0 B13R0.2 C=CCCCCCCCC(=O)OCC CNP0561434.0 [0,0,0,0,0,0|0,0,2]=2 1 B13R0.2 C=COC(=O)CCCCCCCCC CNP0137792.0 [0,0,0,0,0,0|0,0,2]=2 2 B13R0.2 CC=CCC=CCCCC(=O)OCC CNP0208574.0 [0,0,0,0,0,0|0,0,4]=4 3 B13R0.2 CCCCCC=CC=CC(=O)OCC CNP0259062.0 [0,0,0,0,0,0|0,0,4]=4 4 B13R0.2 CCCCCC=CCCC(=O)OCC CNP0247879.0 [0,0,0,0,0,0|0,0,2]=2 5 B13R0.2 CCCCCC=CCOC(=O)CCC CNP0047858.0 [0,0,0,0,0,0|2,0,2]=4 6 B13R0.2 CCCCCCC=COC(=O)CCC CNP0492034.0 [0,0,0,0,0,0|2,0,2]=4 7 B13R0.2 CCCCCCCC=CC(=O)OCC CNP0323878.0 [0,0,0,0,0,0|0,0,2]=2 8 B13R0.2 CCCCCCCCCC(=O)CC=O CNP0246850.0 [0,0,0,0,0,0|2,0,1]=3 9 B13R0.2 CCCCCCCCCC(=O)CCC CNP0343183.0 [0,0,0,0,0,0|1,0,0]=1 10 B13R0.2 CCCCCCCCCC(=O)OCC CNP0245893.0 [0,0,0,0,0,0|0,0,0]=0 11 B13R0.2 CCCCCCCCCC(C)CCC CNP0097879.0 [0,0,0,0,0,0|2,0,1]=3 12 B13R0.2 CCCCCCCCOC(=O)CCC CNP0140143.0 [0,0,0,0,0,0|2,0,0]=2 13 B13R0.2 CCCCCCOCCC(C)CCC CNP0085746.0 [0,0,0,0,0,0|3,0,1]=4 14 B13R0.2 CCOC(=O)CCCCCCCC=O CNP0276438.0 [0,0,0,0,0,0|1,0,1]=2 15 B13R0.2 CCOC(=O)CCCCCCCCO CNP0242583.0 [0,0,0,0,0,0|1,0,0]=1 16 B12R0.1 CC=CC(=O)CCCCCCCC CNP0482568.0 [1,0,0,0,0,0|1,0,1]=3 17 B12R0.1 CCCCCC=CCC(=O)OCC CNP0584413.0 [1,0,0,0,0,0|0,0,2]=3 18 B12R0.1 CCCCCCC#CC(=O)OCC CNP0031634.0 [1,0,0,0,0,0|0,0,2]=3 19 B12R0.1 CCCCCCC=CC(=O)OCC CNP0307887.0 [1,0,0,0,0,0|0,0,2]=3 20 B12R0.1 CCCCCCCCC(=O)OCC CNP0255123.0 [1,0,0,0,0,0|0,0,0]=1 21 B12R0.1 CCCCCCCC[C@H](C)CCC CNP0076722.1 [1,0,0,0,0,0|2,0,1]=4 22 B12R0.1 CCCCCCCOC(=O)CCC CNP0077240.0 [1,0,0,0,0,0|2,0,0]=3 23 B12R0.5 C#CC=CCCCCCCCCC CNP0168870.0 [1,0,0,0,0,0|1,0,2]=4 24 B12R0.5 C=CC=CCCCCCCCCC CNP0589614.0 [1,0,0,0,0,0|1,0,2]=4 25 B12R0.5 CC=CCCCCCCCCCC CNP0504957.0 [1,0,0,0,0,0|1,0,2]=4 26 B12R0.5 CCC=CCCCCCCCC=O CNP0222286.0 [1,0,0,0,0,0|2,0,1]=4 27 B12R0.5 CCC=CCCCCCCCCC CNP0534908.0 [1,0,0,0,0,0|1,0,0]=2 28 B12R0.5 CCC=CCCCCCCCCO CNP0133783.0 [1,0,0,0,0,0|2,0,0]=3 29 B12R0.5 CCCC=CCCCCCCCO CNP0274278.0 [1,0,0,0,0,0|2,0,1]=4 30 B12R0.5 CCCCCCCCC=CCCO CNP0107866.0 [1,0,0,0,0,0|2,0,1]=4 31 B12R0.5 CCCCCCCCCC=CC=O CNP0141647.0 [1,0,0,0,0,0|2,0,1]=4 32 B12R0.5 CCCCCCCCCC=CCO CNP0254277.0 [1,0,0,0,0,0|2,0,0]=3 33 B12R0.5 CCCCCCCCCCCCC CNP0251262.0 [1,0,0,0,0,0|1,0,1]=3 34 B12R0.5 CCCCCCCCCCCCO CNP0281602.0 [1,0,0,0,0,0|2,0,1]=4 35 B12R0.5 CCCCCCCCCCOC=O CNP0485887.0 [1,0,0,0,0,0|1,0,2]=4 36 B12R0.5 CCCCCCCCCCOCO CNP0587051.0 [1,0,0,0,0,0|1,0,1]=3 37 B12R0.5 CCCCCCCCCOCCC CNP0508454.0 [1,0,0,0,0,0|2,0,0]=3 38 B12R0.5 CCCCCCNCCCCCC CNP0462839.0 [1,0,0,0,0,0|2,0,1]=4 39 B12R0.5 CCCCCCOCCCCCC CNP0492138.0 [1,0,0,0,0,0|2,0,1]=4 40 B12R0.248 C#CCCCCCCCC(=O)OC CNP0179424.0 [1,0,0,0,0,0|0,0,2]=3 41 B12R0.248 C=CC(=O)CCCCCCCCC CNP0105121.0 [1,0,0,0,0,0|0,0,2]=3 42 B12R0.248 C=CC(=O)OCCCCCCCC CNP0564168.0 [1,0,0,0,0,0|1,0,2]=4 43 B12R0.248 C=CCCCCCCCC(=O)OC CNP0363612.0 [1,0,0,0,0,0|0,0,2]=3 44 B12R0.248 CCC=CCCCCOC(=O)CC CNP0209959.0 [1,0,0,0,0,0|1,0,2]=4 45 B12R0.248 CCCCC=CCCOC(=O)CC CNP0105555.0 [1,0,0,0,0,0|1,0,2]=4 46 B12R0.248 CCCCCC=CCCC(=O)OC CNP0112743.0 [1,0,0,0,0,0|0,0,2]=3 47 B12R0.248 CCCCCCCC=CC(=O)OC CNP0075998.0 [1,0,0,0,0,0|0,0,2]=3 48 B12R0.248 CCCCCCCCCC(=NO)C CNP0318820.0 [1,0,0,0,0,0|3,0,0]=4 49 B12R0.248 CCCCCCCCCC(=O)CC CNP0517584.0 [1,0,0,0,0,0|0,0,0]=1 50 B12R0.248 CCCCCCCCCC(=O)OC CNP0223324.0 [1,0,0,0,0,0|0,0,0]=1 51 B12R0.248 CCCCCCCCCC(C)CC CNP0349662.0 [1,0,0,0,0,0|1,0,1]=3 52 B12R0.248 CCCCCCCCC[C@@H](C)CI CNP0083067.1 [1,0,0,0,0,0|2,0,1]=4 53 B12R0.248 CCCCCCCCOC(=O)CC CNP0215951.0 [1,0,0,0,0,0|1,0,0]=2 54 B12R0.248 COC(=O)CCCCCCCC=O CNP0287915.0 [1,0,0,0,0,0|1,0,1]=3 55 B12R0.248 COC(=O)CCCCCCCCO CNP0294192.0 [1,0,0,0,0,0|1,0,0]=2 56 B14R0.1 CCOC(=O)CCCCCC(=O)OCC CNP0501214.0 [0,1,0,0,0,0|1,0,1]=3 57 B14R0.181 CCCCCCCCCC(=O)C(C)CC CNP0351856.0 [0,1,0,0,0,0|1,0,0]=2 58 B14R0.181 CCCCCCCCCC(=O)C(O)CC CNP0152109.0 [0,1,0,0,0,0|1,0,0]=2 59 B14R0.181 CCCCCCCCOC(=O)[C@H](C)CC CNP0410814.1 [0,1,0,0,0,0|2,0,0]=3 60 B14R0.391 CC(C)OC(=O)CCCCCCCCO CNP0392498.0 [0,1,0,0,0,0|1,0,0]=2 61 B14R0.391 CCCCCCCCCC(=O)C=C(C)C CNP0232845.0 [0,1,0,0,0,0|1,0,1]=3 62 B14R0.391 CCCCCCCCCC(=O)CC(=O)O CNP0069141.0 [0,1,0,0,0,0|2,0,1]=4 63 B14R0.391 CCCCCCCCCC(=O)OC(C)C CNP0080469.0 [0,1,0,0,0,0|0,0,0]=1 64 B14R0.391 CCCCCCCCC[C@@H](C)OC(=O)C CNP0165028.2 [0,1,0,0,0,0|1,0,2]=4 65 B14R0.391 CCCCCCCCC[C@H](C)OC(=O)C CNP0165028.1 [0,1,0,0,0,0|1,0,2]=4 66 B14R0.391 CCCCCCCCOC(=O)CC(C)C CNP0321210.0 [0,1,0,0,0,0|2,0,0]=3 67 B14R0.391 CSCCCCCCNC(=O)NC(C)C CNP0394012.0 [0,1,0,0,0,0|3,0,0]=4 68 B14R0.393 C=CCCCCCCCCC(=O)OCC CNP0247664.0 [0,1,0,0,0,0|0,0,1]=2 69 B14R0.393 CCCCCCCCCCC(=O)OCC CNP0025805.0 [0,1,0,0,0,0|0,0,0]=1 70 B14R0.393 CCCCCCCCCCC(C)CCC CNP0003453.0 [0,1,0,0,0,0|2,0,1]=4 71 B14R0.393 CCCCCCCCCC[C@@H](O)CCC CNP0076547.2 [0,1,0,0,0,0|1,0,2]=4 72 B14R0.393 CCCCCCCCCC[C@H](O)CCC CNP0076547.1 [0,1,0,0,0,0|1,0,2]=4 73 B14R0.393 CCOC(=O)CCCCCCCCCBr CNP0024178.0 [0,1,0,0,0,0|0,0,0]=1 74 B14R0.432 CCOC(=O)CCCCCCCC(=O)O CNP0155089.0 [0,1,0,0,0,0|1,0,1]=3 75 B14R0.493 CCCCCCCCCC(=O)CCCC CNP0481269.0 [0,1,0,0,0,0|1,0,0]=2 76 B14R0.493 CCCCCCCCCC(=O)OCCC CNP0095402.0 [0,1,0,0,0,0|0,0,0]=1 77 B14R0.493 CCCCCCCCC[C@H](C)CCCC CNP0076142.1 [0,1,0,0,0,0|2,0,1]=4 78 B14R0.493 CCCCCCCCOC(=O)CCCC CNP0076933.0 [0,1,0,0,0,0|2,0,0]=3 79 B14R0.493 CCCOC(=O)CCCCCCCCO CNP0133360.0 [0,1,0,0,0,0|1,0,0]=2 80 B14R0.2432 CCCCC[C@@H](C)CCC[C@@H](C)CCC CNP0250251.2 [0,1,0,0,0,0|2,0,1]=4 81 B14R0.2432 CCCCC[C@H](C)CCC[C@H](C)CCC CNP0250251.1 [0,1,0,0,0,0|2,0,1]=4 82 B14R0.2432 CCCCC[C@H](O)CCC[C@H](O)CCC CNP0416178.1 [0,1,0,0,0,0|1,0,2]=4 83 B14R1.26 CCCCCCC[C@@H]1CC=CC(=O)O1 CNP0175844.1 [0,0,0,1,0,0|2,0,1]=4 84 B14R1.26 CCCCCCC[C@H]1CCCC(=O)O1 CNP0316484.1 [0,0,0,1,0,0|2,0,0]=3 85 B14R1.216 CCCCCC=CCC1CCCC1=O CNP0180932.0 [0,0,0,1,0,0|1,0,2]=4 86 B14R1.326 CC1CCCCC=CCCCC(=O)O1 CNP0304698.0 [0,0,0,1,0,0|0,0,2]=3 87 B14R1.326 CC1CCCCCCCCCC(=O)O1 CNP0584711.0 [0,0,0,1,0,0|0,0,0]=1 88 B14R1.326 C[C@@H]1C/C=C/CCCCCCC(=O)O1 CNP0142568.1 [0,0,0,1,0,0|0,0,2]=3 89 B14R1.326 C[C@@H]1C/C=C\CCCCCCC(=O)O1 CNP0142568.3 [0,0,0,1,0,0|0,0,2]=3 90 B14R1.326 C[C@@H]1CCCCCC/C=C\CC(=O)O1 CNP0330088.2 [0,0,0,1,0,0|0,0,2]=3 91 B14R1.326 C[C@H]1C/C=C/CCCCCCC(=O)O1 CNP0142568.2 [0,0,0,1,0,0|0,0,2]=3 92 B14R1.326 C[C@H]1CCCC/C=C\CCCC(=O)O1 CNP0304698.1 [0,0,0,1,0,0|0,0,2]=3 93 B14R1.326 C[C@H]1CCCCCC/C=C\CC(=O)O1 CNP0330088.1 [0,0,0,1,0,0|0,0,2]=3 94 B14R1.965 CCOC(=O)C[C@@H]1CCNC[C@@H]1CC CNP0264127.1 [0,0,0,1,0,0|1,0,0]=2 95 B14R1.3126 CCCCCCC[C@H]1OC(=O)C[C@H]1C CNP0537001.1 [0,0,0,1,0,0|2,0,0]=3 96 B14R1.4408 O=C1CC=CCCCCCCCCO1 CNP0106632.0 [0,0,0,1,0,0|0,0,2]=3 97 B14R1.4408 O=C1CCCCCCCC=CCCO1 CNP0208635.0 [0,0,0,1,0,0|0,0,2]=3 98 B14R1.4408 O=C1CCCCCCCCC=CCO1 CNP0609723.0 [0,0,0,1,0,0|0,0,2]=3 99 B14R1.4408 O=C1CCCCCCCCCCCO1 CNP0320182.0 [0,0,0,1,0,0|0,0,0]=1 100 B11R0.3 CC=CCCCCCCCCC CNP0084835.0 [2,0,0,0,0,0|0,0,1]=3 101 B11R0.3 CC=CCCCCCCCCO CNP0112250.0 [2,0,0,0,0,0|1,0,1]=4 102 B11R0.3 CCC=CCCCCCCCC CNP0223387.0 [2,0,0,0,0,0|0,0,1]=3 103 B11R0.3 CCCCCCCCC=CCO CNP0086126.0 [2,0,0,0,0,0|1,0,1]=4 104 B11R0.3 CCCCCCCCCC=CBr CNP0424110.0 [2,0,0,0,0,0|1,0,1]=4 105 B11R0.3 CCCCCCCCCCCC CNP0299960.0 [2,0,0,0,0,0|0,0,1]=3 106 B11R0.3 CCCCCCCCCCCO CNP0115710.0 [2,0,0,0,0,0|1,0,1]=4 107 B11R0.3 CCCCCCCCCCNC CNP0142745.0 [2,0,0,0,0,0|1,0,1]=4 108 B11R0.3 CCCCCCCCCCON CNP0565549.0 [2,0,0,0,0,0|1,0,1]=4 109 B11R0.3 [CH2]CCCCCCCCCCC CNP0562200.0 [2,0,0,0,0,0|0,0,2]=4 110 B11R0.4 CCCC=CCCC(=O)OCC CNP0257239.0 [2,0,0,0,0,0|0,0,2]=4 111 B11R0.4 CCCCC=CCC(=O)OCC CNP0229476.0 [2,0,0,0,0,0|0,0,2]=4 112 B11R0.4 CCCCCC#CC(=O)OCC CNP0603684.0 [2,0,0,0,0,0|0,0,2]=4 113 B11R0.4 CCCCCC=CC(=O)OCC CNP0259768.0 [2,0,0,0,0,0|0,0,2]=4 114 B11R0.4 CCCCCCCC(=O)CCC CNP0224296.0 [2,0,0,0,0,0|1,0,0]=3 115 B11R0.4 CCCCCCCC(=O)OCC CNP0311189.0 [2,0,0,0,0,0|0,0,0]=2 116 B11R0.4 CCCCCCOC(=O)CCC CNP0153531.0 [2,0,0,0,0,0|2,0,0]=4 117 B11R0.40 C#CCCCCCCC(=O)OC CNP0316329.0 [2,0,0,0,0,0|0,0,2]=4 118 B11R0.40 C=C(CC)CCCCCCCC CNP0359541.0 [2,0,0,0,0,0|1,0,0]=3 119 B11R0.40 C=CC(=O)CCCCCCCC CNP0104265.0 [2,0,0,0,0,0|0,0,2]=4 120 B11R0.40 CC=CCCCCCC(=O)OC CNP0525056.0 [2,0,0,0,0,0|0,0,2]=4 121 B11R0.40 CCC=CCCCCC(=O)OC CNP0111381.0 [2,0,0,0,0,0|0,0,2]=4 122 B11R0.40 CCCCC=CCCC(=O)OC CNP0611978.0 [2,0,0,0,0,0|0,0,2]=4 123 B11R0.40 CCCCCC=CCC(=O)OC CNP0154150.0 [2,0,0,0,0,0|0,0,2]=4 124 B11R0.40 CCCCCCC#CC(=O)OC CNP0282401.0 [2,0,0,0,0,0|0,0,2]=4 125 B11R0.40 CCCCCCC=CC(=O)OC CNP0002510.0 [2,0,0,0,0,0|0,0,2]=4 126 B11R0.40 CCCCCCCCC(=O)CC CNP0144959.0 [2,0,0,0,0,0|0,0,0]=2 127 B11R0.40 CCCCCCCCC(=O)OC CNP0418286.0 [2,0,0,0,0,0|0,0,0]=2 128 B11R0.40 CCCCCCCCC(O)CC CNP0589699.0 [2,0,0,0,0,0|0,0,2]=4 129 B11R0.40 CCCCCCCC[C@H](C)CC CNP0096496.1 [2,0,0,0,0,0|1,0,1]=4 130 B11R0.40 CCCCCCCOC(=O)CC CNP0602844.0 [2,0,0,0,0,0|1,0,0]=3 131 B11R0.40 COC(=O)CCCCCCCO CNP0247810.0 [2,0,0,0,0,0|1,0,0]=3 132 B11R0.148 C#CCCCCCCCC(=O)O CNP0319936.0 [2,0,0,0,0,0|0,0,2]=4 133 B11R0.148 C=CCCCCCCCC(=O)C CNP0147878.0 [2,0,0,0,0,0|0,0,2]=4 134 B11R0.148 C=CCCCCCCCC(=O)O CNP0349039.0 [2,0,0,0,0,0|0,0,2]=4 135 B11R0.148 CC=CCCCCCCC(=O)O CNP0359674.0 [2,0,0,0,0,0|0,0,2]=4 136 B11R0.148 CCC=CCCCCCC(=O)O CNP0230092.0 [2,0,0,0,0,0|0,0,2]=4 137 B11R0.148 CCCC=CCCCCC(=O)C CNP0145750.0 [2,0,0,0,0,0|0,0,2]=4 138 B11R0.148 CCCC=CCCCCC(=O)O CNP0345656.0 [2,0,0,0,0,0|0,0,2]=4 139 B11R0.148 CCCCC=CCCCC(=O)O CNP0002615.0 [2,0,0,0,0,0|0,0,2]=4 140 B11R0.148 CCCCCC=CCCC(=O)C CNP0261656.0 [2,0,0,0,0,0|0,0,2]=4 141 B11R0.148 CCCCCC=CCCC(=O)O CNP0165247.0 [2,0,0,0,0,0|0,0,2]=4 142 B11R0.148 CCCCCCC=CCC(=O)O CNP0245227.0 [2,0,0,0,0,0|0,0,2]=4 143 B11R0.148 CCCCCCCC=CC(=O)C CNP0126399.0 [2,0,0,0,0,0|0,0,2]=4 144 B11R0.148 CCCCCCCC=CC(=O)O CNP0134914.0 [2,0,0,0,0,0|0,0,2]=4 145 B11R0.148 CCCCCCCCC=C(C)C CNP0555992.0 [2,0,0,0,0,0|1,0,1]=4 146 B11R0.148 CCCCCCCCCC(=O)C CNP0310446.0 [2,0,0,0,0,0|0,0,0]=2 147 B11R0.148 CCCCCCCCCC(=O)Cl CNP0310799.0 [2,0,0,0,0,0|1,0,0]=3 148 B11R0.148 CCCCCCCCCC(=O)N CNP0196101.0 [2,0,0,0,0,0|1,0,0]=3 149 B11R0.148 CCCCCCCCCC(=O)O CNP0213238.0 [2,0,0,0,0,0|0,0,0]=2 150 B11R0.148 CCCCCCCCCC(=O)S CNP0175900.0 [2,0,0,0,0,0|0,1,0]=3 151 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0527675.0 [2,0,0,0,0,0|0,0,1]=3 152 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0527709.0 [2,0,0,0,0,0|0,0,1]=3 153 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0572352.0 [2,0,0,0,0,0|0,0,1]=3 154 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0599431.0 [2,0,0,0,0,0|0,0,1]=3 155 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0602582.0 [2,0,0,0,0,0|0,0,1]=3 156 B11R0.148 CCCCCCCCCC(C)C CNP0076440.0 [2,0,0,0,0,0|1,0,1]=4 157 B11R0.148 CCCCCCCCC[C@@H](C)O CNP0370761.1 [2,0,0,0,0,0|0,0,2]=4 158 B11R0.148 CCCCCCCCC[C@H](C)O CNP0370761.2 [2,0,0,0,0,0|0,0,2]=4 159 B11R0.148 CCCCCCCCOC(=O)C CNP0207320.0 [2,0,0,0,0,0|1,0,0]=3 160 B11R0.148 CCCCCCCCO[13C](=O)C CNP0542593.0 [2,0,0,0,0,0|1,0,0]=3 161 B11R0.148 CCCCCCCCSC(=O)C CNP0537924.0 [2,0,0,0,0,0|1,0,0]=3 162 B11R0.148 CCCCCOCCOC(=O)C CNP0497389.0 [2,0,0,0,0,0|2,0,0]=4 163 B11R0.148 COCCCCCCCC(=O)O CNP0294553.0 [2,0,0,0,0,0|1,0,0]=3 164 B11R0.148 O=C(O)CCCCCCCCO CNP0086761.0 [2,0,0,0,0,0|1,0,0]=3 165 B11R0.148 O=CCCCCCCCC(=O)O CNP0472761.0 [2,0,0,0,0,0|1,0,1]=4 166 B13R0.66 C=CCOC(=O)CCCCCCCC CNP0131773.0 [1,1,0,0,0,0|0,0,1]=3 167 B13R0.66 CCCCCCCOC(=O)CCCC CNP0231760.0 [1,1,0,0,0,0|2,0,0]=4 168 B13R0.88 CCCC(=O)CCCCCCC(C)C CNP0307359.0 [1,1,0,0,0,0|1,0,0]=3 169 B13R0.88 CCOC(=O)CCCCCC[C@@H](C)O CNP0112958.1 [1,1,0,0,0,0|0,0,0]=2 170 B13R0.193 CCCCCC(=O)CCC(=O)OCC CNP0017938.0 [1,1,0,0,0,0|0,0,1]=3 171 B13R0.330 CCCCCCC(=CC(=O)OCC)Br CNP0225649.0 [1,1,0,0,0,0|0,0,2]=4 172 B13R0.330 CCCCCC[C@H](O)CC(=O)OCC CNP0291447.1 [1,1,0,0,0,0|0,0,0]=2 173 B13R0.335 CC(=O)OC(=O)CCCCCCCO CNP0220022.0 [1,1,0,0,0,0|1,0,1]=4 174 B13R0.335 CCCCCCCCC(=O)OC(C)C CNP0003082.0 [1,1,0,0,0,0|0,0,0]=2 175 B13R0.335 CCCCCCCOC(=O)CC(C)C CNP0076121.0 [1,1,0,0,0,0|2,0,0]=4 176 B13R0.340 CCCCCCCOC(=O)[C@H](C)CC CNP0135717.1 [1,1,0,0,0,0|2,0,0]=4 177 B13R0.367 CCOC(=O)CCCCC(=O)OCC CNP0031190.0 [1,1,0,0,0,0|1,0,1]=4 178 B13R0.54 CC/C=C/CCCCCCC[C@H](C)O CNP0191015.1 [1,1,0,0,0,0|1,0,0]=3 179 B13R0.54 CCCCCCCCC=COC(=O)C CNP0501330.0 [1,1,0,0,0,0|0,0,2]=4 180 B13R0.54 CCCCCCCCCC=CC(=O)C CNP0265083.0 [1,1,0,0,0,0|1,0,1]=4 181 B13R0.54 CCCCCCCCCCCC(C)C CNP0149200.0 [1,1,0,0,0,0|1,0,1]=4 182 B13R0.54 CCCCCCCCCCC[C@@H](C)O CNP0149423.2 [1,1,0,0,0,0|1,0,1]=4 183 B13R0.54 CCCCCCCCCCC[C@H](C)O CNP0149423.1 [1,1,0,0,0,0|1,0,1]=4 184 B13R0.54 CCCCCCCCCCOC(=O)C CNP0190607.0 [1,1,0,0,0,0|0,0,2]=4 185 B13R0.147 CCCCCCCCCC=C(Cl)CO CNP0255372.0 [1,1,0,0,0,0|2,0,0]=4 186 B13R0.147 CCCCCCCCCCC(=O)CC CNP0487301.0 [1,1,0,0,0,0|1,0,1]=4 187 B13R0.147 CCCCCCCCCC[C@@H](C)CC CNP0232099.1 [1,1,0,0,0,0|1,0,1]=4 188 B13R0.147 CCCCCCCCCOC(=O)CC CNP0113142.0 [1,1,0,0,0,0|2,0,0]=4 189 B13R0.165 CCCCCCC(O)CCCCCC CNP0082295.0 [1,1,0,0,0,0|1,0,1]=4 190 B13R0.336 CCC#CC=CCCCCCCCC CNP0611343.0 [1,1,0,0,0,0|1,0,1]=4 191 B13R0.336 CCC=CCCCCCCCCCC CNP0003426.0 [1,1,0,0,0,0|1,0,0]=3 192 B13R0.336 CCC=CCCCCCCCCCO CNP0173162.0 [1,1,0,0,0,0|1,0,0]=3 193 B13R0.336 CCCC=CCCCCCCCCC CNP0541639.0 [1,1,0,0,0,0|1,0,0]=3 194 B13R0.336 CCCCC=CCCCCCCCC CNP0076420.0 [1,1,0,0,0,0|1,0,1]=4 195 B13R0.336 CCCCCCCCC=CCCCO CNP0351626.0 [1,1,0,0,0,0|1,0,1]=4 196 B13R0.336 CCCCCCCCCCC=CCO CNP0096544.0 [1,1,0,0,0,0|2,0,0]=4 197 B13R0.336 CCCCCCCCCCCCCC CNP0293304.0 [1,1,0,0,0,0|1,0,1]=4 198 B13R0.336 CCCCCCCCCCCCCI CNP0486092.0 [1,1,0,0,0,0|1,0,1]=4 199 B13R0.336 CCCCCCCCCCCCCN CNP0561220.0 [1,1,0,0,0,0|1,0,1]=4 200 B13R0.336 CCCCCCCCCCCCCO CNP0139347.0 [1,1,0,0,0,0|1,0,1]=4 201 B13R0.338 CCCCCCCC(N)CCCCC CNP0427184.0 [1,1,0,0,0,0|1,0,1]=4 202 B13R0.338 CCCCCCC[C@H](C)CCCCC CNP0183278.1 [1,1,0,0,0,0|1,0,1]=4 203 B13R0.150 CCCCCCCCCC(=O)N(C)C CNP0080141.0 [1,1,0,0,0,0|1,0,0]=3 204 B13R0.150 CCCCCCCCC[C@@H](O)[C@H](C)N CNP0142474.1 [1,1,0,0,0,0|0,0,2]=4 205 B13R0.150 CCCCCCCCC[C@H](O)[C@@H](C)N CNP0142474.2 [1,1,0,0,0,0|0,0,2]=4 206 B13R0.150 CCCCCCCCOC(=O)C(C)C CNP0205183.0 [1,1,0,0,0,0|1,0,0]=3 207 B13R0.194 CCCCCC(=O)CCCC(=O)OC CNP0227503.0 [1,1,0,0,0,0|0,0,1]=3 208 B13R0.201 COC(=O)CCCCCCC(=O)OC CNP0371182.0 [1,1,0,0,0,0|1,0,1]=4 209 B13R0.202 COC(=O)CCCCCCCC(=O)C CNP0550064.0 [1,1,0,0,0,0|0,0,1]=3 210 B13R0.202 COC(=O)CCCCCCCC(=O)O CNP0202412.0 [1,1,0,0,0,0|1,0,1]=4 211 B13R0.274 CCCCCCC=C(C)CC(=O)OC CNP0372183.0 [1,1,0,0,0,0|0,0,2]=4 212 B13R0.274 CCCCCCC[C@@H](O)CC(=O)SC CNP0526799.1 [1,1,0,0,0,0|0,1,0]=3 213 B13R0.274 CCCCCCC[C@H](O)CC(=O)OC CNP0172127.1 [1,1,0,0,0,0|0,0,0]=2 214 B13R0.412 CCCCCCCCCC(OC)OC CNP0017635.0 [1,1,0,0,0,0|0,0,2]=4 215 B15R0.115 CCOC(=O)CC/C=C/C[C@H](O)C[C@@H](C)O CNP0541366.1 [0,2,0,0,0,0|0,0,2]=4 216 B15R0.410 CCOC(=O)CCC[C@H](C)CC(=O)OCC CNP0240427.1 [0,2,0,0,0,0|1,0,1]=4 217 B15R0.1734 CCOC(=O)CCCC[C@@H](N)C(=O)OCC CNP0108026.1 [0,2,0,0,0,0|1,0,1]=4 218 B15R0.408 CCOC(=O)CCCCCCC(=O)OCC CNP0110680.0 [0,2,0,0,0,0|0,0,1]=3 219 B15R0.138 CCCCCCCC(=O)CC(=O)SCCN CNP0084103.0 [0,2,0,0,0,0|0,1,1]=4 220 B15R0.244 CCCCCC(=O)CCCCC(=O)OCC CNP0208298.0 [0,2,0,0,0,0|0,0,0]=2 221 B15R0.4259 CCCOC(=O)CCCCC(=O)OCCC CNP0002393.0 [0,2,0,0,0,0|1,0,1]=4 222 B15R0.324 CCCCCCCCCOC(=O)[C@H](C)CC CNP0326716.1 [0,2,0,0,0,0|1,0,0]=3 223 B15R0.69 CCCCCCCCCOC(=O)CC(C)C CNP0002721.0 [0,2,0,0,0,0|1,0,0]=3 224 B15R0.69 CCCCCCCCCOS(=O)OC(C)C CNP0075943.0 [0,2,0,0,0,0|1,0,0]=3 225 B15R0.3221 CCCCCCCCCC(=O)O[C@H](C)CC CNP0297370.1 [0,2,0,0,0,0|0,0,0]=2 226 B15R0.366 C=COC(=O)CCCCCCCCCCC CNP0315574.0 [0,2,0,0,0,0|0,0,2]=4 227 B15R0.366 CCCCCC=CCCC=CC(=O)OCC CNP0003548.0 [0,2,0,0,0,0|0,0,2]=4 228 B15R0.366 CCCCCCCCCC=CC(=O)OCC CNP0203006.0 [0,2,0,0,0,0|0,0,0]=2 229 B15R0.366 CCCCCCCCCCCC(=O)CCO CNP0280181.0 [0,2,0,0,0,0|2,0,0]=4 230 B15R0.366 CCCCCCCCCCCC(=O)NCC CNP0001305.0 [0,2,0,0,0,0|1,0,0]=3 231 B15R0.366 CCCCCCCCCCCC(=O)OCC CNP0263071.0 [0,2,0,0,0,0|0,0,0]=2 232 B15R0.366 CCCCCCCCCCOC(=O)CCC CNP0186393.0 [0,2,0,0,0,0|1,0,0]=3 233 B15R0.366 CCOC(=O)CCCCCCCCCC=O CNP0279106.0 [0,2,0,0,0,0|0,0,0]=2 234 B15R0.2002 C=CCCCCCCCCC(=O)OCC=C CNP0052168.0 [0,2,0,0,0,0|0,0,2]=4 235 B15R0.88 CCCCCCCCCC(=O)NCC(=O)O CNP0004511.0 [0,2,0,0,0,0|1,0,1]=4 236 B15R0.88 CCCCCCCCCC(=O)NCC(C)C CNP0308804.0 [0,2,0,0,0,0|1,0,0]=3 237 B15R0.88 CCCCCCCCCC(=O)OCC(C)C CNP0076649.0 [0,2,0,0,0,0|0,0,0]=2 238 B15R0.88 CCCCCCCCOC(=O)CCC(C)C CNP0541657.0 [0,2,0,0,0,0|2,0,0]=4 239 B15R0.322 C=CCCCCCCCC(=O)OCCCC CNP0585797.0 [0,2,0,0,0,0|0,0,2]=4 240 B15R0.322 CCCCCCCC=CC(=O)OCCCC CNP0002822.0 [0,2,0,0,0,0|0,0,2]=4 241 B15R0.322 CCCCCCCCCC(=O)OCCCC CNP0288450.0 [0,2,0,0,0,0|0,0,0]=2 242 B15R0.322 CCCCCCCCOC(=O)CCCCC CNP0294728.0 [0,2,0,0,0,0|2,0,0]=4 243 B15R0.322 CCCCOC(=O)CCCCCCCCO CNP0299327.0 [0,2,0,0,0,0|1,0,0]=3 244 B13R1.6 CCCCCCC1CCCC(=O)O1 CNP0280779.0 [1,0,0,1,0,0|2,0,0]=4 245 B13R1.42 CCOC(=O)CCC1CCCCC1 CNP0003502.0 [1,0,0,1,0,0|0,0,0]=2 246 B13R1.190 CCCCCCC1OC(=O)CC1C CNP0251689.0 [1,0,0,1,0,0|2,0,0]=4 247 B13R1.279 O=C1CCCCCCCCCCC1 CNP0294882.0 [1,0,0,1,0,0|1,0,0]=3 248 B13R1.279 O=C1CCCCCCCCCCO1 CNP0348572.0 [1,0,0,1,0,0|0,0,0]=2 249 B13R1.470 CCCC(=O)C[C@H]1CCCCN1C CNP0304537.1 [1,0,0,1,0,0|2,0,0]=4 250 B13R1.654 CCCCCCCC1CCCC1=O CNP0079998.0 [1,0,0,1,0,0|1,0,0]=3 251 B13R1.657 CCCCC[C@H]1CC[C@H](O1)OCC CNP0237360.1 [1,0,0,1,0,0|0,0,2]=4 252 B13R1.3821 CC1CCCCCCC(=O)OC1C CNP0207162.0 [1,0,0,1,0,0|0,0,0]=2 253 B13R1.28 CCCCCCCC1CCCCC1 CNP0076836.0 [1,0,0,1,0,0|1,0,1]=4 254 B13R1.2883 C1CCCCCCCCCCCC1 CNP0566911.0 [1,0,0,1,0,0|1,0,1]=4 255 B13R1.9 CCCCCCC1COC(=O)CO1 CNP0002636.0 [1,0,0,1,0,0|1,0,0]=3 256 B13R1.27 CCCCCCC[C@@H]1CCC(=O)O1 CNP0201617.2 [1,0,0,1,0,0|1,0,0]=3 257 B13R1.27 CCCCCCC[C@H]1CCC(=O)O1 CNP0201617.1 [1,0,0,1,0,0|1,0,0]=3 258 B15R1.25751 C[C@@H]1C/C=C/CC[C@@H](CCCC(=O)O1)O CNP0461719.3 [0,1,0,1,0,0|0,0,2]=4 259 B15R1.25751 C[C@@H]1C/C=C/CC[C@H](CCCC(=O)O1)O CNP0461719.4 [0,1,0,1,0,0|0,0,2]=4 260 B15R1.25751 C[C@@H]1C/C=C/[C@@H](CCCCCC(=O)O1)O CNP0553012.2 [0,1,0,1,0,0|0,0,2]=4 261 B15R1.25751 C[C@@H]1C/C=C\CC[C@@H](CCCC(=O)O1)O CNP0461719.2 [0,1,0,1,0,0|0,0,2]=4 262 B15R1.25751 C[C@@H]1C/C=C\CC[C@H](CCCC(=O)O1)O CNP0461719.1 [0,1,0,1,0,0|0,0,2]=4 263 B15R1.25751 C[C@@H]1C/C=C\[C@@H](CCCCCC(=O)O1)O CNP0553012.1 [0,1,0,1,0,0|0,0,2]=4 264 B15R1.942 CCC(C)CCCCC1CCCC(=O)O1 CNP0351135.0 [0,1,0,1,0,0|2,0,0]=4 265 B15R1.25818 C[C@@H]1CCCCCC[C@@H](/C=C/C(=O)O1)O CNP0130816.1 [0,1,0,1,0,0|0,0,2]=4 266 B15R1.25818 C[C@@H]1CCCCCC[C@@H](/C=C\C(=O)O1)O CNP0130816.2 [0,1,0,1,0,0|0,0,2]=4 267 B15R1.1010 CCCCCCC[C@@H]1C[C@H](CC(=O)O1)O CNP0545694.1 [0,1,0,1,0,0|2,0,0]=4 268 B15R1.5737 C[C@@H]1CCCCCCCCCCC(=O)C1 CNP0104860.1 [0,1,0,1,0,0|1,0,0]=3 269 B15R1.5737 C[C@@H]1CCCCCCCCCCC(=O)O1 CNP0233115.1 [0,1,0,1,0,0|0,0,0]=2 270 B15R1.253 N[C@H]1CCCCCCCCCCNC1=O CNP0547506.1 [0,1,0,1,0,0|1,0,0]=3 271 B15R1.5365 CCCCCCCC[C@@H]1CC(=O)CC1=O CNP0321800.1 [0,1,0,1,0,0|1,0,1]=4 272 B15R1.5365 CCCCCCCC[C@H]1OC(=CC1=O)C CNP0237453.1 [0,1,0,1,0,0|1,0,1]=4 273 B15R1.35 CCCCCCCCCC1=NCCCC1 CNP0450651.0 [0,1,0,1,0,0|2,0,0]=4 274 B15R1.6476 O=C1CCCCCCCC(=O)OCCO1 CNP0319407.0 [0,1,0,1,0,0|1,0,1]=4 275 B15R1.3974 CCCCCCC(=O)N[C@H]1CCOC1=O CNP0181312.1 [0,1,0,1,0,0|1,0,1]=4 276 B15R1.106 CCCCCCCCC1CCCC(=O)O1 CNP0174932.0 [0,1,0,1,0,0|1,0,0]=3 277 B15R1.6595 O=C1C=CCCCCCCCCCCC1 CNP0071987.0 [0,1,0,1,0,0|1,0,0]=3 278 B15R1.6595 O=C1CCCC=CCCCCCCCC1 CNP0321790.0 [0,1,0,1,0,0|1,0,1]=4 279 B15R1.6595 O=C1CCCCCCCCCCCCC1 CNP0211498.0 [0,1,0,1,0,0|1,0,0]=3 280 B15R1.6595 O=C1CCCCCCCCCCCCO1 CNP0407259.0 [0,1,0,1,0,0|0,0,0]=2 281 B15R1.157 C=CCOC(=O)CCCC1CCCCC1 CNP0002703.0 [0,1,0,1,0,0|0,0,1]=3 282 B15R2.42187 O=C1CCC[C@@]2([C@@H]1CCCCCC2)O CNP0321411.1 [0,0,0,2,0,0|2,0,0]=4 283 B15R2.47582 O=C1CCCC2(CCCCC2CC1)O CNP0556230.0 [0,0,0,2,0,0|2,0,0]=4