0,0,4418097,2869330,3471938,3238331,0,0,4690888,3178390,4134445,957.303961142857,46,0,54,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,958.3106712,{"$nulls":3},20,0.4782608695652174,1.173913043478261,0,0,0,0,0,0,0.2571428571428571,-0.21739130434782608,1.173913043478261,-2,0.43478260869565216,"C46H54O22","O22","CHO","Lignin",6]
[958.3219046,0,0,0,0,0,0,0,0,0,0,0,0,0,0,3874799,0,0,0,957.314532,45,0,54,0,21,0,2,0,0,0,0,0,0,0,0,0,0,null,958.3219046,{"$nulls":3},20,0.4666666666666667,1.2,0.044444444444444446,0,0,0,0,0,0.23076923076923078,-0.13333333333333333,1.2,-1,0.4444444444444444,"C45H54O21N2","O21N2","CHON","Lignin",6]
[958.3470566,3580618,2973515,3405586,3248186,0,0,6350037,2722502,3400020.0000000005,4016680,3459126,3430952,3482019,0,0,3378084,2798456,3571220,957.3403806250001,47,0,58,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,958.3470566,{"$nulls":3},19,0.44680851063829785,1.2340425531914894,0,0,0,0,0,0,0.2328767123287671,-0.3404255319148936,1.2340425531914894,-2,0.40425531914893614,"C47H58O21","O21","CHO","Lignin",6]
[958.383442,3179199,3637037,0,0,0,0,3300537,0,2904379,3668511,4853785,0,2858379,2841513,0,3054465,0,3443194,957.3766339285713,48,0,62,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,958.383442,{"$nulls":3},18,0.4166666666666667,1.2916666666666667,0,0,0,0,0,0,0.21052631578947367,-0.4583333333333333,1.2916666666666667,-2,0.375,"C48H62O20","O20","CHO","Lignin",6]
[958.4198273999999,0,0,0,0,0,0,0,0,0,3150358,2818045,0,2952563,0,0,0,0,0,957.4131181428572,49,0,66,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,958.4198273999999,{"$nulls":3},17,0.3877551020408163,1.346938775510204,0,0,0,0,0,0,0.189873417721519,-0.5714285714285714,1.346938775510204,-2,0.3469387755102041,"C49H66O19","O19","CHO","Lignin",6]
[959.2695348,0,0,0,0,0,0,0,0,0,0,0,3480502,0,0,0,0,0,0,958.2625475,44,0,49,0,23,0,1,0,0,0,0,0,0,0,0,0,0,null,959.2695348,{"$nulls":3},21,0.5227272727272727,1.1136363636363635,0.022727272727272728,0,0,0,0,0,0.2698412698412698,0,1.1136363636363635,-2,0.4772727272727273,"C44H49O23N1","O23N1","CHON","Lignin",6]
[959.3423055999999,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2844502,958.334947,46,0,57,0,21,0,1,0,0,0,0,0,0,0,0,0,0,null,959.3423055999999,{"$nulls":3},19,0.45652173913043476,1.2391304347826086,0.021739130434782608,0,0,0,0,0,0.21739130434782608,-0.2608695652173913,1.2391304347826086,-2,0.41304347826086957,"C46H57O21N1","O21N1","CHON","Lignin",6]
[959.3771896999999,0,0,0,0,0,0,0,0,0,0,0,2966383,0,0,0,0,0,0,958.370349,41,0,70,0,18,0,1,0,2,0,0,1,0,0,0,0,0,null,959.3771896999999,{"$nulls":3},8,0.43902439024390244,1.7073170731707317,0.024390243902439025,0.04878048780487805,0.024390243902439025,0,0,0,0,-0.7804878048780488,1.7073170731707317,-10,0.1951219512195122,"C41H70O18N1S2P1","O18N1S2P1","CHONSP","N-ConSatCom",3]
[960.0972638000001,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2745664,0,0,959.0898,44,0,33,0,21,0,0,0,1,0,0,1,0,0,0,0,0,null,960.0972638000001,{"$nulls":3},29,0.4772727272727273,0.75,0,0.022727272727272728,0.022727272727272728,0,0,0,0.5238095238095238,0.13636363636363635,0.75,8,0.6590909090909091,"C44H33O21S1P1","O21S1P1","CHOSP","Lignin",6]
[960.2535504,0,0,2730627,0,0,0,3420013,0,0,0,2927259,0,0,0,0,0,0,0,959.2472328888889,44,0,48,0,24,0,0,0,0,0,0,0,0,0,0,0,0,null,960.2535504,{"$nulls":3},21,0.5454545454545454,1.0909090909090908,0,0,0,0,0,0,0.28125,0,1.0909090909090908,-3,0.4772727272727273,"C44H48O24","O24","CHO","Lignin",6]
[960.2899358,4056205,2820482,0,0,0,0,4394836,0,0,4530266,0,0,3284189,0,0,4215956,0,0,959.2831735833333,45,0,52,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,960.2899358,{"$nulls":3},20,0.5111111111111111,1.1555555555555554,0,0,0,0,0,0,0.2537313432835821,-0.13333333333333333,1.1555555555555554,-3,0.4444444444444444,"C45H52O23","O23","CHO","Lignin",6]
[960.2969492999999,0,0,0,0,0,0,0,0,0,0,0,2825498,0,0,0,0,0,0,959.2901615000001,49,0,53,0,18,0,0,0,0,0,0,1,0,0,0,0,0,null,960.2969492999999,{"$nulls":3},24,0.3673469387755102,1.0816326530612246,0,0,0.02040816326530612,0,0,0,0.358974358974359,-0.4489795918367347,1.0816326530612246,6,0.4897959183673469,"C49H53O18P1","O18P1","CHOP","Lignin",6]
[960.3263212,4013187,3835239,0,3327506,0,0,4628284,2851605,0,4966482,4639335,2943239,3251398,0,0,4684915.000000001,0,4034748,959.3197890624999,46,0,56,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,960.3263212,{"$nulls":3},19,0.4782608695652174,1.2173913043478262,0,0,0,0,0,0,0.22857142857142856,-0.2608695652173913,1.2173913043478262,-3,0.41304347826086957,"C46H56O22","O22","CHO","Lignin",6]
[960.3627066,4025464.9999999995,2906444,0,2979319,3266419,0,4450081,0,3332104,4833353,3801677,3398896,3620017,2711427,0,4043858,0,3512484,959.3561438124999,47,0,60,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,960.3627066,{"$nulls":3},18,0.44680851063829785,1.2765957446808511,0,0,0,0,0,0,0.2054794520547945,-0.3829787234042553,1.2765957446808511,-3,0.3829787234042553,"C47H60O21","O21","CHO","Lignin",6]
[960.399092,2901102,0,0,2738137,0,0,3991304,0,2924529,0,3405363,0,2919579,0,0,0,3018029,0,959.3922421428571,48,0,64,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,960.399092,{"$nulls":3},17,0.4166666666666667,1.3333333333333333,0,0,0,0,0,0,0.18421052631578946,-0.5,1.3333333333333333,-3,0.3541666666666667,"C48H64O20","O20","CHO","Lignin",6]
[960.4354774,0,0,0,0,0,0,3343088,0,0,0,0,0,0,0,0,0,0,3465332,959.42812675,49,0,68,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,960.4354774,{"$nulls":3},16,0.3877551020408163,1.3877551020408163,0,0,0,0,0,0,0.16455696202531644,-0.6122448979591837,1.3877551020408163,-3,0.32653061224489793,"C49H68O19","O19","CHO","Lignin",6]
[961.2860532,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,3122765,960.279296,45,0,55,0,18,0,1,0,2,0,0,0,0,0,0,0,0,null,961.2860532,{"$nulls":3},19,0.4,1.2222222222222223,0.022222222222222223,0.044444444444444446,0,0,0,0,0.21212121212121213,-0.26666666666666666,1.2222222222222223,1,0.4222222222222222,"C45H55O18N1S2","O18N1S2","CHONS","Lignin",6]
[961.3224386,0,0,0,0,0,0,3063959,0,0,0,0,0,0,0,0,0,0,0,960.3155546666667,46,0,59,0,17,0,1,0,2,0,0,0,0,0,0,0,0,null,961.3224386,{"$nulls":3},18,0.3695652173913043,1.2826086956521738,0.021739130434782608,0.043478260869565216,0,0,0,0,0.18840579710144928,-0.391304347826087,1.2826086956521738,1,0.391304347826087,"C46H59O17N1S2","O17N1S2","CHONS","Lignin",6]
[962.2341526,3055242,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,961.227438,44,0,42,0,21,0,4,0,0,0,0,0,0,0,0,0,0,null,962.2341526,{"$nulls":3},26,0.4772727272727273,0.9545454545454546,0.09090909090909091,0,0,0,0,0,0.3898305084745763,0.2727272727272727,0.9545454545454546,5,0.5909090909090909,"C44H42O21N4","O21N4","CHON","Lignin",6]
[962.2700688,3128961,0,0,0,0,0,3282484,0,0,3459765,3354929,0,0,0,0,3293687,0,0,961.26321575,45,0,54,0,19,0,0,0,2,0,0,0,0,0,0,0,0,null,962.2700688,{"$nulls":3},19,0.4222222222222222,1.2,0,0.044444444444444446,0,0,0,0,0.22388059701492538,-0.26666666666666666,1.2,0,0.4222222222222222,"C45H54O19S2","O19S2","CHOS","Lignin",6]
[962.3055858,4393592,0,0,0,0,0,3669532,0,3059548,4722349.999999999,3288345,3271768,3326039,2881484,0,0,2814931.0000000005,0,961.2992505,45,0,54,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,962.3055858,{"$nulls":3},19,0.5111111111111111,1.2,0,0,0,0,0,0,0.22388059701492538,-0.17777777777777778,1.2,-4,0.4222222222222222,"C45H54O23","O23","CHO","Lignin",6]
[962.3419712,3256943,3316716,0,0,0,0,4571654,0,4323142.000000001,4198055,0,0,4116547,2720699,0,3685820,0,3163072,961.3356666666667,46,0,58,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,962.3419712,{"$nulls":3},18,0.4782608695652174,1.2608695652173914,0,0,0,0,0,0,0.2,-0.30434782608695654,1.2608695652173914,-4,0.391304347826087,"C46H58O22","O22","CHO","Lignin",6]
[962.3783566,3183206,0,0,0,0,0,3701230,0,3801905.9999999995,3547808,0,0,3815471,0,0,3827104,3116961,0,961.3717386363635,47,0,62,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,962.3783566,{"$nulls":3},17,0.44680851063829785,1.3191489361702127,0,0,0,0,0,0,0.1780821917808219,-0.425531914893617,1.3191489361702127,-4,0.3617021276595745,"C47H62O21","O21","CHO","Lignin",6]
[963.2678201,0,0,0,0,0,0,0,0,0,3068404,0,0,0,0,0,0,0,0,962.261051,40,0,53,0,24,0,1,0,1,0,0,0,0,0,0,0,0,null,963.2678201,{"$nulls":3},15,0.6,1.325,0.025,0.025,0,0,0,0,0.038461538461538464,0,1.325,-9,0.375,"C40H53O24N1S1","O24N1S1","CHONS","Lignin",6]
[964.1909504,0,0,2780757,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,963.1840525,45,0,40,0,24,0,0,0,0,0,0,0,0,0,0,0,0,null,964.1909504,{"$nulls":3},26,0.5333333333333333,0.8888888888888888,0,0,0,0,0,0,0.42424242424242425,0.17777777777777778,0.8888888888888888,2,0.5777777777777777,"C45H40O24","O24","CHO","Lignin",6]
[964.2848504,0,0,0,0,0,0,2919809,0,0,3060028,0,0,2959447,0,0,0,0,0,963.2782622857143,44,0,52,0,24,0,0,0,0,0,0,0,0,0,0,0,0,null,964.2848504,{"$nulls":3},19,0.5454545454545454,1.1818181818181819,0,0,0,0,0,0,0.21875,-0.09090909090909091,1.1818181818181819,-5,0.4318181818181818,"C44H52O24","O24","CHO","Lignin",6]
[964.3212358000001,2918561,0,0,0,0,0,3881325,0,2663166,3749174,0,0,0,0,0,3495883,0,3176280,963.3147488000002,45,0,56,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,964.3212358000001,{"$nulls":3},18,0.5111111111111111,1.2444444444444445,0,0,0,0,0,0,0.19402985074626866,-0.2222222222222222,1.2444444444444445,-5,0.4,"C45H56O23","O23","CHO","Lignin",6]
[964.3576212,0,0,0,0,0,0,4119896,0,0,0,0,0,3547188,0,0,3534769,0,2927428,963.3508352500002,46,0,60,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,964.3576212,{"$nulls":3},17,0.4782608695652174,1.3043478260869565,0,0,0,0,0,0,0.17142857142857143,-0.34782608695652173,1.3043478260869565,-5,0.3695652173913043,"C46H60O22","O22","CHO","Lignin",6]
[964.3940066,2944146,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2771761,963.387011,47,0,64,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,964.3940066,{"$nulls":3},16,0.44680851063829785,1.3617021276595744,0,0,0,0,0,0,0.1506849315068493,-0.46808510638297873,1.3617021276595744,-5,0.3404255319148936,"C47H64O21","O21","CHO","Lignin",6]
[966.2793712,2751252,3396310,0,0,0,0,0,0,0,2954234,0,0,0,0,0,0,0,0,965.2722463333334,47,0,50,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,966.2793712,{"$nulls":3},23,0.46808510638297873,1.0638297872340425,0,0,0,0,0,0,0.3333333333333333,-0.1276595744680851,1.0638297872340425,1,0.48936170212765956,"C47H50O22","O22","CHO","Lignin",6]
[966.3157566,2880269,0,0,0,0,0,3346775,0,2668333.9999999995,0,2847747,0,0,0,0,0,0,0,965.3089382727271,48,0,54,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,966.3157566,{"$nulls":3},22,0.4375,1.125,0,0,0,0,0,0,0.30666666666666664,-0.25,1.125,1,0.4583333333333333,"C48H54O21","O21","CHO","Lignin",6]
[966.3368858,0,0,0,0,0,0,2812236,0,0,0,0,0,0,0,0,0,0,0,965.3300290000001,45,0,58,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,966.3368858,{"$nulls":3},17,0.5111111111111111,1.288888888888889,0,0,0,0,0,0,0.16417910447761194,-0.26666666666666666,1.288888888888889,-6,0.37777777777777777,"C45H58O23","O23","CHO","Lignin",6]
[966.352142,0,3219120,0,0,2859523,0,0,0,2866973,3537903,0,0,0,0,0,0,0,0,965.345351375,49,0,58,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,966.352142,{"$nulls":3},21,0.40816326530612246,1.183673469387755,0,0,0,0,0,0,0.28205128205128205,-0.3673469387755102,1.183673469387755,1,0.42857142857142855,"C49H58O20","O20","CHO","Lignin",6]
[966.3732712,0,0,0,0,0,0,3275066,0,0,0,3035110,0,0,0,0,3664474,0,0,965.3667982,46,0,62,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,966.3732712,{"$nulls":3},16,0.4782608695652174,1.3478260869565217,0,0,0,0,0,0,0.14285714285714285,-0.391304347826087,1.3478260869565217,-6,0.34782608695652173,"C46H62O22","O22","CHO","Lignin",6]
[966.3885273999999,0,0,0,0,0,0,0,0,0,0,3490783,0,0,0,0,0,0,0,965.3811374000001,50,0,62,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,966.3885273999999,{"$nulls":3},20,0.38,1.24,0,0,0,0,0,0,0.25925925925925924,-0.48,1.24,1,0.4,"C50H62O19","O19","CHO","Lignin",6]
[966.4242607,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2763271,0,965.4178135,43,0,70,0,20,0,2,0,1,0,0,0,0,0,0,0,0,null,966.4242607,{"$nulls":3},10,0.46511627906976744,1.627906976744186,0.046511627906976744,0.023255813953488372,0,0,0,0,0,-0.5116279069767442,1.627906976744186,-10,0.23255813953488372,"C43H70O20N2S1","O20N2S1","CHONS","N-ConSatCom",3]
[968.2433795999999,3109313,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,967.235949,42,0,48,0,26,0,0,0,0,0,0,0,0,0,0,0,0,null,968.2433795999999,{"$nulls":3},19,0.6190476190476191,1.1428571428571428,0,0,0,0,0,0,0.20689655172413793,0.09523809523809523,1.1428571428571428,-7,0.4523809523809524,"C42H48O26","O26","CHO","Lignin",6]
[968.2950212,0,3066642,0,0,0,0,3120601,0,0,0,0,0,0,0,0,0,0,0,967.2884207142857,47,0,52,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,968.2950212,{"$nulls":3},22,0.46808510638297873,1.1063829787234043,0,0,0,0,0,0,0.3055555555555556,-0.1702127659574468,1.1063829787234043,0,0.46808510638297873,"C47H52O22","O22","CHO","Lignin",6]
[968.3314066,3091891,2912002,0,0,3288736,0,2997706,2661276,0,2790113,0,0,0,2834106,0,3491298,0,2927612,967.3247493846155,48,0,56,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,968.3314066,{"$nulls":3},21,0.4375,1.1666666666666667,0,0,0,0,0,0,0.28,-0.2916666666666667,1.1666666666666667,0,0.4375,"C48H56O21","O21","CHO","Lignin",6]
[968.367792,0,0,0,0,0,0,0,0,0,3012317,0,0,2748822,0,0,0,0,0,967.361089,49,0,60,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,968.367792,{"$nulls":3},20,0.40816326530612246,1.2244897959183674,0,0,0,0,0,0,0.2564102564102564,-0.40816326530612246,1.2244897959183674,0,0.40816326530612246,"C49H60O20","O20","CHO","Lignin",6]
[968.4041774,0,0,0,0,0,0,0,0,0,0,0,0,2801034,0,0,0,0,0,967.3968195000001,50,0,64,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,968.4041774,{"$nulls":3},19,0.38,1.28,0,0,0,0,0,0,0.2345679012345679,-0.52,1.28,0,0.38,"C50H64O19","O19","CHO","Lignin",6]
[969.3353867000001,0,0,0,0,0,0,0,0,0,2795115,0,0,0,0,0,0,0,0,968.327684,50,0,55,0,15,0,3,0,1,0,0,0,0,0,0,0,0,null,969.3353867000001,{"$nulls":3},25,0.3,1.1,0.06,0.02,0,0,0,0,0.35064935064935066,-0.28,1.1,10,0.5,"C50H55O15N3S1","O15N3S1","CHONS","Lignin",6]
[970.2742858,0,0,2691400,0,0,0,0,0,0,0,3154274,0,0,2711716,0,0,0,0,969.267206,46,0,50,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,970.2742858,{"$nulls":3},22,0.5,1.0869565217391304,0,0,0,0,0,0,0.30434782608695654,-0.08695652173913043,1.0869565217391304,-1,0.4782608695652174,"C46H50O23","O23","CHO","Lignin",6]
[970.3106712,3624092,2716660,0,0,0,0,3166950,0,0,3464708,2922838,0,4199201,0,0,0,2736948,0,969.3038146923077,47,0,54,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,970.3106712,{"$nulls":3},21,0.46808510638297873,1.148936170212766,0,0,0,0,0,0,0.2777777777777778,-0.2127659574468085,1.148936170212766,-1,0.44680851063829785,"C47H54O22","O22","CHO","Lignin",6]
[970.3470566,2755735,2821094,0,0,0,0,3775194,0,0,3658240,3247433,0,0,0,0,2908687,0,2886949,969.3400679285714,48,0,58,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,970.3470566,{"$nulls":3},20,0.4375,1.2083333333333333,0,0,0,0,0,0,0.25333333333333335,-0.3333333333333333,1.2083333333333333,-1,0.4166666666666667,"C48H58O21","O21","CHO","Lignin",6]
[970.383442,0,0,0,2656104.0000000005,0,0,3242702,0,0,3130877,0,0,0,0,0,3242495,0,0,969.3762153636363,49,0,62,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,970.383442,{"$nulls":3},19,0.40816326530612246,1.2653061224489797,0,0,0,0,0,0,0.23076923076923078,-0.4489795918367347,1.2653061224489797,-1,0.3877551020408163,"C49H62O20","O20","CHO","Lignin",6]
[970.4198273999999,0,0,0,0,0,0,0,0,0,0,0,0,3009281,0,0,0,0,2801934,969.4129735999999,50,0,66,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,970.4198273999999,{"$nulls":3},18,0.38,1.32,0,0,0,0,0,0,0.20987654320987653,-0.56,1.32,-1,0.36,"C50H66O19","O19","CHO","Lignin",6]
[971.3129337,0,0,0,0,0,0,0,0,0,3077542,0,0,0,0,0,0,0,0,970.305476,50,0,54,0,17,0,1,0,0,0,0,1,0,0,0,0,0,null,971.3129337,{"$nulls":3},25,0.34,1.08,0.02,0,0.02,0,0,0,0.3670886075949367,-0.44,1.08,8,0.5,"C50H54O17N1P1","O17N1P1","CHONP","Lignin",6]
[971.3423055999999,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2678776,970.334448,47,0,57,0,21,0,1,0,0,0,0,0,0,0,0,0,0,null,971.3423055999999,{"$nulls":3},20,0.44680851063829785,1.2127659574468086,0.02127659574468085,0,0,0,0,0,0.23943661971830985,-0.2553191489361702,1.2127659574468086,-1,0.425531914893617,"C47H57O21N1","O21N1","CHON","Lignin",6]
[972.1531253,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2963285,0,0,971.146223,45,0,36,0,21,0,2,0,1,0,0,0,0,0,0,0,0,null,972.1531253,{"$nulls":3},29,0.4666666666666667,0.8,0.044444444444444446,0.022222222222222223,0,0,0,0,0.49206349206349204,0.3111111111111111,0.8,8,0.6444444444444445,"C45H36O21N2S1","O21N2S1","CHONS","Lignin",6]
[972.2899358,0,2835850,0,0,0,0,2827422,0,0,3425622,0,0,0,0,0,0,0,0,971.2828465714286,46,0,52,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,972.2899358,{"$nulls":3},21,0.5,1.1304347826086956,0,0,0,0,0,0,0.2753623188405797,-0.13043478260869565,1.1304347826086956,-2,0.45652173913043476,"C46H52O23","O23","CHO","Lignin",6]
[972.3263212,3824573,0,0,0,0,0,3331221,0,0,3192148,0,0,3760413.0000000005,0,0,0,0,0,971.3193018333333,47,0,56,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,972.3263212,{"$nulls":3},20,0.46808510638297873,1.1914893617021276,0,0,0,0,0,0,0.25,-0.2553191489361702,1.1914893617021276,-2,0.425531914893617,"C47H56O22","O22","CHO","Lignin",6]
[972.3627066,2742201,3582326,0,0,0,0,3596427,0,0,0,3742438,0,2829589,0,0,0,0,3015402,971.3554464000001,48,0,60,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,972.3627066,{"$nulls":3},19,0.4375,1.25,0,0,0,0,0,0,0.22666666666666666,-0.375,1.25,-2,0.3958333333333333,"C48H60O21","O21","CHO","Lignin",6]
[972.399092,0,0,0,0,0,0,3082370,0,0,0,0,0,0,0,0,3948291,0,2924257,971.391694125,49,0,64,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,972.399092,{"$nulls":3},18,0.40816326530612246,1.3061224489795917,0,0,0,0,0,0,0.20512820512820512,-0.4897959183673469,1.3061224489795917,-2,0.3673469387755102,"C49H64O20","O20","CHO","Lignin",6]
[972.4384681000001,0,0,0,0,0,0,0,0,0,0,0,0,0,2857683,0,0,0,0,971.430225,49,0,69,0,16,0,2,0,0,0,0,1,0,0,0,0,0,null,972.4384681000001,{"$nulls":3},17,0.32653061224489793,1.4081632653061225,0.04081632653061224,0,0.02040816326530612,0,0,0,0.15789473684210525,-0.7346938775510204,1.4081632653061225,1,0.3469387755102041,"C49H69O16N2P1","O16N2P1","CHONP","Lignin",6]
[974.3055858,0,0,0,0,0,0,0,0,0,3314899,0,0,0,0,0,0,0,0,973.2979483333334,46,0,54,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,974.3055858,{"$nulls":3},20,0.5,1.173913043478261,0,0,0,0,0,0,0.2463768115942029,-0.17391304347826086,1.173913043478261,-3,0.43478260869565216,"C46H54O23","O23","CHO","Lignin",6]
[974.3419712,2873112,2827184,0,0,0,0,2821854,0,0,3600593,2995496,0,0,0,0,0,0,0,973.3347839999998,47,0,58,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,974.3419712,{"$nulls":3},19,0.46808510638297873,1.2340425531914894,0,0,0,0,0,0,0.2222222222222222,-0.2978723404255319,1.2340425531914894,-3,0.40425531914893614,"C47H58O22","O22","CHO","Lignin",6]
[974.3783566,0,0,0,0,0,0,0,0,3339612,0,4464930,0,0,0,0,3686615,0,0,973.3715729999998,48,0,62,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,974.3783566,{"$nulls":3},18,0.4375,1.2916666666666667,0,0,0,0,0,0,0.2,-0.4166666666666667,1.2916666666666667,-3,0.375,"C48H62O21","O21","CHO","Lignin",6]
[974.4147419999999,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2831567,0,0,973.4077101666667,49,0,66,0,20,0,0,0,0,0,0,0,0,0,0,0,0,null,974.4147419999999,{"$nulls":3},17,0.40816326530612246,1.346938775510204,0,0,0,0,0,0,0.1794871794871795,-0.5306122448979592,1.346938775510204,-3,0.3469387755102041,"C49H66O20","O20","CHO","Lignin",6]
[974.4511273999999,0,0,0,0,0,0,2794186,0,0,0,0,0,0,0,0,0,0,0,973.4434535,50,0,70,0,19,0,0,0,0,0,0,0,0,0,0,0,0,null,974.4511273999999,{"$nulls":3},16,0.38,1.4,0,0,0,0,0,0,0.16049382716049382,-0.64,1.4,-3,0.32,"C50H70O19","O19","CHO","Lignin",6]
[976.2848504,0,0,0,0,0,0,0,0,0,2921594,0,0,0,0,0,0,0,0,975.2778265,45,0,52,0,24,0,0,0,0,0,0,0,0,0,0,0,0,null,976.2848504,{"$nulls":3},20,0.5333333333333333,1.1555555555555554,0,0,0,0,0,0,0.24242424242424243,-0.08888888888888889,1.1555555555555554,-4,0.4444444444444444,"C45H52O24","O24","CHO","Lignin",6]
[976.3212358000001,0,0,0,0,0,0,0,0,0,2939001,0,0,0,0,0,0,0,0,975.3142273999999,46,0,56,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,976.3212358000001,{"$nulls":3},19,0.5,1.2173913043478262,0,0,0,0,0,0,0.21739130434782608,-0.21739130434782608,1.2173913043478262,-4,0.41304347826086957,"C46H56O23","O23","CHO","Lignin",6]
[976.3576212,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2749272,0,0,975.3504081666669,47,0,60,0,22,0,0,0,0,0,0,0,0,0,0,0,0,null,976.3576212,{"$nulls":3},18,0.46808510638297873,1.2765957446808511,0,0,0,0,0,0,0.19444444444444445,-0.3404255319148936,1.2765957446808511,-4,0.3829787234042553,"C47H60O22","O22","CHO","Lignin",6]
[976.3940066,0,0,0,0,0,0,0,0,0,2882679,0,0,2718359,0,0,0,0,0,975.3867352,48,0,64,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,976.3940066,{"$nulls":3},17,0.4375,1.3333333333333333,0,0,0,0,0,0,0.17333333333333334,-0.4583333333333333,1.3333333333333333,-4,0.3541666666666667,"C48H64O21","O21","CHO","Lignin",6]
[978.2429858,0,0,2926672,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,977.2350349999999,47,0,46,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,978.2429858,{"$nulls":3},25,0.48936170212765956,0.9787234042553191,0,0,0,0,0,0,0.38028169014084506,0,0.9787234042553191,2,0.5319148936170213,"C47H46O23","O23","CHO","Lignin",6]
[978.3368858,0,0,0,0,0,0,2839809,0,0,0,0,0,0,0,0,2878066,0,0,977.3295758,46,0,58,0,23,0,0,0,0,0,0,0,0,0,0,0,0,null,978.3368858,{"$nulls":3},18,0.5,1.2608695652173914,0,0,0,0,0,0,0.18840579710144928,-0.2608695652173913,1.2608695652173914,-5,0.391304347826087,"C46H58O23","O23","CHO","Lignin",6]
[982.3470566,2797133,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,981.340027,49,0,58,0,21,0,0,0,0,0,0,0,0,0,0,0,0,null,982.3470566,{"$nulls":3},21,0.42857142857142855,1.183673469387755,0,0,0,0,0,0,0.2727272727272727,-0.32653061224489793,1.183673469387755,0,0.42857142857142855,"C49H58O21","O21","CHO","Lignin",6]
[983.9294525,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2789563,0,982.922805,34,0,16,0,33,0,0,0,1,0,0,0,0,0,0,0,0,null,983.9294525,{"$nulls":3},27,0.9705882352941176,0.47058823529411764,0,0.029411764705882353,0,0,0,0,0.5757575757575758,1.5294117647058822,0.47058823529411764,-6,0.7941176470588235,"C34H16O33S1","O33S1","CHOS","Others",9]
[986.3404699,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2723860,985.3328306666666,42,0,67,0,20,0,0,0,2,0,0,1,0,0,0,0,0,null,986.3404699,{"$nulls":3},10,0.47619047619047616,1.5952380952380953,0,0.047619047619047616,0.023809523809523808,0,0,0,0,-0.6666666666666666,1.5952380952380953,-10,0.23809523809523808,"C42H67O20S2P1","O20S2P1","CHOSP","N-FreeSatCom",4]
[996.0845099,0,0,0,2690456,0,0,0,0,0,0,0,0,0,0,0,0,0,0,995.076764,39,0,33,0,29,0,0,0,0,0,0,1,0,0,0,0,0,null,996.0845099,{"$nulls":3},24,0.7435897435897436,0.8461538461538461,0,0,0.02564102564102564,0,0,0,0.3617021276595745,0.5128205128205128,0.8461538461538461,-5,0.6153846153846154,"C39H33O29P1","O29P1","CHOP","Tannins",5]

{"sheet":"Sample Information","index":1,"n_rows":19,"n_cols":2,"rows_kept":19,"flags":["formulas_cached_only"]}
["Sample Order","Sample ID"]
["Intensity1","1FTMSIsoLabelSummary_1A"]
["Intensity2","2FTMSIsoLabelSummary_3A"]
["Intensity3","3FTMSIsoLabelSummary_5A"]
["Intensity4","4FTMSIsoLabelSummary_6A"]
["Intensity5","5FTMSIsoLabelSummary_7A"]
["Intensity6","6FTMSIsoLabelSummary_9A"]
["Intensity7","7FTMSIsoLabelSummary_11A"]
["Intensity8","8FTMSIsoLabelSummary_14A"]
["Intensity9","9FTMSIsoLabelSummary_15A"]
["Intensity10","10FTMSIsoLabelSummary_O1A"]
["Intensity11","11FTMSIsoLabelSummary_O3A"]
["Intensity12","12FTMSIsoLabelSummary_O5A"]
["Intensity13","13FTMSIsoLabelSummary_O6A"]
["Intensity14","14FTMSIsoLabelSummary_O7A"]
["Intensity15","15FTMSIsoLabelSummary_O9A"]
["Intensity16","16FTMSIsoLabelSummary_O11A"]
["Intensity17","17FTMSIsoLabelSummary_O14A"]
["Intensity18","18FTMSIsoLabelSummary_O15A"]