0  B4R0.1  CC=C(C)Br CM14455 [1,0,0,0,0,0|1,0,1]=3
1  B6R0.4  CC(=O)C=COC CM11079 [0,1,0,0,0,0|1,0,1]=3
2  B6R1.2  Cc1cc[nH]n1 CM14373 [0,0,0,1,0,0|2,0,0]=3
3  B6R1.2  c1co[nH]c1=O CM10160 [0,0,0,1,0,0|2,0,1]=4
4  B6R1.2  c1conc1N CM10019 [0,0,0,1,0,0|2,0,1]=4
5  B3R0.1  C=CC=O CM11306 [2,0,0,0,0,0|0,0,0]=2
6  B3R0.2  CC(=S)O CM13905 [2,0,0,0,0,0|1,0,1]=4
7  B3R0.2  CS(=O)[O-] CM13899 [2,0,0,0,0,0|2,0,0]=4
8  B5R0.4  CC(C)(C)C=O CM10011 [1,1,0,0,0,0|0,0,1]=3
9  B5R0.5  CC(C(=O)O)F CM13749 [1,1,0,0,0,0|1,0,1]=4
10  B5R0.2  C(C=CCCl)Cl CM14478 [1,1,0,0,0,0|1,0,1]=4
11  B5R0.2  C(C=CCCl)Cl CM14479 [1,1,0,0,0,0|1,0,1]=4
12  B5R0.2  C(C=CCCl)O CM14462 [1,1,0,0,0,0|0,0,2]=4
13  B7R0.4  CC(=O)OC=CCBr CM11056 [0,2,0,0,0,0|2,0,0]=4
14  B7R0.6  CN(C)C=C[N+](=O)[O-] CM10970 [0,2,0,0,0,0|1,0,0]=3
15  B5R1.1  C1C=CCN1 CM14480 [1,0,0,1,0,0|1,0,1]=4
16  B7R1.1  c1c[nH]nc1CCl CM10174 [0,1,0,1,0,0|2,0,0]=4
17  B7R1.2  Cc1cc(on1)C CM14486 [0,1,0,1,0,0|1,0,1]=4
18  B7R1.2  Cc1ncc(s1)I CM10702 [0,1,0,1,0,0|2,0,0]=4
19  B7R1.4  Cc1cscc1Br CM10703 [0,1,0,1,0,0|0,1,1]=4
20  B7R1.20  C1CC1CC(=O)O CM13686 [0,1,0,1,0,0|0,0,2]=4