0  B7R1.3  CC1=CC=CN=C1 DB01996 [0,1,0,0,0,0|0,0,0]=1
1  B7R1.3  IC1=CC=CC=C1 DB02252 [0,1,0,0,0,0|1,0,0]=2
2  B7R1.3  NC1=CC=CC=C1 DB06728 [0,1,0,0,0,0|1,0,0]=2
3  B7R1.3  OC1=CC=CC=C1 DB03255 [0,1,0,0,0,0|1,0,0]=2
4  B7R1.3  SC1=CC=CC=N1 DB03329 [0,1,0,0,0,0|0,0,0]=1
5  B5R1.1  C1=CNC=N1 DB03366 [0,0,0,0,1,0|1,0,0]=2
6  B5R1.1  C1=CNN=C1 DB02757 [0,0,0,0,1,0|1,0,0]=2
7  B5R1.1  C1=C[N-]C=N1 DB03840 [0,0,0,0,1,0|1,0,0]=2
8  B5R1.1  C1=NC=NN1 DB03594 [0,0,0,0,1,0|2,0,0]=3
9  B4R0.2  C\C=C\C=O DB04381 [1,0,1,0,0,0|1,0,1]=4
10  B6R1.2  CC1=CN=CN1 DB03385 [0,1,0,0,1,0|1,0,0]=3
11  B6R1.2  CC1=CNC=C1 DB01932 [0,1,0,0,1,0|0,0,1]=3
12  B6R1.2  CN1C=C[NH+]=C1 DB02671 [0,1,0,0,1,0|1,0,1]=4
13  B6R1.2  IC1=CNN=C1 DB02721 [0,1,0,0,1,0|1,0,0]=3
14  B8R1.2  NCC1=CC=CC=C1 DB02464 [0,2,0,0,0,0|1,0,0]=3
15  B8R1.2  OCC1=CC=CN=C1 DB04145 [0,2,0,0,0,0|0,0,0]=2
16  B8R1.2  SCC1=CC=CN=C1 DB04490 [0,2,0,0,0,0|0,0,0]=2
17  B8R1.3  CC1=CC=C(O)C=C1 DB01688 [0,2,0,0,0,0|1,0,0]=3
18  B8R1.3  NC1=CC=C(N)C=C1 DB14141 [0,2,0,0,0,0|1,0,0]=3
19  B8R1.3  NC1=CC=C(O)C=C1 DB14144 [0,2,0,0,0,0|1,0,0]=3
20  B8R1.3  OC1=CC=C(I)C=C1 DB03002 [0,2,0,0,0,0|1,0,0]=3
21  B8R1.4  CC1=CC=CC(O)=C1 DB01776 [0,2,0,0,0,0|1,0,0]=3
22  B8R1.4  NC1=CN=CC(Cl)=N1 DB02297 [0,2,0,0,0,0|1,0,0]=3
23  B8R1.4  O=C1C=CNC(=O)N1 DB03419 [0,2,0,0,0,0|1,0,1]=4
24  B8R1.4  OC1=CC=CC(Cl)=C1 DB01957 [0,2,0,0,0,0|1,0,0]=3
25  B8R1.4  [C@H]1(O)C=CN=C(O)N1 DB03939 [0,2,0,0,0,0|1,0,1]=4
26  B8R1.5  ClC1=C(Cl)C=CC=C1 DB13963 [0,2,0,0,0,0|1,0,0]=3
27  B8R1.5  NC1=CC=CC=C1F DB02403 [0,2,0,0,0,0|1,0,0]=3
28  B8R1.5  NC1=CC=CC=C1O DB01726 [0,2,0,0,0,0|1,0,0]=3
29  B8R1.5  OC1=CC=CC=C1Br DB04586 [0,2,0,0,0,0|1,0,0]=3
30  B8R1.5  OC1=CC=CC=C1Cl DB03110 [0,2,0,0,0,0|1,0,0]=3
31  B8R1.5  OC1=CC=CC=C1O DB02232 [0,2,0,0,0,0|1,0,0]=3