0  B7R1.3  CC1=NC=CC=C1 YMDB01458 [0,0,0,0,0,0|2,0,0]=2
1  B8R1.2  O=CC1=CC=CC=C1 YMDB01326 [0,1,0,0,0,0|0,0,1]=2
2  B8R1.2  OCC1=CC=CC=C1 YMDB01426 [0,1,0,0,0,0|0,0,0]=1
3  B8R1.3  CC1=CN=C(C)C=N1 YMDB01598 [0,1,0,0,0,0|3,0,0]=4
4  B8R1.3  O=C1C=CC(=O)C=C1 YMDB00155 [0,1,0,0,0,0|0,0,1]=2
5  B8R1.4  CC1=CC=CC(O)=C1 YMDB01730 [0,1,0,0,0,0|0,0,0]=1
6  B8R1.4  CC1=CN=CC(C)=N1 YMDB01600 [0,1,0,0,0,0|3,0,0]=4
7  B8R1.4  NC1=CC=NC(=O)N1 YMDB00651 [0,1,0,0,0,0|2,0,1]=4
8  B8R1.4  O=C1C=CNC(=O)N1 YMDB00098 [0,1,0,0,0,0|2,0,1]=4
9  B8R1.5  CC1=CC=CC=C1O YMDB01457 [0,1,0,0,0,0|0,0,0]=1
10  B6R0.6  C\C=C\C=C\CO YMDB01707 [0,0,1,0,0,0|0,0,2]=3
11  B6R1.2  CC1=CC=CS1 YMDB01462 [0,0,0,0,1,0|2,0,0]=3
12  B6R1.2  CC1=CSC=N1 YMDB01620 [0,0,0,0,1,0|3,0,0]=4
13  B7R0.4  C\C=C\C=C\C(=O)O YMDB01784 [0,1,1,0,0,0|1,0,0]=3
14  B7R0.6  O=C(O)\C=C\C(=O)O YMDB00101 [0,1,1,0,0,0|2,0,0]=4
15  B7R1.1  CCC1=CC=CO1 YMDB01437 [0,1,0,0,1,0|2,0,0]=4
16  B7R1.1  CSC1=CSC=C1 YMDB01449 [0,1,0,0,1,0|1,1,0]=4
17  B7R1.1  O=CC1=CC=CO1 YMDB01459 [0,1,0,0,1,0|1,0,1]=4
18  B7R1.1  OCC1=CC=CS1 YMDB01447 [0,1,0,0,1,0|1,0,0]=3
19  B7R1.1  SCC1=CC=CO1 YMDB01433 [0,1,0,0,1,0|1,1,0]=4
20  B7R1.4  CC1=C(S)C=CO1 YMDB01443 [0,1,0,0,1,0|1,1,0]=4
21  B7R1.4  CC1=C(S)C=CS1 YMDB01502 [0,1,0,0,1,0|1,1,0]=4
22  B9R1.1  C=CC1=CC=C(O)C=C1 YMDB01627 [0,2,0,0,0,0|0,0,0]=2
23  B9R1.1  CCC1=CC=C(O)C=C1 YMDB01617 [0,2,0,0,0,0|0,0,0]=2
24  B9R1.6  CC(=O)C1=CC=CC=C1 YMDB01629 [0,2,0,0,0,0|0,0,1]=3
25  B9R1.6  NC(=O)C1=CC=CN=C1 YMDB00274 [0,2,0,0,0,0|1,0,1]=4
26  B9R1.6  O=C(O)C1=CC=CC=C1 YMDB02301 [0,2,0,0,0,0|0,0,0]=2
27  B9R1.6  O=C(O)C1=CN=CC=C1 YMDB00224 [0,2,0,0,0,0|1,0,0]=3
28  B9R1.8  NCCC1=CC=CC=C1 YMDB01558 [0,2,0,0,0,0|1,0,0]=3
29  B9R1.8  O=CCC1=CC=CC=C1 YMDB00116 [0,2,0,0,0,0|0,0,1]=3
30  B9R1.8  OCCC1=CC=CC=C1 YMDB01072 [0,2,0,0,0,0|0,0,0]=2
31  B9R1.15  COC1=CC=CC=C1O YMDB01430 [0,2,0,0,0,0|0,0,0]=2
32  B9R1.3  CC1=C(O)C(=O)C=CO1 YMDB01601 [0,2,0,0,0,0|1,0,0]=3
33  B5R1.1  C1=CSC=C1 YMDB01792 [1,0,0,0,1,0|1,0,0]=3