0  B9R1.8  OCCC1=CC=CC=C1 D00192 [1,0,0,0,0,0|1,0,0]=2
1  B9R1.15  COC1=CC=CC=C1O D00117 [1,0,0,0,0,0|2,0,0]=3
2  B9R1.15  OC1=CC=CC=C1[Hg]Cl D04932 [1,0,0,0,0,0|3,0,0]=4
3  B9R1.15  OCC1=CC=CC=C1O D05790 [1,0,0,0,0,0|2,0,0]=3
4  B8R1.2  C(=O)C1=CC=CC=C1 D02314 [2,0,0,0,0,0|1,0,1]=4
5  B8R1.2  OCC1=CC=CC=C1 D00077 [2,0,0,0,0,0|1,0,0]=3
6  B8R1.2  OCC1=CC=CN=C1 D05158 [2,0,0,0,0,0|2,0,0]=4
7  B8R1.5  NC1=CC=NC=C1N D10228 [2,0,0,0,0,0|2,0,0]=4
8  B8R1.5  NC1=CC=NC=C1N D10689 [2,0,0,0,0,0|2,0,0]=4
9  B10R1.15  CCC(O)C1=CC=CC=C1 D01470 [1,1,0,0,0,0|1,0,0]=3
10  B10R1.17  CNCCC1=NC=CC=C1 D01592 [1,1,0,0,0,0|1,0,0]=3
11  B10R1.17  CNCCC1=NC=CC=C1 D03102 [1,1,0,0,0,0|1,0,0]=3
12  B10R1.17  CNCCC1=NC=CC=C1 D07522 [1,1,0,0,0,0|1,0,0]=3
13  B10R1.17  NNCCC1=CC=CC=C1 D00505 [1,1,0,0,0,0|0,0,0]=2
14  B10R1.17  NNCCC1=CC=CC=C1 D08349 [1,1,0,0,0,0|0,0,0]=2
15  B10R1.17  OCCOC1=CC=CC=C1 D08359 [1,1,0,0,0,0|1,0,0]=3
16  B10R1.18  CC(N)CC1=CC=CC=C1 D02074 [1,1,0,0,0,0|0,0,0]=2
17  B10R1.18  CC(N)CC1=CC=CC=C1 D07445 [1,1,0,0,0,0|0,0,0]=2
18  B10R1.18  C[C@@H](N)CC1=CC=CC=C1 D04704 [1,1,0,0,0,0|0,0,0]=2
19  B10R1.18  C[C@H](N)CC1=CC=CC=C1 D02078 [1,1,0,0,0,0|0,0,0]=2
20  B10R1.18  C[C@H](N)CC1=CC=CC=C1 D03740 [1,1,0,0,0,0|0,0,0]=2
21  B10R1.18  O=C(O)CC1=CC=CC=C1 D09942 [1,1,0,0,0,0|1,0,1]=4
22  B10R1.18  O=C([O-])CC1=CC=CC=C1 D05867 [1,1,0,0,0,0|1,0,1]=4
23  B10R1.61  NC(=O)C1=C(O)C=CC=C1 D01811 [1,1,0,0,0,0|1,0,1]=4
24  B12R1.1123  NCCC1=CC(O)=C(O)C=C1O D05294 [0,2,0,0,0,0|1,0,0]=3
25  B12R1.151  CC(C)(N)CC1=C(Cl)C=CC=C1 D03566 [0,2,0,0,0,0|0,1,0]=3
26  B12R2.221  OC1=C2CCCC2=C(Cl)C=C1 D03464 [0,1,0,1,0,0|1,1,0]=4
27  B8R1.8  NCCC1=CNC=N1 D04444 [1,0,0,0,1,0|2,0,0]=4
28  B8R1.8  NCCC1=CNC=N1 D04445 [1,0,0,0,1,0|2,0,0]=4
29  B8R1.8  NCCC1=CNC=N1 D08040 [1,0,0,0,1,0|2,0,0]=4
30  B8R1.8  NCCC1=NNC=C1 D01187 [1,0,0,0,1,0|2,0,0]=4