0  B10R1.15  N#CC(O)C1=CC=CC=C1 YMDB01642 [0,0,0,0,0,0|2,0,2]=4
1  B9R1.6  CC(=O)C1=CC=CC=C1 YMDB01629 [1,0,0,0,0,0|0,0,0]=1
2  B9R1.6  NC(=O)C1=CC=CN=C1 YMDB00274 [1,0,0,0,0,0|2,0,0]=3
3  B9R1.6  NC(=O)C1=NC=CN=C1 YMDB00976 [1,0,0,0,0,0|3,0,0]=4
4  B9R1.6  O=C(O)C1=CC=CC=C1 YMDB02301 [1,0,0,0,0,0|0,0,0]=1
5  B9R1.6  O=C(O)C1=CN=CC=C1 YMDB00224 [1,0,0,0,0,0|1,0,0]=2
6  B9R1.8  C\C=C\C1=CN=CC=N1 YMDB01512 [1,0,0,0,0,0|3,0,0]=4
7  B9R1.8  NCCC1=CC=CC=C1 YMDB01558 [1,0,0,0,0,0|2,0,1]=4
8  B9R1.8  O=CCC1=CC=CC=C1 YMDB00116 [1,0,0,0,0,0|2,0,1]=4
9  B9R1.8  OCCC1=CC=CC=C1 YMDB01072 [1,0,0,0,0,0|2,0,1]=4
10  B11R1.12  CC=C(C=O)C1=CC=CC=C1 YMDB01440 [0,1,0,0,0,0|1,0,0]=2
11  B11R1.222  COC(=O)C1=CC=CC=C1O YMDB01370 [0,1,0,0,0,0|0,0,0]=1
12  B8R1.2  O=CC1=CC=CC=C1 YMDB01326 [2,0,0,0,0,0|0,0,0]=2
13  B8R1.2  OCC1=CC=CC=C1 YMDB01426 [2,0,0,0,0,0|0,0,1]=3
14  B10R1.13  CC(=O)C1=CC=C(C)C=C1 YMDB01619 [1,1,0,0,0,0|0,0,0]=2
15  B10R1.13  CC(O)C1=CC=C(O)C=C1 YMDB01404 [1,1,0,0,0,0|0,0,2]=4
16  B10R1.13  NC1=CC=C(C(=O)O)C=C1 YMDB00493 [1,1,0,0,0,0|0,0,0]=2
17  B10R1.13  O=C(O)C1=CC=C(O)C=C1 YMDB00495 [1,1,0,0,0,0|0,0,0]=2
18  B10R1.13  O=[N+]([O-])C1=CC=C(O)C=C1 YMDB00316 [1,1,0,0,0,0|1,0,1]=4
19  B10R1.61  NC1=CC=CC=C1C(=O)O YMDB00278 [1,1,0,0,0,0|0,0,0]=2
20  B10R1.61  O=C(O)C1=CC=CC=C1O YMDB01322 [1,1,0,0,0,0|0,0,0]=2
21  B10R1.113  C[N+]1=CC=CC(C(N)=O)=C1 YMDB00348 [1,1,0,0,0,0|2,0,0]=4
22  B10R1.17  O=C\C=C\C1=CC=CC=C1 YMDB01654 [1,1,0,0,0,0|1,0,1]=4
23  B10R1.18  CC(=O)OC1=CC=CC=C1 YMDB00838 [1,1,0,0,0,0|2,0,0]=4
24  B12R1.43  O=C(O)C(=O)CC1=CC=CC=C1 YMDB00786 [0,1,0,0,0,1|2,0,0]=4
25  B12R1.16  CCOC(=O)C1=CC=C(O)C=C1 YMDB01688 [0,2,0,0,0,0|0,0,0]=2
26  B12R1.107  CC(=O)OC(C)C1=CC=CC=C1 YMDB01472 [0,2,0,0,0,0|1,0,1]=4
27  B8R1.7  CC(=O)C1=CC=CS1 YMDB01431 [1,0,0,0,1,0|1,0,0]=3
28  B8R1.7  CC(=O)C1=NC=CS1 YMDB01581 [1,0,0,0,1,0|2,0,0]=4
29  B12R1.27  COC(=O)\C=C\C1=CC=CC=C1 YMDB01744 [0,0,0,0,0,2|0,0,0]=2