0  B7R1.1  CCC1=CC=CO1 YMDB01437 [0,0,0,0,0,0|1,0,1]=2
1  B7R1.1  CCC1=NC=CS1 YMDB01505 [0,0,0,0,0,0|2,1,1]=4
2  B7R1.1  CSC1=CSC=C1 YMDB01449 [0,0,0,0,0,0|4,0,0]=4
3  B7R1.1  O=CC1=CC=CO1 YMDB01459 [0,0,0,0,0,0|0,0,0]=0
4  B7R1.1  OCC1=CC=CS1 YMDB01447 [0,0,0,0,0,0|0,1,2]=3
5  B7R1.1  SCC1=CC=CO1 YMDB01433 [0,0,0,0,0,0|0,1,1]=2
6  B6R1.2  CC1=CC=CS1 YMDB01462 [1,0,0,0,0,0|0,1,1]=3
7  B6R1.2  CC1=CSC=N1 YMDB01620 [1,0,0,0,0,0|2,0,1]=4
8  B6R1.2  O=C1CCCO1 YMDB01418 [1,0,0,0,0,0|0,0,3]=4
9  B8R1.1  CC1=CC=C(C=O)O1 YMDB01435 [0,1,0,0,0,0|0,0,0]=1
10  B8R1.1  CC1=CC=C(C=O)S1 YMDB01445 [0,1,0,0,0,0|0,1,0]=2
11  B8R1.1  CC1=CC=C(CS)O1 YMDB01503 [0,1,0,0,0,0|0,1,1]=3
12  B8R1.7  CC(=O)C1=CC=CS1 YMDB01431 [0,1,0,0,0,0|0,1,0]=2
13  B8R1.7  CC(=O)C1=NC=CS1 YMDB01581 [0,1,0,0,0,0|1,1,0]=3
14  B8R1.8  SCCC1=CC=CO1 YMDB01460 [0,1,0,0,0,0|0,1,1]=3
15  B8R1.11  CCC1=C(C)N=CO1 YMDB01498 [0,1,0,0,0,0|2,0,1]=4
16  B6R0.6  CCC\C=C/C=O YMDB01655 [0,0,1,0,0,0|1,0,2]=4
17  B6R0.6  C\C=C\C=C\CO YMDB01707 [0,0,1,0,0,0|1,0,1]=3
18  B8R1.2  O=CC1=CC=CC=C1 YMDB01326 [0,0,0,0,0,1|1,0,0]=2
19  B8R1.2  OCC1=CC=CC=C1 YMDB01426 [0,0,0,0,0,1|1,0,2]=4
20  B5R1.1  C1=CSC=C1 YMDB01792 [2,0,0,0,0,0|0,1,0]=3
21  B7R0.4  C\C=C\C=C\C(=O)O YMDB01784 [0,1,1,0,0,0|1,0,0]=3
22  B7R1.4  CC1=C(S)C=CO1 YMDB01443 [1,1,0,0,0,0|0,0,1]=3
23  B7R1.4  CC1=C(S)C=CS1 YMDB01502 [1,1,0,0,0,0|0,1,1]=4
24  B9R1.1  C=CC1=CC=C(O)C=C1 YMDB01627 [0,1,0,0,0,1|2,0,0]=4
25  B9R1.6  CC(=O)C1=CC=CC=C1 YMDB01629 [0,1,0,0,0,1|1,0,0]=3
26  B9R1.6  NC(=O)C1=CC=CN=C1 YMDB00274 [0,1,0,0,0,1|1,0,0]=3
27  B9R1.6  NC(=O)C1=NC=CN=C1 YMDB00976 [0,1,0,0,0,1|1,0,0]=3
28  B9R1.6  O=C(O)C1=CC=CC=C1 YMDB02301 [0,1,0,0,0,1|1,0,0]=3
29  B9R1.6  O=C(O)C1=CN=CC=C1 YMDB00224 [0,1,0,0,0,1|1,0,0]=3
30  B9R1.8  C\C=C\C1=CN=CC=N1 YMDB01512 [0,1,0,0,0,1|2,0,0]=4
31  B9R1.8  O=CCC1=CC=CC=C1 YMDB00116 [0,1,0,0,0,1|1,0,0]=3
32  B9R1.35  O=C(O)C1=CC=C(O)O1 YMDB02319 [0,2,0,0,0,0|0,0,0]=2
33  B9R1.13  CC(=O)CC1=CC=CO1 YMDB01695 [0,2,0,0,0,0|0,0,0]=2