0 B10R0.1 C=CCCCOC(=O)CCC CNP0608395.0 [0,0,0,0,0,0|0,0,2]=2 1 B10R0.1 CCC=CCCC(=O)OCC CNP0128665.0 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.1 CCCC(=O)CCCCCO CNP0177163.0 [0,0,0,0,0,0|2,0,0]=2 3 B10R0.1 CCCC(=O)NCCCCCl CNP0333987.0 [0,0,0,0,0,0|2,0,0]=2 4 B10R0.1 CCCC(=O)OCCCSC CNP0006534.0 [0,0,0,0,0,0|1,0,0]=1 5 B10R0.1 CCCC=COC(=O)CCC CNP0575733.0 [0,0,0,0,0,0|0,0,2]=2 6 B10R0.1 CCCCC=CC(=O)OCC CNP0074971.0 [0,0,0,0,0,0|2,0,1]=3 7 B10R0.1 CCCCCCC(=O)CCO CNP0040088.0 [0,0,0,0,0,0|2,0,0]=2 8 B10R0.1 CCCCCCC(=O)OCC CNP0228643.0 [0,0,0,0,0,0|2,0,0]=2 9 B10R0.1 CCCCCC[C@@H](O)CCC CNP0127008.1 [0,0,0,0,0,0|1,0,2]=3 10 B10R0.1 CCCCCC[C@@H](O)CCO CNP0217557.2 [0,0,0,0,0,0|2,0,2]=4 11 B10R0.1 CCCCCC[C@H](C)CCC CNP0332545.1 [0,0,0,0,0,0|2,0,1]=3 12 B10R0.1 CCCCCC[C@H](O)CCO CNP0217557.1 [0,0,0,0,0,0|2,0,2]=4 13 B10R0.1 CCCCCOC(=O)CCC CNP0232104.0 [0,0,0,0,0,0|0,0,0]=0 14 B10R0.1 CCCCCO[C@H](C)OCC CNP0125234.1 [0,0,0,0,0,0|2,0,1]=3 15 B10R0.1 CCCN(N)CCCCCN CNP0546326.0 [0,0,0,0,0,0|4,0,0]=4 16 B10R0.1 CCOC(=O)CCCCSC CNP0264286.0 [0,0,0,0,0,0|3,0,0]=3 17 B9R0.5 C=CCC(=O)CCCCC CNP0108996.0 [1,0,0,0,0,0|0,0,2]=3 18 B9R0.5 C=CCCCC(=O)OCC CNP0023026.0 [1,0,0,0,0,0|1,0,2]=4 19 B9R0.5 C=COC(=O)CCCCC CNP0521245.0 [1,0,0,0,0,0|1,0,2]=4 20 B9R0.5 CC=CC(=O)CCCCC CNP0176491.0 [1,0,0,0,0,0|0,0,2]=3 21 B9R0.5 CC=CC(=O)OCCCC CNP0017670.0 [1,0,0,0,0,0|0,0,2]=3 22 B9R0.5 CC=CCCC(=O)CCC CNP0280412.0 [1,0,0,0,0,0|0,0,2]=3 23 B9R0.5 CCC=CCC(=O)OCC CNP0055106.0 [1,0,0,0,0,0|1,0,2]=4 24 B9R0.5 CCCC(=O)CCCC=O CNP0599929.0 [1,0,0,0,0,0|1,0,1]=3 25 B9R0.5 CCCC=CC(=O)OCC CNP0003275.0 [1,0,0,0,0,0|1,0,2]=4 26 B9R0.5 CCCCCC(=O)CCC CNP0331420.0 [1,0,0,0,0,0|0,0,0]=1 27 B9R0.5 CCCCCC(=O)CCO CNP0135586.0 [1,0,0,0,0,0|1,0,0]=2 28 B9R0.5 CCCCCC(=O)OCC CNP0149883.0 [1,0,0,0,0,0|1,0,0]=2 29 B9R0.5 CCCCC[C@H](C)CCC CNP0345469.1 [1,0,0,0,0,0|1,0,1]=3 30 B9R0.5 CCCCC[C@H](O)CCC CNP0294811.1 [1,0,0,0,0,0|0,0,2]=3 31 B9R0.5 CCCCC[C@H](O)CCO CNP0370820.1 [1,0,0,0,0,0|1,0,2]=4 32 B9R0.5 CCCCOC(=O)CCC CNP0123594.0 [1,0,0,0,0,0|0,0,0]=1 33 B9R0.5 CCCCO[C@H](C)OCC CNP0212958.1 [1,0,0,0,0,0|2,0,1]=4 34 B9R0.5 CCOC(=O)CCCC#N CNP0244990.0 [1,0,0,0,0,0|2,0,1]=4 35 B9R0.5 CCOC(=O)CCCSC CNP0002800.0 [1,0,0,0,0,0|2,0,0]=3 36 B9R0.45 CC=CC=CCCCCC CNP0327405.0 [1,0,0,0,0,0|1,0,2]=4 37 B9R0.45 CCC#CCCCCCC CNP0606734.0 [1,0,0,0,0,0|1,0,2]=4 38 B9R0.45 CCC=CCCCCCC CNP0223572.0 [1,0,0,0,0,0|1,0,1]=3 39 B9R0.45 CCC=CCCCCCO CNP0246173.0 [1,0,0,0,0,0|2,0,1]=4 40 B9R0.45 CCCC#CCCCCC CNP0576219.0 [1,0,0,0,0,0|1,0,1]=3 41 B9R0.45 CCCC=CCCCCC CNP0076954.0 [1,0,0,0,0,0|1,0,0]=2 42 B9R0.45 CCCCCC=CCC=O CNP0158662.0 [1,0,0,0,0,0|2,0,1]=4 43 B9R0.45 CCCCCC=CCCO CNP0111850.0 [1,0,0,0,0,0|2,0,0]=3 44 B9R0.45 CCCCCCC=CCO CNP0303395.0 [1,0,0,0,0,0|2,0,1]=4 45 B9R0.45 CCCCCCCCCC CNP0279708.0 [1,0,0,0,0,0|1,0,1]=3 46 B9R0.45 CCCCCCCCCI CNP0565198.0 [1,0,0,0,0,0|2,0,1]=4 47 B9R0.45 CCCCCCCCCO CNP0307663.0 [1,0,0,0,0,0|2,0,1]=4 48 B9R0.45 CCCCCCCCOC CNP0305574.0 [1,0,0,0,0,0|2,0,1]=4 49 B9R0.45 CCCCCCCOCC CNP0144632.0 [1,0,0,0,0,0|2,0,1]=4 50 B9R0.45 CCCCCCOCCC CNP0488672.0 [1,0,0,0,0,0|2,0,0]=3 51 B9R0.45 CCCCCOCCCC CNP0134382.0 [1,0,0,0,0,0|0,0,1]=2 52 B9R0.45 CCCCOCCCCO CNP0571704.0 [1,0,0,0,0,0|1,0,1]=3 53 B9R0.45 CCOCCOCCOC CNP0567615.0 [1,0,0,0,0,0|2,0,1]=4 54 B9R0.46 C=CC(=O)CCCCCC CNP0199222.0 [1,0,0,0,0,0|1,0,2]=4 55 B9R0.46 C=CC(=O)OCCOCC CNP0523688.0 [1,0,0,0,0,0|1,0,2]=4 56 B9R0.46 C=CCCCCC(=O)CC CNP0107479.0 [1,0,0,0,0,0|1,0,2]=4 57 B9R0.46 CCCCC=CC(=O)OC CNP0002590.0 [1,0,0,0,0,0|2,0,1]=4 58 B9R0.46 CCCCCCC(=O)CC CNP0226154.0 [1,0,0,0,0,0|1,0,0]=2 59 B9R0.46 CCCCCCC(=O)NN CNP0349501.0 [1,0,0,0,0,0|3,0,0]=4 60 B9R0.46 CCCCCCC(=O)OC CNP0149439.0 [1,0,0,0,0,0|2,0,0]=3 61 B9R0.46 CCCCCC[C@@H](C)CC CNP0315749.1 [1,0,0,0,0,0|2,0,1]=4 62 B9R0.46 CCCCCC[C@@H](O)CC CNP0164339.1 [1,0,0,0,0,0|1,0,2]=4 63 B9R0.46 CCCCCC[C@H](O)CC CNP0164339.2 [1,0,0,0,0,0|1,0,2]=4 64 B9R0.46 CCCCCOC(=O)CC CNP0268077.0 [1,0,0,0,0,0|0,0,0]=1 65 B9R0.46 CCCCCO[C@H](C)OC CNP0289301.1 [1,0,0,0,0,0|2,0,1]=4 66 B9R0.46 CSCCCOC(=O)CS CNP0575609.0 [1,0,0,0,0,0|2,0,0]=3 67 B11R0.2 CCCCCCC(C)CC(C)C CNP0576324.0 [0,1,0,0,0,0|2,0,1]=4 68 B11R0.2 CCCCCOC(=O)CC(C)C CNP0135492.0 [0,1,0,0,0,0|0,0,0]=1 69 B11R0.4 C=CC=CCCOC(=O)CCC CNP0281096.0 [0,1,0,0,0,0|0,0,3]=4 70 B11R0.4 CC=CC(=O)OCCC=CCC CNP0265278.0 [0,1,0,0,0,0|0,0,3]=4 71 B11R0.4 CC=CC(=O)OCCCCCC CNP0002922.0 [0,1,0,0,0,0|0,0,2]=3 72 B11R0.4 CC=CC=CCOC(=O)CCC CNP0328344.0 [0,1,0,0,0,0|0,0,3]=4 73 B11R0.4 CC=CCCCOC(=O)CCC CNP0508923.0 [0,1,0,0,0,0|0,0,1]=2 74 B11R0.4 CCC=CCCOC(=O)CCC CNP0286866.0 [0,1,0,0,0,0|0,0,1]=2 75 B11R0.4 CCCC=CCCC(=O)OCC CNP0257239.0 [0,1,0,0,0,0|2,0,1]=4 76 B11R0.4 CCCC=CCOC(=O)CCC CNP0260808.0 [0,1,0,0,0,0|0,0,1]=2 77 B11R0.4 CCCCC=CCC(=O)OCC CNP0229476.0 [0,1,0,0,0,0|2,0,1]=4 78 B11R0.4 CCCCCC#CC(=O)OCC CNP0603684.0 [0,1,0,0,0,0|2,0,0]=3 79 B11R0.4 CCCCCC=CC(=O)OCC CNP0259768.0 [0,1,0,0,0,0|2,0,0]=3 80 B11R0.4 CCCCCCC=C(C)CCO CNP0138583.0 [0,1,0,0,0,0|3,0,0]=4 81 B11R0.4 CCCCCCCC(=O)CCC CNP0224296.0 [0,1,0,0,0,0|1,0,0]=2 82 B11R0.4 CCCCCCCC(=O)OCC CNP0311189.0 [0,1,0,0,0,0|2,0,0]=3 83 B11R0.4 CCCCCCCC(C)CCC CNP0333661.0 [0,1,0,0,0,0|2,0,1]=4 84 B11R0.4 CCCCCCC[C@@H](O)CCC CNP0081402.1 [0,1,0,0,0,0|1,0,2]=4 85 B11R0.4 CCCCCCOC(=O)CCC CNP0153531.0 [0,1,0,0,0,0|0,0,0]=1 86 B11R0.4 CCCCCCO[C@H](C)OCC CNP0259643.1 [0,1,0,0,0,0|2,0,1]=4 87 B11R0.5 CCCCC(=CC(=O)OCC)Br CNP0310959.0 [0,1,0,0,0,0|2,0,1]=4 88 B11R0.5 CCCCC(C)CC(C)CCC CNP0574073.0 [0,1,0,0,0,0|2,0,1]=4 89 B11R0.5 CCCCC(C)OC(=O)CCC CNP0547746.0 [0,1,0,0,0,0|0,0,0]=1 90 B11R0.81 C=C(CCCC)OCCCCC CNP0385438.0 [0,1,0,0,0,0|1,0,0]=2 91 B11R0.81 C=CCOC(=O)CCCCCC CNP0085340.0 [0,1,0,0,0,0|1,0,2]=4 92 B11R0.81 CCCC=COC(=O)CCCC CNP0496892.0 [0,1,0,0,0,0|0,0,2]=3 93 B11R0.81 CCCCCCC(=O)CCC=O CNP0001517.0 [0,1,0,0,0,0|1,0,1]=3 94 B11R0.81 CCCCCCC(=O)OCCC CNP0320924.0 [0,1,0,0,0,0|1,0,0]=2 95 B11R0.81 CCCCCCC(C)CCCC CNP0536101.0 [0,1,0,0,0,0|2,0,1]=4 96 B11R0.81 CCCCCOC(=O)CCCC CNP0079884.0 [0,1,0,0,0,0|0,0,0]=1 97 B11R0.142 CC=C(C)C(=O)OCCCCC CNP0541757.0 [0,1,0,0,0,0|0,0,2]=3 98 B11R0.142 CCCCCOC(=O)[C@H](C)CC CNP0234090.1 [0,1,0,0,0,0|0,0,0]=1 99 B11R0.161 CCCCCCC(CC)CCC CNP0593745.0 [0,1,0,0,0,0|2,0,1]=4 100 B11R0.174 CCCC(=O)OCCC(C)CC CNP0235877.0 [0,1,0,0,0,0|0,0,0]=1 101 B11R0.174 CCCC(C)CCCC(C)CC CNP0076780.0 [0,1,0,0,0,0|2,0,1]=4 102 B11R0.176 CCCC(=O)OCCCC(C)C CNP0508013.0 [0,1,0,0,0,0|0,0,0]=1 103 B11R0.176 CCOC(=O)CCCCC(C)C CNP0312915.0 [0,1,0,0,0,0|2,0,0]=3 104 B11R0.176 CCOC(=O)CCCC[C@H](C)O CNP0017820.1 [0,1,0,0,0,0|2,0,0]=3 105 B11R0.304 CCCCCC[P@](=O)(O)OCC CNP0577105.1 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.4 CCCCCCC1CCCC1 CNP0324091.0 [0,0,0,1,0,0|2,0,1]=4 107 B11R1.16 CCCN(C)C1CCCCC1 CNP0578480.0 [0,0,0,1,0,0|3,0,0]=4 108 B11R1.16 CCOC(=O)C1CCCCC1 CNP0408576.0 [0,0,0,1,0,0|2,0,0]=3 109 B11R1.24 CCCCC1CCCC(=O)O1 CNP0003367.0 [0,0,0,1,0,0|0,0,0]=1 110 B11R1.24 CCCCC1COCC(=O)O1 CNP0582719.0 [0,0,0,1,0,0|1,0,0]=2 111 B11R1.24 CSCC[C@H]1CCNC(=S)O1 CNP0184861.1 [0,0,0,1,0,0|2,1,0]=4 112 B11R1.30 COCC(=O)OC1CCCC1 CNP0525040.0 [0,0,0,1,0,0|1,0,0]=2 113 B11R1.101 CC1CCCCCCCCC1 CNP0242949.0 [0,0,0,1,0,0|2,0,1]=4 114 B11R1.101 O=C1C=CCCCCCCO1 CNP0528458.0 [0,0,0,1,0,0|0,0,2]=3 115 B11R1.101 OC1CCCCCCCCC1 CNP0610074.0 [0,0,0,1,0,0|1,0,2]=4 116 B11R1.180 CCCCCC1=CCCC1=O CNP0080134.0 [0,0,0,1,0,0|1,0,1]=3 117 B11R1.180 CCCCCC1CCCC1=O CNP0487255.0 [0,0,0,1,0,0|1,0,0]=2 118 B11R1.180 CCCCCC1CCOC1=O CNP0186949.0 [0,0,0,1,0,0|2,0,0]=3 119 B11R1.180 CCCCC[C@@H]1CC=CC1=O CNP0037134.2 [0,0,0,1,0,0|1,0,2]=4 120 B11R1.180 CCCCC[C@H]1CC=CC1=O CNP0037134.1 [0,0,0,1,0,0|1,0,2]=4 121 B11R1.230 CCCC[C@@H]1OC(=O)C[C@@H]1C CNP0241589.2 [0,0,0,1,0,0|0,0,0]=1 122 B11R1.230 CCCC[C@@H]1OC(=O)C[C@H]1C CNP0241589.4 [0,0,0,1,0,0|0,0,0]=1 123 B11R1.230 CCCC[C@H]1OC(=O)C[C@@H]1C CNP0241589.1 [0,0,0,1,0,0|0,0,0]=1 124 B11R1.230 CCCC[C@H]1OC(=O)C[C@H]1C CNP0241589.3 [0,0,0,1,0,0|0,0,0]=1 125 B8R0.1 C=CCOC(=O)CCC CNP0002468.0 [2,0,0,0,0,0|0,0,2]=4 126 B8R0.1 CC=CC(=O)CCCC CNP0170062.0 [2,0,0,0,0,0|0,0,2]=4 127 B8R0.1 CCCC(=O)OCSC CNP0002701.0 [2,0,0,0,0,0|1,0,0]=3 128 B8R0.1 CCCCC(=O)CCC CNP0094009.0 [2,0,0,0,0,0|0,0,0]=2 129 B8R0.1 CCCCC(=O)OCC CNP0305309.0 [2,0,0,0,0,0|1,0,0]=3 130 B8R0.1 CCCC[C@H](C)CCC CNP0319238.1 [2,0,0,0,0,0|1,0,1]=4 131 B8R0.1 CCCC[C@H](O)CCC CNP0195357.1 [2,0,0,0,0,0|0,0,2]=4 132 B8R0.1 CCCOC(=O)CCC CNP0083884.0 [2,0,0,0,0,0|0,0,0]=2 133 B8R0.1 CCOC(=O)CCCO CNP0364509.0 [2,0,0,0,0,0|2,0,0]=4 134 B8R0.1 CCOC(=O)CCSC CNP0199051.0 [2,0,0,0,0,0|2,0,0]=4 135 B8R0.4 CC=C=CCCCCC CNP0555445.0 [2,0,0,0,0,0|0,0,2]=4 136 B8R0.4 CC=CCCCCCC CNP0241269.0 [2,0,0,0,0,0|1,0,1]=4 137 B8R0.4 CCC=CCCCCC CNP0539420.0 [2,0,0,0,0,0|0,0,1]=3 138 B8R0.4 CCC=CCCCCO CNP0192139.0 [2,0,0,0,0,0|1,0,1]=4 139 B8R0.4 CCCC#CCCCC CNP0399647.0 [2,0,0,0,0,0|0,0,2]=4 140 B8R0.4 CCCC=CCCCC CNP0594829.0 [2,0,0,0,0,0|0,0,1]=3 141 B8R0.4 CCCC=CCCCO CNP0085599.0 [2,0,0,0,0,0|1,0,1]=4 142 B8R0.4 CCCCC=CCCO CNP0221419.0 [2,0,0,0,0,0|1,0,1]=4 143 B8R0.4 CCCCCC=CCO CNP0113756.0 [2,0,0,0,0,0|1,0,1]=4 144 B8R0.4 CCCCCCCCC CNP0402619.0 [2,0,0,0,0,0|0,0,1]=3 145 B8R0.4 CCCCCCCCN CNP0065900.0 [2,0,0,0,0,0|1,0,1]=4 146 B8R0.4 CCCCCCCCO CNP0368614.0 [2,0,0,0,0,0|1,0,1]=4 147 B8R0.4 CCCCCCCNC CNP0216624.0 [2,0,0,0,0,0|1,0,1]=4 148 B8R0.4 CCCCCCOCC CNP0609034.0 [2,0,0,0,0,0|1,0,1]=4 149 B8R0.4 CCCCNCCCC CNP0203128.0 [2,0,0,0,0,0|1,0,1]=4 150 B8R0.4 CCCCOCCCC CNP0077266.0 [2,0,0,0,0,0|0,0,1]=3 151 B8R0.4 CCCCOCCCO CNP0141373.0 [2,0,0,0,0,0|1,0,1]=4 152 B8R0.4 CCCCSCCCC CNP0370059.0 [2,0,0,0,0,0|0,1,1]=4 153 B8R0.4 CCCCSSCCC CNP0003137.0 [2,0,0,0,0,0|1,1,0]=4 154 B8R0.4 CCOCCOCCO CNP0079970.0 [2,0,0,0,0,0|2,0,0]=4 155 B8R0.6 C=CC(=O)CCCCC CNP0297364.0 [2,0,0,0,0,0|0,0,2]=4 156 B8R0.6 C=CC(=O)OCCCC CNP0191898.0 [2,0,0,0,0,0|0,0,2]=4 157 B8R0.6 CC=C(O)CCCCC CNP0174345.0 [2,0,0,0,0,0|0,0,2]=4 158 B8R0.6 CCCC=CC(=O)CC CNP0017905.0 [2,0,0,0,0,0|0,0,2]=4 159 B8R0.6 CCCCCC(=O)CC CNP0381627.0 [2,0,0,0,0,0|0,0,0]=2 160 B8R0.6 CCCCCC(=O)CO CNP0546319.0 [2,0,0,0,0,0|1,0,0]=3 161 B8R0.6 CCCCCC(=O)OC CNP0192346.0 [2,0,0,0,0,0|1,0,0]=3 162 B8R0.6 CCCCCC(=O)SC CNP0018085.0 [2,0,0,0,0,0|1,0,0]=3 163 B8R0.6 CCCCC[C@@H](O)CC CNP0204116.1 [2,0,0,0,0,0|0,0,2]=4 164 B8R0.6 CCCCC[C@H](C)CC CNP0121781.1 [2,0,0,0,0,0|1,0,1]=4 165 B8R0.6 CCCCC[C@H](O)CC CNP0204116.2 [2,0,0,0,0,0|0,0,2]=4 166 B8R0.6 CCCCOC(=O)CC CNP0139208.0 [2,0,0,0,0,0|0,0,0]=2 167 B8R0.6 COC(=O)CCCSC CNP0313998.0 [2,0,0,0,0,0|2,0,0]=4 168 B8R0.6 COCCCC(=O)OC CNP0580088.0 [2,0,0,0,0,0|2,0,0]=4 169 B8R0.7 C=CCCCOC(=O)C CNP0186159.0 [2,0,0,0,0,0|0,0,2]=4 170 B8R0.7 CC(=O)NCCCCN CNP0279373.0 [2,0,0,0,0,0|2,0,0]=4 171 B8R0.7 CCCCC=CC(=O)C CNP0125606.0 [2,0,0,0,0,0|1,0,1]=4 172 B8R0.7 CCCCCC=C(C)C CNP0153071.0 [2,0,0,0,0,0|2,0,0]=4 173 B8R0.7 CCCCCC=C(C)O CNP0546798.0 [2,0,0,0,0,0|1,0,1]=4 174 B8R0.7 CCCCCCC(=O)C CNP0325160.0 [2,0,0,0,0,0|1,0,0]=3 175 B8R0.7 CCCCCCC(=O)Cl CNP0211048.0 [2,0,0,0,0,0|2,0,0]=4 176 B8R0.7 CCCCCCC(=O)N CNP0248097.0 [2,0,0,0,0,0|2,0,0]=4 177 B8R0.7 CCCCCCC(=O)O CNP0141686.0 [2,0,0,0,0,0|2,0,0]=4 178 B8R0.7 CCCCCOC(=O)C CNP0227990.0 [2,0,0,0,0,0|0,0,0]=2 179 B8R0.7 CCCOCCC(=O)C CNP0376956.0 [2,0,0,0,0,0|2,0,0]=4 180 B8R0.7 COCCCOC(=O)C CNP0076800.0 [2,0,0,0,0,0|1,0,0]=3 181 B8R0.7 CSCCCOC(=O)C CNP0179840.0 [2,0,0,0,0,0|1,0,0]=3 182 B10R0.2 CCCC(=O)CC(=O)OCC CNP0003512.0 [1,1,0,0,0,0|1,0,1]=4 183 B10R0.2 CCCC(=O)OC(=O)CCC CNP0001510.0 [1,1,0,0,0,0|0,0,1]=3 184 B10R0.2 CCCC(=O)OC(C)CCC CNP0118403.0 [1,1,0,0,0,0|0,0,0]=2 185 B10R0.2 CCCC(O)CC(=O)OCC CNP0256152.0 [1,1,0,0,0,0|1,0,0]=3 186 B10R0.3 C=C(C)CCOC(=O)CCC CNP0525083.0 [1,1,0,0,0,0|0,0,1]=3 187 B10R0.3 C=C(CCO)CCCC(C)C CNP0310766.0 [1,1,0,0,0,0|2,0,0]=4 188 B10R0.3 CCCC(=O)CCCC(=O)O CNP0236856.0 [1,1,0,0,0,0|1,0,1]=4 189 B10R0.3 CCCC(=O)OCCC(C)C CNP0144794.0 [1,1,0,0,0,0|0,0,0]=2 190 B10R0.3 CCCC(C)CCCC(C)C CNP0547186.0 [1,1,0,0,0,0|1,0,1]=4 191 B10R0.3 CCOC(=O)CCCC(=O)C CNP0564200.0 [1,1,0,0,0,0|1,0,1]=4 192 B10R0.3 CCOC(=O)CCCC(C)C CNP0181211.0 [1,1,0,0,0,0|1,0,0]=3 193 B10R0.3 CCOC(=O)CCCC(C)O CNP0612036.0 [1,1,0,0,0,0|1,0,0]=3 194 B10R0.3 COCC(=O)NCCC(C)C CNP0213339.0 [1,1,0,0,0,0|2,0,0]=4 195 B10R0.6 CCCCCC(=O)C=C(C)C CNP0610551.0 [1,1,0,0,0,0|0,0,2]=4 196 B10R0.6 CCCCCC(=O)CC(=O)O CNP0414310.0 [1,1,0,0,0,0|1,0,1]=4 197 B10R0.6 CCCCCC(=O)OC(C)C CNP0202716.0 [1,1,0,0,0,0|1,0,0]=3 198 B10R0.6 CCCCOC(=O)CC(=O)C CNP0002486.0 [1,1,0,0,0,0|0,0,1]=3 199 B10R0.6 CCCCOC(=O)CC(C)C CNP0084165.0 [1,1,0,0,0,0|0,0,0]=2 200 B10R0.6 CCCCOC(=O)C[C@@H](C)O CNP0226564.2 [1,1,0,0,0,0|0,0,0]=2 201 B10R0.6 CCCCOC(=O)C[C@H](C)O CNP0226564.1 [1,1,0,0,0,0|0,0,0]=2 202 B10R0.6 COCCOC(=O)C[C@@H](C)O CNP0205160.1 [1,1,0,0,0,0|1,0,0]=3 203 B10R0.19 CCCCC(C)C(C)CCC CNP0086078.0 [1,1,0,0,0,0|1,0,1]=4 204 B10R0.19 CCCCC(O)C(=O)OCC CNP0612227.0 [1,1,0,0,0,0|1,0,0]=3 205 B10R0.19 CCCC[C@H](Br)C(=O)OCC CNP0154903.1 [1,1,0,0,0,0|1,0,0]=3 206 B10R0.19 CCCC[C@H](O)[C@@H](C)CCC CNP0167037.1 [1,1,0,0,0,0|1,0,1]=4 207 B10R0.19 CCCC[C@H](O)[C@H](C)CCC CNP0167037.2 [1,1,0,0,0,0|1,0,1]=4 208 B10R0.19 CCOC(=O)[C@@H](N)CCSC CNP0177391.1 [1,1,0,0,0,0|2,0,0]=4 209 B10R0.24 CCCCC=C(C=O)CCC CNP0589946.0 [1,1,0,0,0,0|0,0,1]=3 210 B10R0.24 CCCCCC(CO)CCC CNP0552368.0 [1,1,0,0,0,0|0,0,2]=4 211 B10R0.83 CC=C(C)C(=O)CCCCC CNP0394780.0 [1,1,0,0,0,0|0,0,2]=4 212 B10R0.83 CC=C(C)C(=O)OCCCC CNP0152613.0 [1,1,0,0,0,0|0,0,2]=4 213 B10R0.83 CCCCOC(=O)[C@H](C)CC CNP0310161.1 [1,1,0,0,0,0|0,0,0]=2 214 B10R0.91 C=CCOC(=O)CCCCC CNP0190608.0 [1,1,0,0,0,0|0,0,2]=4 215 B10R0.91 C=CCSC(=O)CCCCC CNP0018361.0 [1,1,0,0,0,0|0,0,2]=4 216 B10R0.91 CCC=CC(=O)CCCCC CNP0076921.0 [1,1,0,0,0,0|0,0,1]=3 217 B10R0.91 CCCCC(=O)CCCCO CNP0289121.0 [1,1,0,0,0,0|1,0,0]=3 218 B10R0.91 CCCCCC(=O)C#CCO CNP0412381.0 [1,1,0,0,0,0|0,0,2]=4 219 B10R0.91 CCCCCC(=O)C=CCO CNP0135755.0 [1,1,0,0,0,0|0,0,2]=4 220 B10R0.91 CCCCCC(=O)CCC=O CNP0301067.0 [1,1,0,0,0,0|0,0,1]=3 221 B10R0.91 CCCCCC(=O)CCCC CNP0609052.0 [1,1,0,0,0,0|0,0,0]=2 222 B10R0.91 CCCCCC(=O)OCCC CNP0003080.0 [1,1,0,0,0,0|0,0,0]=2 223 B10R0.91 CCCCCC(=O)OCSC CNP0354839.0 [1,1,0,0,0,0|1,0,0]=3 224 B10R0.91 CCCCCC(=O)SCCC CNP0018084.0 [1,1,0,0,0,0|0,0,0]=2 225 B10R0.91 CCCCC[C@@H](C)CCCC CNP0127873.2 [1,1,0,0,0,0|1,0,1]=4 226 B10R0.91 CCCCC[C@@H](C)CCCO CNP0181655.1 [1,1,0,0,0,0|1,0,1]=4 227 B10R0.91 CCCCC[C@H](C)CCCC CNP0127873.1 [1,1,0,0,0,0|1,0,1]=4 228 B10R0.91 CCCCC[C@H](C)CCCO CNP0181655.2 [1,1,0,0,0,0|1,0,1]=4 229 B10R0.91 CCCCOC(=O)CCCC CNP0085853.0 [1,1,0,0,0,0|0,0,0]=2 230 B10R0.91 CCCCOC(=O)CN=C=O CNP0504348.0 [1,1,0,0,0,0|1,0,1]=4 231 B10R0.91 CCCC[Se]C(=O)CCCC CNP0604167.0 [1,1,0,0,0,0|0,1,0]=3 232 B10R0.108 CCCC(=O)OCC(C)CC CNP0003450.0 [1,1,0,0,0,0|0,0,0]=2 233 B10R0.108 CCCC(=O)OC[C@@H](O)CO CNP0583085.2 [1,1,0,0,0,0|1,0,0]=3 234 B10R0.108 CCCC(=O)OC[C@H](O)CO CNP0583085.1 [1,1,0,0,0,0|1,0,0]=3 235 B10R0.156 CCCCCC(C)(C)CCC CNP0534660.0 [1,1,0,0,0,0|1,0,1]=4 236 B10R0.4 CCCC=CCCCC(=O)C CNP0301086.0 [1,1,0,0,0,0|1,0,1]=4 237 B10R0.4 CCCCCCC=CC(C)O CNP0160624.0 [1,1,0,0,0,0|1,0,1]=4 238 B10R0.4 CCCCCCCCC(C)C CNP0188292.0 [1,1,0,0,0,0|1,0,1]=4 239 B10R0.4 CCCCCCCC[C@@H](C)O CNP0256065.2 [1,1,0,0,0,0|1,0,1]=4 240 B10R0.4 CCCCCCCC[C@H](C)O CNP0256065.1 [1,1,0,0,0,0|1,0,1]=4 241 B10R0.4 CCCCOCCOC(C)O CNP0572466.0 [1,1,0,0,0,0|1,0,1]=4 242 B10R0.71 C=CCCC=CCCCCC CNP0165546.0 [1,1,0,0,0,0|1,0,1]=4 243 B10R0.71 CCC#CC=CCCCCC CNP0109430.0 [1,1,0,0,0,0|1,0,1]=4 244 B10R0.71 CCC=CCCCCCCC CNP0194721.0 [1,1,0,0,0,0|1,0,1]=4 245 B10R0.71 CCC=CCCCCCCO CNP0316558.0 [1,1,0,0,0,0|1,0,1]=4 246 B10R0.71 CCCC#CCCCCCC CNP0606026.0 [1,1,0,0,0,0|1,0,1]=4 247 B10R0.71 CCCC=CCCCCC=O CNP0001519.0 [1,1,0,0,0,0|1,0,1]=4 248 B10R0.71 CCCC=CCCCCCC CNP0153165.0 [1,1,0,0,0,0|1,0,0]=3 249 B10R0.71 CCCC=CCOCCCC CNP0076694.0 [1,1,0,0,0,0|1,0,0]=3 250 B10R0.71 CCCCC=CCCCCC CNP0245948.0 [1,1,0,0,0,0|1,0,0]=3 251 B10R0.71 CCCCC=CCCCCO CNP0201281.0 [1,1,0,0,0,0|2,0,0]=4 252 B10R0.71 CCCCCC=CCCC=O CNP0153870.0 [1,1,0,0,0,0|1,0,1]=4 253 B10R0.71 CCCCCC=CCCCO CNP0003298.0 [1,1,0,0,0,0|1,0,0]=3 254 B10R0.71 CCCCCCC=CCCO CNP0105271.0 [1,1,0,0,0,0|1,0,1]=4 255 B10R0.71 CCCCCCCCCCC CNP0270748.0 [1,1,0,0,0,0|1,0,1]=4 256 B10R0.71 CCCCCCCCCCI CNP0573243.0 [1,1,0,0,0,0|1,0,1]=4 257 B10R0.71 CCCCCCCCCCN CNP0456638.0 [1,1,0,0,0,0|1,0,1]=4 258 B10R0.71 CCCCCCCCCCO CNP0305576.0 [1,1,0,0,0,0|1,0,1]=4 259 B10R0.71 CCCCCCCCCCS CNP0541016.0 [1,1,0,0,0,0|1,0,1]=4 260 B10R0.71 CCCCCCCCCC[11CH3] CNP0510425.0 [1,1,0,0,0,0|1,0,1]=4 261 B10R0.71 CCCCCCCCCOC CNP0246631.0 [1,1,0,0,0,0|1,0,1]=4 262 B10R0.71 CCCCCCCCOCC CNP0319929.0 [1,1,0,0,0,0|1,0,1]=4 263 B10R0.71 CCCCCNCCCCC CNP0450899.0 [1,1,0,0,0,0|1,0,1]=4 264 B10R0.71 CCCCOCCOCCO CNP0079968.0 [1,1,0,0,0,0|1,0,1]=4 265 B10R0.71 CCOCCOCCOCC CNP0581610.0 [1,1,0,0,0,0|1,0,1]=4 266 B10R0.71 [2H]CCCCCCCCCC CNP0534733.0 [1,1,0,0,0,0|1,0,1]=4 267 B10R0.74 CCCCCCCC(Cl)CC CNP0573579.0 [1,1,0,0,0,0|1,0,1]=4 268 B10R0.74 CCCCCCC[C@@H](C)CC CNP0202505.2 [1,1,0,0,0,0|1,0,1]=4 269 B10R0.74 CCCCCCC[C@@H](O)CC CNP0233369.2 [1,1,0,0,0,0|1,0,1]=4 270 B10R0.74 CCCCCCC[C@H](C)CC CNP0202505.1 [1,1,0,0,0,0|1,0,1]=4 271 B10R0.74 CCCCCCC[C@H](O)CC CNP0233369.1 [1,1,0,0,0,0|1,0,1]=4 272 B10R0.41 CCCCCCC(=NO)CC CNP0390787.0 [1,1,0,0,0,0|1,0,1]=4 273 B10R0.55 COC(=O)CCCCC(C)C CNP0109196.0 [1,1,0,0,0,0|2,0,0]=4 274 B10R0.59 CC/C(=C/CC[C@@H](O)CC)/C CNP0213896.1 [1,1,0,0,0,0|2,0,0]=4 275 B10R0.59 CC/C(=C/CC[C@H](O)CC)/C CNP0213896.2 [1,1,0,0,0,0|2,0,0]=4 276 B10R0.75 CCCCCOC(=O)C(C)C CNP0172576.0 [1,1,0,0,0,0|0,0,0]=2 277 B12R0.4 CCC=CCCOC(=O)CC(C)C CNP0295531.0 [0,2,0,0,0,0|0,0,1]=3 278 B12R0.4 CCCC=CCOC(=O)CC(C)C CNP0219358.0 [0,2,0,0,0,0|0,0,1]=3 279 B12R0.4 CCCCCC=CC(=O)NC(C)C CNP0179463.0 [0,2,0,0,0,0|2,0,0]=4 280 B12R0.4 CCCCCCOC(=O)CC(C)C CNP0187690.0 [0,2,0,0,0,0|0,0,0]=2 281 B12R0.4 CCCCCCOC(=O)CC(C)S CNP0003261.0 [0,2,0,0,0,0|0,0,0]=2 282 B12R0.241 CC[C@H](C)CCOC(=O)CC(C)C CNP0310686.1 [0,2,0,0,0,0|0,0,0]=2 283 B12R0.270 CC(C)CCCOC(=O)CC(C)C CNP0076997.0 [0,2,0,0,0,0|0,0,0]=2 284 B12R0.1 CCCCCC=CCC(=O)OCC CNP0584413.0 [0,2,0,0,0,0|2,0,0]=4 285 B12R0.1 CCCCCCC#CC(=O)OCC CNP0031634.0 [0,2,0,0,0,0|2,0,0]=4 286 B12R0.1 CCCCCCC=CC(=O)OCC CNP0307887.0 [0,2,0,0,0,0|2,0,0]=4 287 B12R0.1 CCCCCCCCC(=O)OCC CNP0255123.0 [0,2,0,0,0,0|2,0,0]=4 288 B12R0.1 CCCCCCCOC(=O)CCC CNP0077240.0 [0,2,0,0,0,0|0,0,0]=2 289 B12R0.49 CC/C=C/CCOC(=O)[C@H](C)CC CNP0287655.2 [0,2,0,0,0,0|0,0,1]=3 290 B12R0.49 CC/C=C\CCOC(=O)[C@H](C)CC CNP0287655.1 [0,2,0,0,0,0|0,0,1]=3 291 B12R0.49 CC=C(C)C(=O)OCCCCCC CNP0081467.0 [0,2,0,0,0,0|0,0,2]=4 292 B12R0.49 CCCC=CCOC(=O)C(C)CC CNP0003459.0 [0,2,0,0,0,0|0,0,1]=3 293 B12R0.49 CCCCCCOC(=O)[C@@H](C)CC CNP0268240.2 [0,2,0,0,0,0|0,0,0]=2 294 B12R0.49 CCCCCCOC(=O)[C@H](C)CC CNP0268240.1 [0,2,0,0,0,0|0,0,0]=2 295 B12R0.101 CCCCC(C)COC(=O)CCC CNP0076629.0 [0,2,0,0,0,0|0,0,0]=2 296 B12R0.101 CCCC[C@@H](C)CCC(=O)OCC CNP0177367.1 [0,2,0,0,0,0|2,0,0]=4 297 B12R0.114 CCCCCC[C@@H](O)C(=O)OCC CNP0292543.1 [0,2,0,0,0,0|2,0,0]=4 298 B12R0.206 CCC=CCCOC(=O)CCCC CNP0142398.0 [0,2,0,0,0,0|0,0,1]=3 299 B12R0.206 CCCC=CCOC(=O)CCCC CNP0196077.0 [0,2,0,0,0,0|0,0,1]=3 300 B12R0.206 CCCCC=COC(=O)CCCC CNP0548851.0 [0,2,0,0,0,0|0,0,1]=3 301 B12R0.206 CCCCCCCC(=O)CCCC CNP0528685.0 [0,2,0,0,0,0|1,0,0]=3 302 B12R0.206 CCCCCCCC(=O)OCCC CNP0248076.0 [0,2,0,0,0,0|1,0,0]=3 303 B12R0.206 CCCCCCOC(=O)CCCC CNP0076877.0 [0,2,0,0,0,0|0,0,0]=2 304 B12R0.239 CCCCCC(=O)OC(C)CCC CNP0481029.0 [0,2,0,0,0,0|1,0,1]=4 305 B12R0.239 CCCCCC(C)OC(=O)CCC CNP0481243.0 [0,2,0,0,0,0|0,0,0]=2 306 B12R0.239 CCCCC[C@@H](O)CC(=O)OCC CNP0379134.1 [0,2,0,0,0,0|2,0,0]=4 307 B12R0.276 CCOC(=O)CCCC[C@@H](C)CC CNP0170449.1 [0,2,0,0,0,0|2,0,0]=4 308 B12R0.277 CCOC(=O)/C=C/CCC[C@H](C)O CNP0117476.1 [0,2,0,0,0,0|2,0,0]=4 309 B12R0.285 CCC=C(C)CCOC(=O)CCC CNP0575322.0 [0,2,0,0,0,0|0,0,1]=3 310 B12R0.285 CCCC(=O)OCC[C@@H](S)CCC CNP0002774.1 [0,2,0,0,0,0|0,0,0]=2 311 B12R0.285 CCCC(=O)OCOC(=O)CCC CNP0154947.0 [0,2,0,0,0,0|0,0,1]=3 312 B12R0.103 CCCCC(=O)NC(=O)CCCC CNP0292936.0 [0,2,0,0,0,0|1,0,1]=4 313 B12R0.103 CCCCC(=O)OC(=O)CCCC CNP0106392.0 [0,2,0,0,0,0|0,0,1]=3 314 B12R0.103 CCOCC(=O)OC(=O)COCC CNP0181935.0 [0,2,0,0,0,0|1,0,1]=4 315 B12R0.47 CCC=CCOC(=O)CCCCC CNP0003217.0 [0,2,0,0,0,0|0,0,2]=4 316 B12R0.47 CCCC=COC(=O)CCCCC CNP0547534.0 [0,2,0,0,0,0|0,0,2]=4 317 B12R0.47 CCCCCCC(=O)OCCCC CNP0305116.0 [0,2,0,0,0,0|1,0,0]=3 318 B12R0.47 CCCCCOC(=O)CCCCC CNP0135873.0 [0,2,0,0,0,0|0,0,0]=2 319 B12R0.95 CCCCC(=O)OCCCC(C)C CNP0320343.0 [0,2,0,0,0,0|0,0,0]=2 320 B12R0.95 CCCOC(=O)NCCCN(C)C CNP0348045.0 [0,2,0,0,0,0|2,0,0]=4 321 B12R0.111 CCCCCC=C(C=O)CCCC CNP0422738.0 [0,2,0,0,0,0|1,0,0]=3 322 B12R0.255 CCCCCCC(=O)CCC(=O)C CNP0196471.0 [0,2,0,0,0,0|1,0,0]=3 323 B12R0.255 CCCCCCC(=O)CCC(=O)O CNP0192324.0 [0,2,0,0,0,0|1,0,1]=4 324 B12R0.255 CCCCCCC(=O)OCC(C)C CNP0370161.0 [0,2,0,0,0,0|1,0,0]=3 325 B12R0.255 CCCCCOC(=O)CCC(=O)C CNP0609109.0 [0,2,0,0,0,0|0,0,0]=2 326 B12R0.255 CCCCCOC(=O)CCC(C)C CNP0532674.0 [0,2,0,0,0,0|0,0,0]=2 327 B12R0.648 CCCCOC(=O)C(=O)OCCC CNP0489961.0 [0,2,0,0,0,0|2,0,0]=4 328 B12R0.86 CCC(C)C(=O)OCCCC(C)C CNP0220928.0 [0,2,0,0,0,0|0,0,0]=2 329 B12R0.156 CC=C(C)C(=O)OCCC(C)CC CNP0122564.0 [0,2,0,0,0,0|0,0,2]=4 330 B12R0.203 CCCCCC[C@@H](CCC)C(=O)O CNP0589459.1 [0,2,0,0,0,0|1,0,1]=4 331 B10R1.10 CCCC1CCCC(=O)O1 CNP0002778.0 [1,0,0,1,0,0|0,0,0]=2 332 B10R1.10 CCC[C@@H]1CC=CC(=O)O1 CNP0289173.2 [1,0,0,1,0,0|0,0,2]=4 333 B10R1.10 CCC[C@@H]1CCC[C@@H](N1)C CNP0243950.3 [1,0,0,1,0,0|1,0,1]=4 334 B10R1.10 CCC[C@@H]1CCC[C@H](N1)C CNP0243950.4 [1,0,0,1,0,0|1,0,1]=4 335 B10R1.10 CCC[C@H]1CC=CC(=O)O1 CNP0289173.1 [1,0,0,1,0,0|0,0,2]=4 336 B10R1.10 CCC[C@H]1CCC[C@@H](N1)C CNP0243950.2 [1,0,0,1,0,0|1,0,1]=4 337 B10R1.10 CCC[C@H]1CCC[C@H](N1)C CNP0243950.1 [1,0,0,1,0,0|1,0,1]=4 338 B10R1.11 CCCC(C)C1CCCC1 CNP0519344.0 [1,0,0,1,0,0|1,0,1]=4 339 B10R1.11 CCOC(=O)[C@@H]1CCNC1 CNP0206039.2 [1,0,0,1,0,0|2,0,0]=4 340 B10R1.11 CCOC(=O)[C@H]1CCNC1 CNP0206039.1 [1,0,0,1,0,0|2,0,0]=4 341 B10R1.21 CCCCCC1CCCC1 CNP0373641.0 [1,0,0,1,0,0|1,0,1]=4 342 B10R1.25 CC[C@@H]1COC(=O)C[C@H]1O CNP0109096.1 [1,0,0,1,0,0|1,0,0]=3 343 B10R1.25 CC[C@H]1COC(=O)C[C@H]1O CNP0109096.2 [1,0,0,1,0,0|1,0,0]=3 344 B10R1.29 CCCCC1CCOC1=O CNP0086360.0 [1,0,0,1,0,0|1,0,0]=3 345 B10R1.78 O=C1CCC=CCCCC1 CNP0611873.0 [1,0,0,1,0,0|0,0,2]=4 346 B10R1.78 O=C1CCCCCCCC1 CNP0106072.0 [1,0,0,1,0,0|0,0,0]=2 347 B10R1.135 CCOC(=O)C1CC1CO CNP0490095.0 [1,0,0,1,0,0|2,0,0]=4 348 B10R1.197 CN[C@H]1CCCC(=O)CC1 CNP0227098.1 [1,0,0,1,0,0|1,0,0]=3 349 B10R1.457 CCCCCC1(CC1C)C CNP0570434.0 [1,0,0,1,0,0|1,0,1]=4 350 B10R1.4 CCCC1CCCCC1C CNP0605780.0 [1,0,0,1,0,0|1,0,1]=4 351 B10R1.17 CCCC=C1CCCCC1 CNP0297291.0 [1,0,0,1,0,0|1,0,0]=3 352 B10R1.17 CCCCC1CCCCC1 CNP0108784.0 [1,0,0,1,0,0|1,0,1]=4 353 B10R1.17 CCCCN1CCCCC1 CNP0144068.0 [1,0,0,1,0,0|1,0,1]=4 354 B10R1.185 C1=CCCCCCCCC1 CNP0479476.0 [1,0,0,1,0,0|1,0,0]=3 355 B10R1.185 C1CCCCCCCCC1 CNP0529209.0 [1,0,0,1,0,0|1,0,1]=4 356 B10R1.15 CCC(=O)C1CCCCN1 CNP0080269.0 [1,0,0,1,0,0|2,0,0]=4 357 B10R1.15 CNC(=O)C1CCCCC1 CNP0263233.0 [1,0,0,1,0,0|2,0,0]=4 358 B10R1.15 COC(=O)C1CCCCC1 CNP0393903.0 [1,0,0,1,0,0|2,0,0]=4 359 B10R1.16 CC/C=C\[C@@H]1CCC(=O)O1 CNP0412368.1 [1,0,0,1,0,0|0,0,2]=4 360 B10R1.16 CCCCC1COC(=O)C1 CNP0495814.0 [1,0,0,1,0,0|2,0,0]=4 361 B10R1.16 CCCC[C@@H]1CCC(=O)O1 CNP0194903.2 [1,0,0,1,0,0|0,0,0]=2 362 B10R1.16 CCCC[C@H]1CCC(=O)O1 CNP0194903.1 [1,0,0,1,0,0|0,0,0]=2 363 B10R1.16 O=C1CCC(N1)CCCO CNP0499401.0 [1,0,0,1,0,0|2,0,0]=4 364 B10R1.27 CCC(=O)CN1CCCC1 CNP0002600.0 [1,0,0,1,0,0|2,0,0]=4 365 B12R1.141 C[C@@H]1CCC/C=C\CCC(=O)O1 CNP0199494.1 [0,1,0,1,0,0|0,0,2]=4 366 B12R1.141 C[C@@H]1CCCCCCCC(=O)O1 CNP0363200.1 [0,1,0,1,0,0|0,0,0]=2 367 B12R1.141 C[C@H]1CCC/C=C\CCC(=O)O1 CNP0199494.2 [0,1,0,1,0,0|0,0,2]=4 368 B12R1.141 C[C@H]1CCCCCCCC(=O)O1 CNP0363200.2 [0,1,0,1,0,0|0,0,0]=2 369 B12R1.456 CCCCC[C@@H]1OC(=O)C[C@@H]1O CNP0268314.3 [0,1,0,1,0,0|1,0,0]=3 370 B12R1.456 CCCCC[C@@H]1OC(=O)C[C@H]1O CNP0268314.4 [0,1,0,1,0,0|1,0,0]=3 371 B12R1.456 CCCCC[C@H]1OC(=O)C[C@@H]1O CNP0268314.2 [0,1,0,1,0,0|1,0,0]=3 372 B12R1.456 CCCCC[C@H]1OC(=O)C[C@H]1O CNP0268314.1 [0,1,0,1,0,0|1,0,0]=3 373 B12R1.28 CC/C=C/C[C@@H]1CCCC(=O)O1 CNP0270021.2 [0,1,0,1,0,0|0,0,1]=3 374 B12R1.28 CC/C=C\C[C@H]1CCCC(=O)O1 CNP0270021.1 [0,1,0,1,0,0|0,0,1]=3 375 B12R1.28 CCCCCC1COCC(=O)O1 CNP0572092.0 [0,1,0,1,0,0|1,0,0]=3 376 B12R1.28 CCCCC[C@@H]1CC=CC(=O)O1 CNP0231431.1 [0,1,0,1,0,0|0,0,2]=4 377 B12R1.28 CCCCC[C@@H]1CCCC(=O)O1 CNP0259863.1 [0,1,0,1,0,0|0,0,0]=2 378 B12R1.28 CCCCC[C@H]1CCCC(=O)O1 CNP0259863.2 [0,1,0,1,0,0|0,0,0]=2 379 B12R1.32 CCCC(=O)C[C@H]1CCCCN1 CNP0276525.1 [0,1,0,1,0,0|1,0,0]=3 380 B12R1.32 CCCC(=O)OC1CCCCC1 CNP0321594.0 [0,1,0,1,0,0|0,0,0]=2 381 B12R1.32 CCOC(=O)CC1CCCCC1 CNP0076528.0 [0,1,0,1,0,0|2,0,0]=4 382 B12R1.51 CCCC(=O)OCC1CCCO1 CNP0002928.0 [0,1,0,1,0,0|0,0,0]=2 383 B12R1.215 O=C1C=CCCCCCCCO1 CNP0588642.0 [0,1,0,1,0,0|0,0,1]=3 384 B12R1.372 CCC=CCCC1CCCC1=O CNP0076899.0 [0,1,0,1,0,0|1,0,1]=4 385 B12R1.542 C/C=C\1/C(=O)OCC[C@@H]1CCO CNP0204624.1 [0,1,0,1,0,0|0,0,2]=4 386 B12R1.1564 CCSC(=O)N1CCCCCC1 CNP0035361.0 [0,1,0,1,0,0|2,0,0]=4 387 B12R1.321 CCCCC1CCCCC(=O)O1 CNP0167621.0 [0,1,0,1,0,0|0,0,0]=2 388 B12R1.1114 CCCC1C(CC(=O)N1CC)C CNP0422080.0 [0,1,0,1,0,0|2,0,0]=4 389 B12R1.8 CCCCCCC1=CCCCC1 CNP0080554.0 [0,1,0,1,0,0|2,0,0]=4 390 B12R1.267 CCCCCC1CCCOC1=O CNP0206110.0 [0,1,0,1,0,0|1,0,0]=3 391 B12R1.267 O=C1CCCCN1CCCCBr CNP0215527.0 [0,1,0,1,0,0|2,0,0]=4 392 B12R1.567 CCCCCC1=C(CCC1=O)C CNP0354329.0 [0,1,0,1,0,0|1,0,0]=3 393 B12R1.532 COC(=O)C[C@@H]1OC(=O)C[C@@H]1C CNP0441321.1 [0,1,0,1,0,0|1,0,1]=4 394 B12R1.861 CC(=CC[C@H]1OC(=O)C[C@@H]1C)C CNP0303951.1 [0,1,0,1,0,0|0,0,2]=4 395 B12R1.861 CC(C)CCC1NC(=O)OC1C CNP0571291.0 [0,1,0,1,0,0|2,0,0]=4 396 B12R2.229 O=C1CCCC[C@H]2[C@@H]1CCC2 CNP0201109.1 [0,0,0,2,0,0|1,0,0]=3 397 B12R2.24 O=C1C=C2CCCCC2CC1 CNP0611969.0 [0,0,0,2,0,0|1,0,1]=4 398 B12R2.24 O=C1CCC2CCCC[C@@H]2O1 CNP0244176.1 [0,0,0,2,0,0|0,0,0]=2 399 B12R2.24 O=C1CCN2CCCC[C@@H]2C1 CNP0465968.2 [0,0,0,2,0,0|2,0,0]=4 400 B12R2.24 O=C1CCN2CCCC[C@H]2C1 CNP0465968.1 [0,0,0,2,0,0|2,0,0]=4 401 B12R2.24 O=C1CC[C@@H]2CCCC[C@@H]2O1 CNP0244176.3 [0,0,0,2,0,0|0,0,0]=2 402 B12R2.24 O=C1CC[C@H]2CCCC[C@@H]2O1 CNP0244176.2 [0,0,0,2,0,0|0,0,0]=2 403 B12R2.203 C[C@@H]1CC[C@H]2[C@@H]1C(=O)OCC2 CNP0118821.1 [0,0,0,2,0,0|0,0,0]=2 404 B12R2.203 C[C@H]1CC[C@H]2[C@@H]1C(=O)OCC2 CNP0118821.2 [0,0,0,2,0,0|0,0,0]=2 405 B12R2.612 C[C@@H]1CC[C@H]2[C@@H]1COC(=O)C2 CNP0210998.1 [0,0,0,2,0,0|2,0,0]=4