0 B5R0.2 C(CC#N)CBr CM12994 [0,0,0,0,0,0|2,0,1]=3 1 B4R0.2 COCC#N CM13130 [1,0,0,0,0,0|2,0,1]=4 2 B6R0.4 CC(=O)C=COC CM11079 [0,1,0,0,0,0|1,0,2]=4 3 B6R1.1 C1CSCCN1 CM13980 [0,0,0,1,0,0|1,1,1]=4 4 B6R1.2 C1C=CCC1O CM14094 [0,0,0,1,0,0|2,0,1]=4 5 B6R1.2 C1COCC1Br CM10289 [0,0,0,1,0,0|2,0,1]=4 6 B6R1.3 C1CC1CC#N CM13687 [0,0,0,1,0,0|1,0,1]=3 7 B6R1.3 C1CC1CCO CM13498 [0,0,0,1,0,0|0,0,2]=3 8 B6R1.6 C1C(CN1)C#N CM14240 [0,0,0,1,0,0|2,0,1]=4 9 B6R1.6 C1C(CO1)CN CM14243 [0,0,0,1,0,0|2,0,1]=4 10 B6R1.6 C1C(CO1)CO CM14247 [0,0,0,1,0,0|1,0,2]=4 11 B6R1.6 C1CC(C1)CBr CM14105 [0,0,0,1,0,0|1,0,1]=3 12 B3R0.1 C=CC=O CM11306 [2,0,0,0,0,0|0,0,2]=4 13 B5R0.1 C(C#N)C(=O)O CM10060 [1,1,0,0,0,0|1,0,1]=4 14 B5R0.1 CC#CC(=O)O CM10024 [1,1,0,0,0,0|0,0,2]=4 15 B5R0.1 CC(CCO)N CM14429 [1,1,0,0,0,0|0,0,1]=3 16 B7R0.6 C(C[N+](=O)[O-])C(=O)O CM10288 [0,2,0,0,0,0|2,0,0]=4 17 B7R0.6 CC(C)CO[N+](=O)[O-] CM13895 [0,2,0,0,0,0|2,0,0]=4 18 B7R0.8 C(CN)CP(=O)(O)O CM10052 [0,2,0,0,0,0|2,0,0]=4 19 B5R1.1 C1C=CCN1 CM14480 [1,0,0,1,0,0|1,0,1]=4 20 B5R1.2 C1C(=O)CO1 CM14220 [1,0,0,1,0,0|1,0,0]=3 21 B5R1.2 C1C(CN1)F CM14271 [1,0,0,1,0,0|2,0,0]=4 22 B5R1.2 C1C(CN1)O CM14096 [1,0,0,1,0,0|1,0,1]=4 23 B5R1.2 C1C(CO1)I CM14229 [1,0,0,1,0,0|2,0,0]=4 24 B5R1.2 C1C(CO1)N CM14221 [1,0,0,1,0,0|2,0,0]=4 25 B5R1.2 C1C(CO1)O CM14219 [1,0,0,1,0,0|1,0,1]=4 26 B5R1.2 C1CC(=O)C1 CM14132 [1,0,0,1,0,0|0,0,0]=2 27 B5R1.3 C1CC1CBr CM13343 [1,0,0,1,0,0|1,0,0]=3 28 B7R1.1 C1CCC(C1)C#N CM13026 [0,1,0,1,0,0|1,0,1]=4 29 B7R1.2 C1C[C@H](C[C@@H]1N)O CM10407 [0,1,0,1,0,0|0,0,2]=4 30 B7R1.3 C1COC(=O)CN1 CM10412 [0,1,0,1,0,0|1,0,0]=3 31 B7R1.3 C1COCCC1=O CM14255 [0,1,0,1,0,0|0,0,0]=2 32 B7R1.3 C1COCCC1O CM14273 [0,1,0,1,0,0|0,0,2]=4 33 B7R1.14 C[Si]1(CCCC1)C CM10032 [0,1,0,1,0,0|1,1,0]=4 34 B7R1.18 C1C(CN1)C(=O)N CM14241 [0,1,0,1,0,0|1,0,0]=3 35 B7R1.18 C1C(CN1)C(=O)N CM14242 [0,1,0,1,0,0|1,0,0]=3 36 B7R1.18 C1C(CN1)C(=O)O CM14218 [0,1,0,1,0,0|1,0,0]=3 37 B7R1.18 C1CC(C1)C(=O)O CM11089 [0,1,0,1,0,0|0,0,0]=2 38 B7R1.20 C1CC1CC(=O)O CM13686 [0,1,0,1,0,0|0,0,0]=2