0  B10R1.61  NC1=CC=CC=C1C(=O)O YMDB00278 [0,0,0,0,0,0|1,0,0]=1
1  B10R1.61  O=C(O)C1=CC=CC=C1O YMDB01322 [0,0,0,0,0,0|0,0,0]=0
2  B9R1.6  CC(=O)C1=CC=CC=C1 YMDB01629 [1,0,0,0,0,0|1,0,0]=2
3  B9R1.6  NC(=O)C1=CC=CN=C1 YMDB00274 [1,0,0,0,0,0|2,0,0]=3
4  B9R1.6  NC(=O)C1=NC=CN=C1 YMDB00976 [1,0,0,0,0,0|3,0,0]=4
5  B9R1.6  O=C(O)C1=CC=CC=C1 YMDB02301 [1,0,0,0,0,0|0,0,0]=1
6  B9R1.6  O=C(O)C1=CN=CC=C1 YMDB00224 [1,0,0,0,0,0|1,0,0]=2
7  B9R1.15  COC1=CC=CC=C1O YMDB01430 [1,0,0,0,0,0|2,0,0]=3
8  B11R1.159  NC1=C(O)C=CC=C1C(=O)O YMDB00254 [0,1,0,0,0,0|1,0,0]=2
9  B11R1.166  CC1=CC=C(C(=O)O)C(C)=C1 YMDB02315 [0,1,0,0,0,0|1,0,0]=2
10  B11R1.222  COC(=O)C1=CC=CC=C1O YMDB01370 [0,1,0,0,0,0|0,0,0]=1
11  B8R1.2  O=CC1=CC=CC=C1 YMDB01326 [2,0,0,0,0,0|0,0,0]=2
12  B8R1.2  OCC1=CC=CC=C1 YMDB01426 [2,0,0,0,0,0|0,0,1]=3
13  B8R1.5  CC1=CC=CC=C1O YMDB01457 [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|1,0,0]=3
15  B10R1.13  CC(O)C1=CC=C(O)C=C1 YMDB01404 [1,1,0,0,0,0|1,0,1]=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  B10R1.15  N#CC(O)C1=CC=CC=C1 YMDB01642 [1,1,0,0,0,0|1,0,1]=4
20  B10R1.113  C[N+]1=CC=CC(C(N)=O)=C1 YMDB00348 [1,1,0,0,0,0|2,0,0]=4
21  B10R1.4  OCCC1=CC=CC=C1O YMDB02314 [1,1,0,0,0,0|0,0,1]=3
22  B12R1.261  O=C(O)C1=CC=CN=C1C(=O)O YMDB00007 [0,2,0,0,0,0|1,0,0]=3
23  B12R1.283  O=CNC1=CC=CC=C1C(=O)O YMDB00811 [0,2,0,0,0,0|0,0,1]=3
24  B10R1.18  O=C(O)CC1=CC=CC=C1 YMDB00891 [0,0,1,1,0,0|1,0,1]=4
25  B10R1.54  O=C(O)\C=C1/C=CC(=O)O1 YMDB00159 [0,0,1,1,0,0|1,0,0]=3
26  B8R1.7  CC(=O)C1=CC=CS1 YMDB01431 [1,0,0,0,1,0|2,0,0]=4