0  B7R1.4  CC1=[NH+]C=CN1C DB03789 [0,0,0,0,0,0|3,0,0]=3
1  B6R1.2  CC1=CN=CN1 DB03385 [1,0,0,0,0,0|2,0,0]=3
2  B6R1.2  CC1=CNC=C1 DB01932 [1,0,0,0,0,0|1,0,0]=2
3  B6R1.2  CN1C=C[NH+]=C1 DB02671 [1,0,0,0,0,0|2,0,0]=3
4  B6R1.2  IC1=CNN=C1 DB02721 [1,0,0,0,0,0|3,0,0]=4
5  B8R1.4  CC1=CC=CC(O)=C1 DB01776 [0,0,0,0,0,1|2,0,0]=3
6  B8R1.4  NC1=CN=CC(Cl)=N1 DB02297 [0,0,0,0,0,1|3,0,0]=4
7  B8R1.4  OC1=CC=CC(Cl)=C1 DB01957 [0,0,0,0,0,1|3,0,0]=4
8  B8R1.5  ClC1=C(Cl)C=CC=C1 DB13963 [0,0,0,0,0,1|3,0,0]=4
9  B8R1.5  NC1=CC=CC=C1F DB02403 [0,0,0,0,0,1|3,0,0]=4
10  B8R1.5  NC1=CC=CC=C1O DB01726 [0,0,0,0,0,1|3,0,0]=4
11  B8R1.5  OC1=CC=CC=C1Br DB04586 [0,0,0,0,0,1|3,0,0]=4
12  B8R1.5  OC1=CC=CC=C1Cl DB03110 [0,0,0,0,0,1|3,0,0]=4
13  B8R1.5  OC1=CC=CC=C1O DB02232 [0,0,0,0,0,1|3,0,0]=4
14  B5R1.1  C1=CNC=N1 DB03366 [2,0,0,0,0,0|2,0,0]=4
15  B5R1.1  C1=CNN=C1 DB02757 [2,0,0,0,0,0|2,0,0]=4
16  B5R1.1  C1=C[N-]C=N1 DB03840 [2,0,0,0,0,0|2,0,0]=4
17  B9R1.2  OCC1=CC=CC(I)=C1 DB03339 [0,1,0,0,0,1|2,0,0]=4
18  B9R1.3  C=C1C=CC=C(C)[C@@H]1N DB03842 [0,1,0,0,0,1|1,0,1]=4
19  B9R1.3  CC1=CC=CC(O)=C1O DB03454 [0,1,0,0,0,1|2,0,0]=4
20  B9R1.69  CC1=CC=C(C)C(N)=C1 DB02163 [0,1,0,0,0,1|2,0,0]=4
21  B9R1.69  CC1=CC=C(N)C=C1C DB03018 [0,1,0,0,0,1|2,0,0]=4
22  B9R1.69  CC1=CC=C(O)C(N)=C1 DB04533 [0,1,0,0,0,1|2,0,0]=4
23  B9R1.69  CC1=CC=C(O)C(O)=C1 DB04120 [0,1,0,0,0,1|2,0,0]=4
24  B9R1.69  CC1=CC=C(O)C=C1C DB04052 [0,1,0,0,0,1|2,0,0]=4
25  B9R1.15  NC1=CC=CC=C1CO DB03058 [0,1,0,0,0,1|2,0,0]=4
26  B9R1.15  SCC1=CC=CC=C1I DB03630 [0,1,0,0,0,1|2,0,0]=4
27  B7R1.3  CC1=CC=CN=C1 DB01996 [0,0,1,1,0,0|1,0,1]=4