0  B10R1.1  OCCC1=CC=C(F)C=C1 DB03669 [0,0,0,0,0,0|3,0,0]=3
1  B9R1.1  O=CC1=CC=C(O)C=C1 DB03560 [1,0,0,0,0,0|1,0,1]=3
2  B9R1.1  OCC1=CC=C(Br)C=C1 DB02822 [1,0,0,0,0,0|2,0,0]=3
3  B9R1.1  [NH3+]CC1=CC=C(F)C=C1 DB03243 [1,0,0,0,0,0|2,0,0]=3
4  B9R1.8  NCCC1=CC=CC=C1 DB04325 [1,0,0,0,0,0|2,0,0]=3
5  B9R1.8  O=CCC1=CC=CC=C1 DB02178 [1,0,0,0,0,0|2,0,1]=4
6  B9R1.8  OCCC1=CC=CC=C1 DB02192 [1,0,0,0,0,0|2,0,0]=3
7  B11R1.1  OCCOC1=CC=C(Cl)C=C1 DB11368 [0,1,0,0,0,0|1,0,0]=2
8  B11R1.22  N#C[C@@H](O)C1=CC=C(O)C=C1 DB03430 [0,1,0,0,0,0|2,0,1]=4
9  B8R1.2  NCC1=CC=CC=C1 DB02464 [2,0,0,0,0,0|1,0,0]=3
10  B8R1.2  OCC1=CC=CN=C1 DB04145 [2,0,0,0,0,0|2,0,0]=4
11  B8R1.2  SCC1=CC=CN=C1 DB04490 [2,0,0,0,0,0|2,0,0]=4
12  B8R1.3  CC1=CC=C(O)C=C1 DB01688 [2,0,0,0,0,0|0,0,0]=2
13  B8R1.3  NC1=CC=C(N)C=C1 DB14141 [2,0,0,0,0,0|2,0,0]=4
14  B8R1.3  NC1=CC=C(O)C=C1 DB14144 [2,0,0,0,0,0|1,0,0]=3
15  B8R1.3  OC1=CC=C(I)C=C1 DB03002 [2,0,0,0,0,0|1,0,0]=3
16  B10R1.13  CC(C)C1=CC=C(N)C=C1 DB02114 [1,1,0,0,0,0|1,0,0]=3
17  B10R1.13  O=C(O)C1=CC=C(O)C=C1 DB04242 [1,1,0,0,0,0|1,0,1]=4
18  B10R1.13  O=[N+]([O-])C1=CC=C(O)C=C1 DB04417 [1,1,0,0,0,0|2,0,0]=4
19  B10R1.25  OCC1=CC=C(F)C=C1F DB04448 [1,1,0,0,0,0|2,0,0]=4
20  B10R1.176  O=C1C=C(CO)OC=C1O DB01759 [1,1,0,0,0,0|2,0,0]=4
21  B10R1.4  CCCC1=CC=CC=C1N DB02970 [1,1,0,0,0,0|1,0,0]=3
22  B10R1.17  C=CCNC1=CC=CC=C1 DB02870 [1,1,0,0,0,0|1,0,1]=4
23  B10R1.17  NCCCC1=CC=CC=C1 DB04410 [1,1,0,0,0,0|1,0,0]=3
24  B10R1.17  O=COCC1=CC=CC=C1 DB04569 [1,1,0,0,0,0|1,0,1]=4
25  B10R1.17  OC\C=C\C1=CC=CC=C1 DB14186 [1,1,0,0,0,0|1,0,1]=4
26  B12R1.16  CNCC(O)C1=CC=C(O)C=C1 DB09203 [0,2,0,0,0,0|1,0,0]=3
27  B12R1.21  O=C(O)CCC1=CC=C(O)C=C1 DB03897 [0,2,0,0,0,0|1,0,1]=4
28  B12R1.49  [C@@H](N)(C=O)CC1=CC=C(O)C=C1 DB03978 [0,2,0,0,0,0|1,0,1]=4
29  B12R1.385  CNCCC1=CC(O)=C(O)C=C1 DB13917 [0,2,0,0,0,0|1,0,0]=3
30  B12R1.4  COC1=CC=C(CC(C)N)C=C1 DB01472 [0,2,0,0,0,0|1,0,0]=3
31  B12R1.286  CCC1=CC(CCN)=CC=C1O DB07346 [0,2,0,0,0,0|2,0,0]=4
32  B12R1.286  C\C=C\C1=CC=C(O)C(OC)=C1 DB14188 [0,2,0,0,0,0|1,0,1]=4
33  B10R2.6  C1=CC=C([C@@H]2CO2)C=C1 DB04499 [1,0,0,1,0,0|2,0,0]=4
34  B10R2.7  C1=CC2=C(C=C1)OC=C2 DB04179 [1,0,0,1,0,0|0,0,2]=4
35  B12R2.24  IC1=CC2=C(C=C1)CCNC2 DB03824 [0,1,0,1,0,0|2,0,0]=4