0  B5R0.1  CC(CCO)N CM14429 [0,0,0,0,0,0|1,0,2]=3
1  B4R0.1  CC=C(C)Br CM14455 [1,0,0,0,0,0|1,0,0]=2
2  B4R0.1  C[C@@H](CN)N CM14368 [1,0,0,0,0,0|2,0,1]=4
3  B4R0.1  C[C@H](CN)N CM14342 [1,0,0,0,0,0|2,0,1]=4
4  B6R0.4  CC(=O)C=COC CM11079 [0,1,0,0,0,0|1,0,1]=3
5  B6R1.2  C1COCC1Br CM10289 [0,0,0,1,0,0|1,0,2]=4
6  B6R1.2  Cc1cc[nH]n1 CM14373 [0,0,0,1,0,0|2,0,1]=4
7  B6R1.2  c1co[nH]c1=O CM10160 [0,0,0,1,0,0|2,0,1]=4
8  B6R1.2  c1conc1N CM10019 [0,0,0,1,0,0|2,0,1]=4
9  B6R1.3  C1CC1CCO CM13498 [0,0,0,1,0,0|0,0,2]=3
10  B3R0.1  C=CC=O CM11306 [2,0,0,0,0,0|0,0,2]=4
11  B3R0.2  CC(=S)O CM13905 [2,0,0,0,0,0|1,0,0]=3
12  B5R0.4  CC(C)(C)C=O CM10011 [1,1,0,0,0,0|0,0,2]=4
13  B5R0.4  CC(C)(CN)N CM11082 [1,1,0,0,0,0|1,0,1]=4
14  B5R0.4  CC(C)(CN)S CM13886 [1,1,0,0,0,0|1,0,1]=4
15  B5R0.5  CC(C(=O)O)F CM13749 [1,1,0,0,0,0|1,0,1]=4
16  B5R0.2  C(C=CCCl)Cl CM14478 [1,1,0,0,0,0|1,0,0]=3
17  B5R0.2  C(C=CCCl)Cl CM14479 [1,1,0,0,0,0|1,0,0]=3
18  B5R0.2  C(C=CCCl)O CM14462 [1,1,0,0,0,0|0,0,0]=2
19  B7R0.4  CC(=O)OC=CCBr CM11056 [0,2,0,0,0,0|2,0,0]=4
20  B5R1.2  C1C(=O)CO1 CM14220 [1,0,0,1,0,0|1,0,0]=3
21  B5R1.2  C1C(CO1)I CM14229 [1,0,0,1,0,0|1,0,1]=4
22  B5R1.2  C1C(CO1)N CM14221 [1,0,0,1,0,0|1,0,1]=4
23  B5R1.2  C1C(CO1)O CM14219 [1,0,0,1,0,0|1,0,1]=4
24  B5R1.2  C1CC(=O)C1 CM14132 [1,0,0,1,0,0|1,0,1]=4
25  B5R1.3  C1CC1CBr CM13343 [1,0,0,1,0,0|1,0,1]=4
26  B5R1.1  C1C=CCN1 CM14480 [1,0,0,1,0,0|1,0,0]=3
27  B7R1.2  C1=CC(=O)OC1O CM11011 [0,1,0,1,0,0|2,0,0]=4
28  B7R1.2  Cc1cc(on1)C CM14486 [0,1,0,1,0,0|1,0,1]=4
29  B7R1.3  C1COCCC1=O CM14255 [0,1,0,1,0,0|1,0,1]=4
30  B7R1.22  C1CC1C(=O)CBr CM11136 [0,1,0,1,0,0|1,0,1]=4