0 B6R0.6 C#CCCCCO CNP0289179.0 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.6 C=CCCCCC CNP0226691.0 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.6 C=CCCCCO CNP0162421.0 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.6 C=CCNCC=C CNP0443858.0 [0,0,0,0,0,0|2,0,2]=4 4 B6R0.6 C=CCOCCO CNP0248950.0 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.6 C=CCSCCC CNP0150756.0 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.6 CCC#CCCO CNP0170517.0 [0,0,0,0,0,0|3,0,1]=4 7 B6R0.6 CCC=CCCC CNP0391454.0 [0,0,0,0,0,0|3,0,1]=4 8 B6R0.6 CCC=CCCO CNP0255718.0 [0,0,0,0,0,0|3,0,1]=4 9 B6R0.6 CCCC#CCO CNP0314465.0 [0,0,0,0,0,0|3,0,1]=4 10 B6R0.6 CCCC=CCO CNP0254124.0 [0,0,0,0,0,0|3,0,1]=4 11 B6R0.6 CCCCCC#N CNP0412353.0 [0,0,0,0,0,0|2,0,2]=4 12 B6R0.6 CCCCCC=O CNP0304790.0 [0,0,0,0,0,0|3,0,1]=4 13 B6R0.6 CCCCCCC CNP0290800.0 [0,0,0,0,0,0|3,0,0]=3 14 B6R0.6 CCCCCCN CNP0213933.0 [0,0,0,0,0,0|2,0,0]=2 15 B6R0.6 CCCCCCO CNP0317600.0 [0,0,0,0,0,0|3,0,0]=3 16 B6R0.6 CCCCCCS CNP0167948.0 [0,0,0,0,0,0|3,0,0]=3 17 B6R0.6 CCCCCC[O-] CNP0579903.0 [0,0,0,0,0,0|3,0,0]=3 18 B6R0.6 CCCCCNC CNP0276164.0 [0,0,0,0,0,0|4,0,0]=4 19 B6R0.6 CCCCCOC CNP0358174.0 [0,0,0,0,0,0|4,0,0]=4 20 B6R0.6 CCCCCSC CNP0293012.0 [0,0,0,0,0,0|4,0,0]=4 21 B6R0.6 CCCCCSS CNP0228282.0 [0,0,0,0,0,0|4,0,0]=4 22 B6R0.6 CCCNCCC CNP0129820.0 [0,0,0,0,0,0|2,0,0]=2 23 B6R0.6 CCCOCCO CNP0079853.0 [0,0,0,0,0,0|3,0,0]=3 24 B6R0.6 CCCSCCC CNP0173387.0 [0,0,0,0,0,0|3,0,0]=3 25 B6R0.6 CCCSSCC CNP0322971.0 [0,0,0,0,0,0|4,0,0]=4 26 B6R0.6 CCOCCCO CNP0304052.0 [0,0,0,0,0,0|4,0,0]=4 27 B6R0.6 CCOCCCS CNP0267296.0 [0,0,0,0,0,0|4,0,0]=4 28 B6R0.6 CCSCCCO CNP0355297.0 [0,0,0,0,0,0|4,0,0]=4 29 B6R0.6 CNCCCCN CNP0157274.0 [0,0,0,0,0,0|3,0,0]=3 30 B6R0.6 COCCCCO CNP0570905.0 [0,0,0,0,0,0|4,0,0]=4 31 B6R0.6 CSCCCCO CNP0002400.0 [0,0,0,0,0,0|4,0,0]=4 32 B6R0.6 ClCCOCCCl CNP0082891.0 [0,0,0,0,0,0|3,0,0]=3 33 B6R0.6 NCCCCC=O CNP0083786.0 [0,0,0,0,0,0|2,0,1]=3 34 B6R0.6 NCCCCCN CNP0184259.0 [0,0,0,0,0,0|1,0,0]=1 35 B6R0.6 NCCCCCO CNP0032450.0 [0,0,0,0,0,0|2,0,0]=2 36 B6R0.6 NCCOCCN CNP0447264.0 [0,0,0,0,0,0|1,0,0]=1 37 B6R0.6 OCCCCCO CNP0201249.0 [0,0,0,0,0,0|3,0,0]=3 38 B6R0.6 OCCNCCO CNP0247543.0 [0,0,0,0,0,0|2,0,0]=2 39 B6R0.6 OCCOCCO CNP0333860.0 [0,0,0,0,0,0|3,0,0]=3 40 B6R0.6 OCCSCCO CNP0335773.0 [0,0,0,0,0,0|3,0,0]=3 41 B6R0.6 [CH2-]CCCCC#[O+] CNP0596536.0 [0,0,0,0,0,0|3,0,1]=4 42 B5R0.2 C=CCCCC CNP0264947.0 [1,0,0,0,0,0|2,0,1]=4 43 B5R0.2 C=CCCCO CNP0003396.0 [1,0,0,0,0,0|2,0,1]=4 44 B5R0.2 C=CCSCC CNP0261096.0 [1,0,0,0,0,0|2,0,1]=4 45 B5R0.2 CC#CCCO CNP0515871.0 [1,0,0,0,0,0|2,0,1]=4 46 B5R0.2 CC=CCCC CNP0419577.0 [1,0,0,0,0,0|2,0,1]=4 47 B5R0.2 CC=CCCO CNP0253382.0 [1,0,0,0,0,0|2,0,1]=4 48 B5R0.2 CCC#CCO CNP0076027.0 [1,0,0,0,0,0|2,0,1]=4 49 B5R0.2 CCC=CCO CNP0239009.0 [1,0,0,0,0,0|2,0,1]=4 50 B5R0.2 CCCCC#N CNP0357663.0 [1,0,0,0,0,0|1,0,2]=4 51 B5R0.2 CCCCC=O CNP0361186.0 [1,0,0,0,0,0|2,0,1]=4 52 B5R0.2 CCCCCBr CNP0018690.0 [1,0,0,0,0,0|2,0,0]=3 53 B5R0.2 CCCCCC CNP0269021.0 [1,0,0,0,0,0|2,0,0]=3 54 B5R0.2 CCCCCI CNP0017763.0 [1,0,0,0,0,0|2,0,0]=3 55 B5R0.2 CCCCCN CNP0203183.0 [1,0,0,0,0,0|1,0,0]=2 56 B5R0.2 CCCCCO CNP0244882.0 [1,0,0,0,0,0|2,0,0]=3 57 B5R0.2 CCCCCS CNP0260876.0 [1,0,0,0,0,0|2,0,0]=3 58 B5R0.2 CCCCNC CNP0277639.0 [1,0,0,0,0,0|3,0,0]=4 59 B5R0.2 CCCCOC CNP0609033.0 [1,0,0,0,0,0|3,0,0]=4 60 B5R0.2 CCCCSC CNP0562965.0 [1,0,0,0,0,0|3,0,0]=4 61 B5R0.2 CCCC[S+]=O CNP0521772.0 [1,0,0,0,0,0|3,0,0]=4 62 B5R0.2 CCCSCC CNP0316215.0 [1,0,0,0,0,0|2,0,0]=3 63 B5R0.2 CCCSSC CNP0296815.0 [1,0,0,0,0,0|3,0,0]=4 64 B5R0.2 CCNCCN CNP0281269.0 [1,0,0,0,0,0|0,0,0]=1 65 B5R0.2 CCNCCO CNP0396370.0 [1,0,0,0,0,0|1,0,0]=2 66 B5R0.2 CCOCC#N CNP0184632.0 [1,0,0,0,0,0|1,0,2]=4 67 B5R0.2 CCOCCO CNP0319988.0 [1,0,0,0,0,0|2,0,0]=3 68 B5R0.2 CCSCCN CNP0506731.0 [1,0,0,0,0,0|1,0,0]=2 69 B5R0.2 CCSSCC CNP0416624.0 [1,0,0,0,0,0|3,0,0]=4 70 B5R0.2 CSCCCN CNP0348726.0 [1,0,0,0,0,0|2,0,0]=3 71 B5R0.2 CSCCCO CNP0359993.0 [1,0,0,0,0,0|3,0,0]=4 72 B5R0.2 N#CCCCO CNP0358912.0 [1,0,0,0,0,0|1,0,2]=4 73 B5R0.2 NCCCC=O CNP0359033.0 [1,0,0,0,0,0|1,0,1]=3 74 B5R0.2 NCCCCN CNP0116270.0 [1,0,0,0,0,0|0,0,0]=1 75 B5R0.2 NCCCCO CNP0514594.0 [1,0,0,0,0,0|1,0,0]=2 76 B5R0.2 OCCCCBr CNP0083982.0 [1,0,0,0,0,0|2,0,0]=3 77 B5R0.2 OCCCCCl CNP0079807.0 [1,0,0,0,0,0|2,0,0]=3 78 B5R0.2 OCCCCO CNP0080008.0 [1,0,0,0,0,0|2,0,0]=3 79 B5R0.2 [C-]#[N+]CCCC CNP0522879.0 [1,0,0,0,0,0|3,0,0]=4 80 B7R0.1 C=CCCCCCC CNP0246919.0 [0,1,0,0,0,0|3,0,0]=4 81 B7R0.1 C=CCCCCCO CNP0075956.0 [0,1,0,0,0,0|3,0,0]=4 82 B7R0.1 CCCC#CCCC CNP0381743.0 [0,1,0,0,0,0|3,0,0]=4 83 B7R0.1 CCCC=CCCC CNP0541880.0 [0,1,0,0,0,0|3,0,0]=4 84 B7R0.1 CCCC=CCCO CNP0287313.0 [0,1,0,0,0,0|3,0,0]=4 85 B7R0.1 CCCCCCC#N CNP0186663.0 [0,1,0,0,0,0|2,0,1]=4 86 B7R0.1 CCCCCCC=O CNP0243745.0 [0,1,0,0,0,0|3,0,0]=4 87 B7R0.1 CCCCCCCC CNP0286567.0 [0,1,0,0,0,0|3,0,0]=4 88 B7R0.1 CCCCCCCN CNP0186919.0 [0,1,0,0,0,0|2,0,0]=3 89 B7R0.1 CCCCCCCO CNP0329737.0 [0,1,0,0,0,0|3,0,0]=4 90 B7R0.1 CCCCCCNC CNP0413437.0 [0,1,0,0,0,0|2,0,0]=3 91 B7R0.1 CCCCCOCC CNP0520137.0 [0,1,0,0,0,0|3,0,0]=4 92 B7R0.1 CCCCNCCO CNP0185911.0 [0,1,0,0,0,0|2,0,0]=3 93 B7R0.1 CCCCOCCO CNP0080154.0 [0,1,0,0,0,0|3,0,0]=4 94 B7R0.1 CCCSSCCC CNP0328321.0 [0,1,0,0,0,0|3,0,0]=4 95 B7R0.1 CCNCCCCN CNP0107714.0 [0,1,0,0,0,0|2,0,0]=3 96 B7R0.1 CNCCCCCN CNP0390055.0 [0,1,0,0,0,0|1,0,0]=2 97 B7R0.1 CNCCCCNC CNP0145070.0 [0,1,0,0,0,0|3,0,0]=4 98 B7R0.1 COCCOCCO CNP0610336.0 [0,1,0,0,0,0|3,0,0]=4 99 B7R0.1 NCCCCCCN CNP0230906.0 [0,1,0,0,0,0|1,0,0]=2 100 B7R0.1 NCCCCCCO CNP0568466.0 [0,1,0,0,0,0|2,0,0]=3 101 B7R0.1 NCCCCCNO CNP0455910.0 [0,1,0,0,0,0|1,0,0]=2 102 B7R0.1 NCCCNCCS CNP0050642.0 [0,1,0,0,0,0|1,0,0]=2 103 B7R0.1 NCCSSCCN CNP0340186.0 [0,1,0,0,0,0|1,0,0]=2 104 B7R0.1 OCCCCCCBr CNP0593386.0 [0,1,0,0,0,0|3,0,0]=4 105 B7R0.1 OCCCCCCO CNP0080019.0 [0,1,0,0,0,0|3,0,0]=4 106 B7R0.1 OCCCCCCS CNP0154751.0 [0,1,0,0,0,0|3,0,0]=4 107 B7R0.1 OCCCSCCO CNP0079791.0 [0,1,0,0,0,0|3,0,0]=4 108 B7R0.1 OCCSSCCO CNP0279278.0 [0,1,0,0,0,0|3,0,0]=4 109 B7R0.1 SCCCCCCS CNP0089642.0 [0,1,0,0,0,0|3,0,0]=4 110 B7R0.1 [CH2-]CCCCCC#[O+] CNP0489135.0 [0,1,0,0,0,0|3,0,0]=4 111 B7R0.3 CCC(C)CCCO CNP0251541.0 [0,1,0,0,0,0|3,0,0]=4 112 B7R0.3 CCCCC(C)CO CNP0563062.0 [0,1,0,0,0,0|3,0,0]=4 113 B7R0.3 CCCCC(O)CO CNP0481107.0 [0,1,0,0,0,0|3,0,0]=4 114 B7R0.3 CCCC[C@@H](C)CC CNP0161853.2 [0,1,0,0,0,0|3,0,0]=4 115 B7R0.3 CCCC[C@H](C)CC CNP0161853.1 [0,1,0,0,0,0|3,0,0]=4 116 B7R0.3 CCCC[C@H](C)CO CNP0563062.1 [0,1,0,0,0,0|3,0,0]=4 117 B7R0.3 CCCC[C@H](O)CC CNP0102609.1 [0,1,0,0,0,0|3,0,0]=4 118 B7R0.3 CCCNC(=S)NN CNP0494468.0 [0,1,0,0,0,0|2,0,1]=4 119 B7R0.3 CCCSC(S)CC CNP0370062.0 [0,1,0,0,0,0|3,0,0]=4 120 B7R0.4 CC(C)CCCCO CNP0497904.0 [0,1,0,0,0,0|3,0,0]=4 121 B7R0.4 CC(O)CCCCO CNP0285438.0 [0,1,0,0,0,0|3,0,0]=4 122 B7R0.4 CCCCCC(=O)N CNP0077222.0 [0,1,0,0,0,0|2,0,1]=4 123 B7R0.4 CCCCCC(C)C CNP0146536.0 [0,1,0,0,0,0|3,0,0]=4 124 B7R0.4 CCCCC[C@@H](C)N CNP0336832.2 [0,1,0,0,0,0|2,0,0]=3 125 B7R0.4 CCCCC[C@@H](C)O CNP0256316.1 [0,1,0,0,0,0|3,0,0]=4 126 B7R0.4 CCCCC[C@@H](C)S CNP0076785.2 [0,1,0,0,0,0|3,0,0]=4 127 B7R0.4 CCCCC[C@H](C)N CNP0336832.1 [0,1,0,0,0,0|2,0,0]=3 128 B7R0.4 CCCCC[C@H](C)O CNP0256316.2 [0,1,0,0,0,0|3,0,0]=4 129 B7R0.4 CCCCC[C@H](C)S CNP0076785.1 [0,1,0,0,0,0|3,0,0]=4 130 B7R0.4 CCCNCC(C)C CNP0333564.0 [0,1,0,0,0,0|2,0,0]=3 131 B7R0.4 CCCSCC(C)C CNP0116113.0 [0,1,0,0,0,0|3,0,0]=4 132 B7R0.4 NC(=O)COCCO CNP0488363.0 [0,1,0,0,0,0|2,0,1]=4 133 B7R0.4 NCCCCC(=O)N CNP0001733.0 [0,1,0,0,0,0|1,0,1]=3 134 B7R0.4 NCCCCC(=O)O CNP0167970.0 [0,1,0,0,0,0|2,0,1]=4 135 B7R0.4 NCCNCC(=O)O CNP0461877.0 [0,1,0,0,0,0|1,0,1]=3 136 B7R0.4 O=C(O)CNCCO CNP0333030.0 [0,1,0,0,0,0|2,0,1]=4 137 B7R0.4 [CH2]CCCCC(C)C CNP0488090.0 [0,1,0,0,0,0|3,0,0]=4 138 B7R0.7 C=C(CCC)CCC CNP0515689.0 [0,1,0,0,0,0|3,0,0]=4 139 B7R0.7 CCCC(=O)CCC CNP0310318.0 [0,1,0,0,0,0|3,0,0]=4 140 B7R0.7 CCCC(C)CCC CNP0137963.0 [0,1,0,0,0,0|3,0,0]=4 141 B7R0.7 CCCC(O)CCC CNP0407378.0 [0,1,0,0,0,0|3,0,0]=4 142 B7R0.7 CCC[C@@H](C)CCO CNP0076379.1 [0,1,0,0,0,0|3,0,0]=4 143 B7R0.7 CCC[C@@H](S)CCO CNP0156811.1 [0,1,0,0,0,0|3,0,0]=4 144 B7R0.7 CCC[C@H](C)CCO CNP0076379.2 [0,1,0,0,0,0|3,0,0]=4 145 B7R0.7 CCC[C@H](S)CCO CNP0156811.2 [0,1,0,0,0,0|3,0,0]=4 146 B7R0.7 CN(CCCl)CCCl CNP0187159.0 [0,1,0,0,0,0|2,0,0]=3 147 B7R0.7 OCCC(O)CCO CNP0198973.0 [0,1,0,0,0,0|3,0,0]=4 148 B7R0.7 [O-][S+](CCO)CCO CNP0606218.0 [0,1,0,0,0,0|3,0,0]=4 149 B7R1.1 CCC1CCCC1 CNP0273207.0 [0,0,0,1,0,0|3,0,0]=4 150 B7R1.1 CCC1OCCO1 CNP0566823.0 [0,0,0,1,0,0|3,0,0]=4 151 B7R1.1 NC[C@@H]1CCCN1 CNP0565632.1 [0,0,0,1,0,0|1,0,0]=2 152 B7R1.1 OC[C@@H]1CCCN1 CNP0083051.2 [0,0,0,1,0,0|2,0,0]=3 153 B7R1.1 OC[C@@H]1CCCO1 CNP0262830.1 [0,0,0,1,0,0|3,0,0]=4 154 B7R1.1 OC[C@H]1CCCN1 CNP0083051.1 [0,0,0,1,0,0|2,0,0]=3 155 B7R1.1 OC[C@H]1CCCO1 CNP0262830.2 [0,0,0,1,0,0|3,0,0]=4 156 B7R1.3 BrC1CCCCC1 CNP0085881.0 [0,0,0,1,0,0|3,0,0]=4 157 B7R1.3 CC1CCCCC1 CNP0191222.0 [0,0,0,1,0,0|3,0,0]=4 158 B7R1.3 CC1CCCCO1 CNP0292894.0 [0,0,0,1,0,0|3,0,0]=4 159 B7R1.3 C[C@@H]1CCCCN1 CNP0238241.1 [0,0,0,1,0,0|2,0,0]=3 160 B7R1.3 C[C@H]1CCCCN1 CNP0238241.2 [0,0,0,1,0,0|2,0,0]=3 161 B7R1.3 NC1CCCCC1 CNP0149842.0 [0,0,0,1,0,0|2,0,0]=3 162 B7R1.3 N[C@@H]1CCC=NC1 CNP0491265.1 [0,0,0,1,0,0|1,0,2]=4 163 B7R1.3 O=C1CCCCN1 CNP0142808.0 [0,0,0,1,0,0|2,0,1]=4 164 B7R1.3 O=C1COCCN1 CNP0517075.0 [0,0,0,1,0,0|2,0,1]=4 165 B7R1.3 OC1CCCCC1 CNP0213861.0 [0,0,0,1,0,0|3,0,0]=4 166 B7R1.4 C[C@@H]1CCC[C@@H]1C CNP0306021.2 [0,0,0,1,0,0|3,0,0]=4 167 B7R1.4 C[C@@H]1CCC[C@H]1C CNP0306021.3 [0,0,0,1,0,0|3,0,0]=4 168 B7R1.4 C[C@@H]1CCC[C@H]1O CNP0569064.1 [0,0,0,1,0,0|3,0,0]=4 169 B7R1.4 C[C@H]1CCC[C@@H]1C CNP0306021.1 [0,0,0,1,0,0|3,0,0]=4 170 B7R1.4 N[C@@H]1CSC[C@@H]1O CNP0364292.4 [0,0,0,1,0,0|2,0,0]=3 171 B7R1.4 N[C@@H]1CSC[C@H]1O CNP0364292.3 [0,0,0,1,0,0|2,0,0]=3 172 B7R1.4 OC1CCCC1O CNP0519159.0 [0,0,0,1,0,0|3,0,0]=4 173 B7R1.4 O[C@@H]1COC[C@@H]1O CNP0326371.1 [0,0,0,1,0,0|3,0,0]=4 174 B7R1.4 O[C@@H]1COC[C@H]1O CNP0326371.2 [0,0,0,1,0,0|3,0,0]=4 175 B7R1.4 O[C@H]1COC[C@@H]1O CNP0326371.3 [0,0,0,1,0,0|3,0,0]=4 176 B7R1.4 SC1CCCC1S CNP0098071.0 [0,0,0,1,0,0|3,0,0]=4 177 B7R1.6 CCC[C@@H]1CCS1 CNP0328925.1 [0,0,0,1,0,0|3,0,0]=4 178 B7R1.7 CCCCC1CO1 CNP0608682.0 [0,0,0,1,0,0|3,0,0]=4 179 B7R1.8 CCC1CCC1O CNP0521190.0 [0,0,0,1,0,0|3,0,0]=4 180 B7R1.24 C1CCCCCC1 CNP0223227.0 [0,0,0,1,0,0|3,0,0]=4 181 B4R0.2 C#CCCC CNP0510243.0 [2,0,0,0,0,0|1,0,1]=4 182 B4R0.2 C=CCCC CNP0529271.0 [2,0,0,0,0,0|1,0,1]=4 183 B4R0.2 C=CCCN CNP0493733.0 [2,0,0,0,0,0|0,0,2]=4 184 B4R0.2 CC#CCC CNP0516358.0 [2,0,0,0,0,0|1,0,1]=4 185 B4R0.2 CC=CCC CNP0524560.0 [2,0,0,0,0,0|1,0,1]=4 186 B4R0.2 CCCC=O CNP0518034.0 [2,0,0,0,0,0|1,0,1]=4 187 B4R0.2 CCCCC CNP0486380.0 [2,0,0,0,0,0|1,0,0]=3 188 B4R0.2 CCCCI CNP0558480.0 [2,0,0,0,0,0|1,0,0]=3 189 B4R0.2 CCCCN CNP0597509.0 [2,0,0,0,0,0|0,0,0]=2 190 B4R0.2 CCCCO CNP0505612.0 [2,0,0,0,0,0|1,0,0]=3 191 B4R0.2 CCCCS CNP0598878.0 [2,0,0,0,0,0|1,0,0]=3 192 B4R0.2 CCCNC CNP0599313.0 [2,0,0,0,0,0|1,0,0]=3 193 B4R0.2 CCCOC CNP0609062.0 [2,0,0,0,0,0|2,0,0]=4 194 B4R0.2 CCCSC CNP0481317.0 [2,0,0,0,0,0|2,0,0]=4 195 B4R0.2 CCCSO CNP0594110.0 [2,0,0,0,0,0|2,0,0]=4 196 B4R0.2 CCNCC CNP0491960.0 [2,0,0,0,0,0|0,0,0]=2 197 B4R0.2 CCOCC CNP0572765.0 [2,0,0,0,0,0|1,0,0]=3 198 B4R0.2 CCSCC CNP0518873.0 [2,0,0,0,0,0|1,0,0]=3 199 B4R0.2 CCSSC CNP0571147.0 [2,0,0,0,0,0|2,0,0]=4 200 B4R0.2 CNCCN CNP0496542.0 [2,0,0,0,0,0|0,0,0]=2 201 B4R0.2 CNCCO CNP0513801.0 [2,0,0,0,0,0|1,0,0]=3 202 B4R0.2 COCCI CNP0495552.0 [2,0,0,0,0,0|2,0,0]=4 203 B4R0.2 COCCO CNP0561250.0 [2,0,0,0,0,0|2,0,0]=4 204 B4R0.2 COCC[Si] CNP0501162.0 [2,0,0,0,0,0|2,0,0]=4 205 B4R0.2 CSCCO CNP0574269.0 [2,0,0,0,0,0|2,0,0]=4 206 B4R0.2 N#CCCN CNP0502764.0 [2,0,0,0,0,0|0,0,2]=4 207 B4R0.2 NCCC=O CNP0502520.0 [2,0,0,0,0,0|1,0,1]=4 208 B4R0.2 NCCCN CNP0566837.0 [2,0,0,0,0,0|0,0,0]=2 209 B4R0.2 NCCCO CNP0538228.0 [2,0,0,0,0,0|1,0,0]=3 210 B4R0.2 NCCCS CNP0560812.0 [2,0,0,0,0,0|1,0,0]=3 211 B4R0.2 NOCON CNP0531529.0 [2,0,0,0,0,0|2,0,0]=4 212 B4R0.2 OCCCBr CNP0506989.0 [2,0,0,0,0,0|2,0,0]=4 213 B4R0.2 OCCCO CNP0503416.0 [2,0,0,0,0,0|2,0,0]=4 214 B4R0.2 OCCCS CNP0586497.0 [2,0,0,0,0,0|2,0,0]=4 215 B4R0.2 SCCCS CNP0528691.0 [2,0,0,0,0,0|2,0,0]=4 216 B4R0.2 [C-]#[N+]CCC CNP0525086.0 [2,0,0,0,0,0|2,0,0]=4 217 B6R0.1 CCC(Br)CCBr CNP0612222.0 [1,1,0,0,0,0|2,0,0]=4 218 B6R0.1 CCCC(=O)CC CNP0248158.0 [1,1,0,0,0,0|2,0,0]=4 219 B6R0.1 CCC[C@@H](C)CC CNP0407855.1 [1,1,0,0,0,0|2,0,0]=4 220 B6R0.1 CCC[C@@H](C)CO CNP0356704.1 [1,1,0,0,0,0|2,0,0]=4 221 B6R0.1 CCC[C@@H](O)CC CNP0346810.2 [1,1,0,0,0,0|2,0,0]=4 222 B6R0.1 CCC[C@H](C)CC CNP0407855.2 [1,1,0,0,0,0|2,0,0]=4 223 B6R0.1 CCC[C@H](C)CO CNP0356704.2 [1,1,0,0,0,0|2,0,0]=4 224 B6R0.1 CCC[C@H](O)CC CNP0346810.1 [1,1,0,0,0,0|2,0,0]=4 225 B6R0.1 CCNC(=O)CC CNP0586892.0 [1,1,0,0,0,0|1,0,1]=4 226 B6R0.1 CCOC(C)CC CNP0086282.0 [1,1,0,0,0,0|2,0,0]=4 227 B6R0.1 CCSC(S)CC CNP0488688.0 [1,1,0,0,0,0|2,0,0]=4 228 B6R0.1 CC[C@@H](C)CCO CNP0260863.2 [1,1,0,0,0,0|2,0,0]=4 229 B6R0.1 CC[C@H](C)CCO CNP0260863.1 [1,1,0,0,0,0|2,0,0]=4 230 B6R0.1 NCC[C@@H](O)CN CNP0347226.2 [1,1,0,0,0,0|0,0,0]=2 231 B6R0.1 NCC[C@H](O)CN CNP0347226.1 [1,1,0,0,0,0|0,0,0]=2 232 B6R0.1 OCC[C@H](O)CO CNP0190269.1 [1,1,0,0,0,0|2,0,0]=4 233 B6R0.4 CC(=CCCN)C CNP0568876.0 [1,1,0,0,0,0|1,0,1]=4 234 B6R0.4 CC(=O)NCCN CNP0182526.0 [1,1,0,0,0,0|0,0,1]=3 235 B6R0.4 CC(=O)NCCO CNP0304709.0 [1,1,0,0,0,0|1,0,1]=4 236 B6R0.4 CC(=O)NCCS CNP0516453.0 [1,1,0,0,0,0|1,0,1]=4 237 B6R0.4 CC(=O)OCCN CNP0165405.0 [1,1,0,0,0,0|1,0,1]=4 238 B6R0.4 CC(C)CCCO CNP0344466.0 [1,1,0,0,0,0|2,0,0]=4 239 B6R0.4 CC(C)NCCN CNP0082470.0 [1,1,0,0,0,0|0,0,0]=2 240 B6R0.4 CC(C)NCCO CNP0141461.0 [1,1,0,0,0,0|1,0,0]=3 241 B6R0.4 CC(C)OCCO CNP0079907.0 [1,1,0,0,0,0|2,0,0]=4 242 B6R0.4 CCCCC(=O)N CNP0248834.0 [1,1,0,0,0,0|1,0,1]=4 243 B6R0.4 CCCCC(C)C CNP0312749.0 [1,1,0,0,0,0|2,0,0]=4 244 B6R0.4 CCCC[C@@H](C)O CNP0276755.1 [1,1,0,0,0,0|2,0,0]=4 245 B6R0.4 CCCC[C@H](C)O CNP0276755.2 [1,1,0,0,0,0|2,0,0]=4 246 B6R0.4 CCCNC(=O)C CNP0115400.0 [1,1,0,0,0,0|1,0,1]=4 247 B6R0.4 CCCSC(C)C CNP0228244.0 [1,1,0,0,0,0|2,0,0]=4 248 B6R0.4 CCCSC(C)S CNP0609747.0 [1,1,0,0,0,0|2,0,0]=4 249 B6R0.4 CCNCC(=O)O CNP0076362.0 [1,1,0,0,0,0|1,0,1]=4 250 B6R0.4 CCNCC(C)C CNP0165310.0 [1,1,0,0,0,0|1,0,0]=3 251 B6R0.4 CCOCC(=O)N CNP0329352.0 [1,1,0,0,0,0|1,0,1]=4 252 B6R0.4 CCOC[C@@H](C)O CNP0076159.1 [1,1,0,0,0,0|2,0,0]=4 253 B6R0.4 CCSCC(C)C CNP0208462.0 [1,1,0,0,0,0|2,0,0]=4 254 B6R0.4 C[S@+]([O-])CCCN CNP0591601.1 [1,1,0,0,0,0|2,0,0]=4 255 B6R0.4 C[S@H+]([O-])CCCN CNP0545944.1 [1,1,0,0,0,0|2,0,0]=4 256 B6R0.4 NC(=O)CCCO CNP0573523.0 [1,1,0,0,0,0|1,0,1]=4 257 B6R0.4 NCCCC(=O)O CNP0116256.0 [1,1,0,0,0,0|1,0,1]=4 258 B6R0.4 NCCN[N+](=O)[O-] CNP0355337.0 [1,1,0,0,0,0|2,0,0]=4 259 B8R0.1 NCCCC(N)CC=O CNP0515515.0 [0,2,0,0,0,0|2,0,0]=4 260 B8R0.4 CCCCCCCCN CNP0065900.0 [0,2,0,0,0,0|2,0,0]=4 261 B8R0.4 CCCCCCCNC CNP0216624.0 [0,2,0,0,0,0|2,0,0]=4 262 B8R0.4 CCCCNCCCC CNP0203128.0 [0,2,0,0,0,0|2,0,0]=4 263 B8R0.4 NCCCNCCCN CNP0609056.0 [0,2,0,0,0,0|0,0,0]=2 264 B8R0.4 NCCCOCCCN CNP0453820.0 [0,2,0,0,0,0|1,0,0]=3 265 B8R0.6 NCCCCC(N)C=O CNP0581320.0 [0,2,0,0,0,0|1,0,0]=3 266 B8R0.7 CCCCCCC(=O)N CNP0248097.0 [0,2,0,0,0,0|2,0,0]=4 267 B8R0.7 C[C@H](N)CNCCCN CNP0150117.1 [0,2,0,0,0,0|0,0,0]=2 268 B8R0.7 N=C(N)NCCCCN CNP0572375.0 [0,2,0,0,0,0|1,0,1]=4 269 B8R0.7 NCCCCCC(=O)O CNP0337210.0 [0,2,0,0,0,0|2,0,0]=4 270 B8R0.7 NCCCCN=C(N)N CNP0307539.0 [0,2,0,0,0,0|1,0,1]=4 271 B8R0.7 NCCCCNC(=O)N CNP0414848.0 [0,2,0,0,0,0|1,0,1]=4 272 B8R0.8 NCCNC(=O)C(=O)N CNP0471629.0 [0,2,0,0,0,0|0,0,2]=4 273 B8R0.28 CC(C)CCC[C@@H](C)N CNP0402006.1 [0,2,0,0,0,0|2,0,0]=4 274 B8R0.28 CC(C)CCC[C@H](C)N CNP0402006.2 [0,2,0,0,0,0|2,0,0]=4 275 B8R0.28 CC(C)CNCC(C)C CNP0347227.0 [0,2,0,0,0,0|2,0,0]=4 276 B8R0.22 CCCN(C=O)CCC CNP0082253.0 [0,2,0,0,0,0|2,0,0]=4 277 B8R0.22 CCN(CCO)CCCl CNP0082053.0 [0,2,0,0,0,0|2,0,0]=4 278 B8R0.22 CCN(CCO)CCO CNP0368162.0 [0,2,0,0,0,0|2,0,0]=4 279 B8R0.22 O=NN(CCO)CCO CNP0568546.0 [0,2,0,0,0,0|2,0,0]=4 280 B6R1.1 C1=CCCCC1 CNP0275665.0 [1,0,0,1,0,0|2,0,0]=4 281 B6R1.1 C1=CCNCC1 CNP0086452.0 [1,0,0,1,0,0|1,0,1]=4 282 B6R1.1 C1=CNCCC1 CNP0200592.0 [1,0,0,1,0,0|1,0,1]=4 283 B6R1.1 C1=NCCCC1 CNP0139263.0 [1,0,0,1,0,0|1,0,1]=4 284 B6R1.1 C1CCCCC1 CNP0220772.0 [1,0,0,1,0,0|2,0,0]=4 285 B6R1.1 C1CCNCC1 CNP0153358.0 [1,0,0,1,0,0|1,0,0]=3 286 B6R1.1 C1CCOCC1 CNP0484551.0 [1,0,0,1,0,0|2,0,0]=4 287 B6R1.1 C1CNCCN1 CNP0389558.0 [1,0,0,1,0,0|0,0,0]=2 288 B6R1.1 C1CNCCN1 CNP0554301.0 [1,0,0,1,0,0|0,0,0]=2 289 B6R1.1 C1COCCN1 CNP0167865.0 [1,0,0,1,0,0|1,0,0]=3 290 B6R1.1 C1COCCO1 CNP0353166.0 [1,0,0,1,0,0|2,0,0]=4 291 B6R1.1 C1CSCCS1 CNP0316640.0 [1,0,0,1,0,0|2,0,0]=4 292 B6R1.2 CC1CCCC1 CNP0194612.0 [1,0,0,1,0,0|2,0,0]=4 293 B6R1.2 CC1CCCO1 CNP0502439.0 [1,0,0,1,0,0|2,0,0]=4 294 B6R1.2 CC1OCCO1 CNP0611683.0 [1,0,0,1,0,0|2,0,0]=4 295 B6R1.2 CC1SCCS1 CNP0002932.0 [1,0,0,1,0,0|2,0,0]=4 296 B6R1.2 C[C@@H]1CCCN1 CNP0080827.1 [1,0,0,1,0,0|1,0,0]=3 297 B6R1.2 C[C@@H]1CCSC1 CNP0174337.1 [1,0,0,1,0,0|2,0,0]=4 298 B6R1.2 C[C@H]1NCCS1 CNP0150573.1 [1,0,0,1,0,0|1,0,0]=3 299 B6R1.2 NN1CCCC1 CNP0577233.0 [1,0,0,1,0,0|2,0,0]=4 300 B6R1.2 O=C1CCCN1 CNP0127855.0 [1,0,0,1,0,0|1,0,1]=4 301 B6R1.2 OC1CCCC1 CNP0085994.0 [1,0,0,1,0,0|2,0,0]=4 302 B6R1.2 O[C@H]1CNOC1 CNP0590444.1 [1,0,0,1,0,0|2,0,0]=4 303 B6R1.2 S=C1NCCN1 CNP0310090.0 [1,0,0,1,0,0|1,0,1]=4 304 B6R1.2 SC1CCCC1 CNP0280825.0 [1,0,0,1,0,0|2,0,0]=4 305 B6R1.2 SC1CCCS1 CNP0002503.0 [1,0,0,1,0,0|2,0,0]=4 306 B6R1.3 CCCC1CC1 CNP0506060.0 [1,0,0,1,0,0|2,0,0]=4 307 B6R1.3 NCCN1CC1 CNP0522628.0 [1,0,0,1,0,0|0,0,0]=2 308 B6R1.4 C[C@H]1CS[C@@H]1C CNP0207395.1 [1,0,0,1,0,0|2,0,0]=4 309 B6R1.8 CC[C@@H]1C[C@@H]1C CNP0076250.1 [1,0,0,1,0,0|2,0,0]=4 310 B8R1.2 CNC1CCCCC1 CNP0474937.0 [0,1,0,1,0,0|2,0,0]=4 311 B8R1.2 NCC1CCCCC1 CNP0581484.0 [0,1,0,1,0,0|2,0,0]=4 312 B8R1.2 NCC1CCOCC1 CNP0398955.0 [0,1,0,1,0,0|2,0,0]=4 313 B8R1.2 OCC1CCCCN1 CNP0335046.0 [0,1,0,1,0,0|2,0,0]=4 314 B8R1.5 N[C@@H]1CCCC[C@@H]1O CNP0462389.2 [0,1,0,1,0,0|2,0,0]=4 315 B8R1.5 N[C@@H]1CCCC[C@H]1O CNP0462389.4 [0,1,0,1,0,0|2,0,0]=4 316 B8R1.5 N[C@@H]1CCCNC1=O CNP0274946.1 [0,1,0,1,0,0|1,0,1]=4 317 B8R1.5 N[C@H]1CCCC[C@@H]1O CNP0462389.1 [0,1,0,1,0,0|2,0,0]=4 318 B8R1.5 N[C@H]1CCCC[C@H]1O CNP0462389.3 [0,1,0,1,0,0|2,0,0]=4 319 B8R1.8 CCCC1NCCS1 CNP0002551.0 [0,1,0,1,0,0|2,0,0]=4 320 B8R1.8 CCCN1OCCO1 CNP0257167.0 [0,1,0,1,0,0|2,0,0]=4 321 B8R1.8 COC[C@@H]1CCCN1 CNP0414825.1 [0,1,0,1,0,0|2,0,0]=4 322 B8R1.8 NCCC1CN=CN1 CNP0562963.0 [0,1,0,1,0,0|1,0,1]=4 323 B8R1.11 OC[C@H]1NCC[C@@H]1O CNP0110769.1 [0,1,0,1,0,0|2,0,0]=4 324 B8R1.22 NC1=NCCCCC1 CNP0446960.0 [0,1,0,1,0,0|1,0,1]=4 325 B8R1.22 NC1=[NH+]CCCCC1 CNP0594018.0 [0,1,0,1,0,0|1,0,1]=4 326 B8R1.22 O=C1CCCCCN1 CNP0157959.0 [0,1,0,1,0,0|2,0,0]=4 327 B8R1.22 O[C@@H]1CNCCOC1 CNP0237299.1 [0,1,0,1,0,0|2,0,0]=4 328 B8R1.4 CN1CCOC(C1)O CNP0001228.0 [0,1,0,1,0,0|2,0,0]=4 329 B8R1.4 C[C@@H]1CCC[C@@H](N1)C CNP0277987.1 [0,1,0,1,0,0|2,0,0]=4 330 B8R1.4 C[C@@H]1CCC[C@H](N1)C CNP0277987.2 [0,1,0,1,0,0|2,0,0]=4 331 B8R1.7 NC(=O)[C@@H]1CCCN1 CNP0120914.1 [0,1,0,1,0,0|1,0,1]=4