0  B12R1.125  C=C(C)COC1=CC=CC=C1N c03068 [0,0,0,0,0,0|3,0,1]=4
1  B12R1.125  CC(=O)NCC1=C(Cl)C=CC=C1 e00298 [0,0,0,0,0,0|3,0,0]=3
2  B12R1.125  CC(C)COC1=CC=CC=C1N c04116 [0,0,0,0,0,0|3,0,0]=3
3  B12R1.125  CC(C)NCC1=C(Cl)C=CC=C1 c04000 [0,0,0,0,0,0|2,0,0]=2
4  B12R1.125  CC(C)NCC1=CC=CC=C1Br c04046 [0,0,0,0,0,0|2,1,0]=3
5  B12R1.125  NC(=O)COC1=C(Cl)C=CC=C1 c07702 [0,0,0,0,0,0|4,0,0]=4
6  B12R1.125  O=C(O)CCC1=C(Cl)C=CC=C1 c04893 [0,0,0,0,0,0|3,0,0]=3
7  B12R1.125  O=C(O)COC1=C(Cl)C=CC=C1 a08309 [0,0,0,0,0,0|4,0,0]=4
8  B11R1.17  CCNCC1=C(Cl)C=CC=C1 c03998 [1,0,0,0,0,0|2,0,0]=3
9  B11R1.17  O=CNCC1=C(Cl)C=CC=C1 e00675 [1,0,0,0,0,0|3,0,0]=4
10  B13R1.164  CC(=O)NCC1=C(Cl)C=C(Cl)C=C1 e00345 [0,1,0,0,0,0|3,0,0]=4
11  B13R1.201  CC(C)NC(=O)C1=C(Cl)C=CC=C1 c03927 [0,1,0,0,0,0|2,0,1]=4
12  B13R1.202  CC1=CC=CC=C1CC(=O)N(C)C e00028 [0,1,0,0,0,0|1,0,1]=3
13  B13R1.528  CCC(C)NCC1=C(C)C=CC=C1 c04077 [0,1,0,0,0,0|3,0,0]=4
14  B13R1.528  CCC(C)NCC1=C(Cl)C=CC=C1 c04078 [0,1,0,0,0,0|2,0,0]=3
15  B13R1.528  CCC(C)NCC1=CC=CC=C1Br c04049 [0,1,0,0,0,0|2,1,0]=4
16  B13R1.528  CNC(=O)CCC1=C(N)C=CC=C1 c07689 [0,1,0,0,0,0|3,0,0]=4
17  B11R1.86  CC(=O)NC1=CC=CC=C1Cl a03950 [0,0,0,0,1,0|3,0,0]=4
18  B11R1.86  CC(C)OC1=CC=CC=C1N c07269 [0,0,0,0,1,0|3,0,0]=4
19  B11R1.86  CN(C)CC1=C(O)C=CC=C1 c02807 [0,0,0,0,1,0|1,0,0]=2
20  B11R1.86  CN(C)CC1=NC=CC=C1O c08864 [0,0,0,0,1,0|2,0,0]=3
21  B12R1.267  CCCNCC1=C(Cl)C=CC=C1 c04001 [1,1,0,0,0,0|1,0,0]=3
22  B12R1.267  CNCCOC1=C(C)C=CC=C1 c04113 [1,1,0,0,0,0|1,0,0]=3
23  B12R1.267  CNCCOC1=C(F)C=CC=C1 c04422 [1,1,0,0,0,0|0,1,0]=3
24  B12R1.21  CC(C)COC1=CC=C(N)C=C1 c01981 [1,1,0,0,0,0|2,0,0]=4
25  B12R1.21  CC(C)COC1=CC=C(N)C=C1 e00935 [1,1,0,0,0,0|2,0,0]=4
26  B12R1.43  CN(C)C(=O)CC1=CC=CC=C1 c08844 [1,1,0,0,0,0|0,0,1]=3
27  B12R1.226  CC(C)COC1=CC(N)=CC=C1 c02559 [1,1,0,0,0,0|2,0,0]=4
28  B12R1.226  CC(C)COC1=CC(N)=CC=C1 c04105 [1,1,0,0,0,0|2,0,0]=4
29  B12R1.124  CC1=C(C(=O)N(C)C)C=CC=C1 c09231 [0,1,0,0,1,0|1,0,1]=4
30  B12R1.124  CN(C)C(=O)C1=C(Cl)C=CC=C1 c09233 [0,1,0,0,1,0|0,0,1]=3
31  B12R1.124  CN(C)C(=O)C1=CC=CC=C1N a09372 [0,1,0,0,1,0|1,0,1]=4
32  B14R1.161  CC1=CC=CC=C1OCC(=O)N(C)C e00140 [0,1,0,0,0,1|1,0,1]=4
33  B14R1.161  CN(C)C(=O)CCC1=C(N)C=CC=C1 c07574 [0,1,0,0,0,1|1,0,0]=3
34  B14R1.161  CN(C)C(=O)COC1=C(Cl)C=CC=C1 e00443 [0,1,0,0,0,1|0,0,1]=3