0  B8R1.2  BrCC1=CN=CC=C1 4090400 [0,0,0,1,0,0|2,0,1]=4
1  B8R1.2  NCC1=CCCCC1 4089848 [0,0,0,1,0,0|1,0,2]=4
2  B8R1.8  NCCC1=CC=CO1 4087953 [0,0,0,1,0,0|1,0,2]=4
3  B8R1.8  OCCC1=CC=CO1 4039978 [0,0,0,1,0,0|1,0,2]=4
4  B8R1.11  CC1=C(CN)SC=C1 4088805 [0,0,0,1,0,0|2,0,1]=4
5  B8R1.11  CC1=C(CO)N=CS1 4091170 [0,0,0,1,0,0|2,0,1]=4
6  B8R1.11  CN1C=CN=C1CN 4090095 [0,0,0,1,0,0|3,0,0]=4
7  B8R1.11  CN1C=NC=C1CCl 4088903 [0,0,0,1,0,0|3,0,0]=4
8  B8R1.11  CN1N=CC=C1CCl 4089161 [0,0,0,1,0,0|3,0,0]=4
9  B7R1.1  C#CC1=CC=CO1 4045318 [1,0,0,1,0,0|0,0,2]=4
10  B7R1.1  C1=NC=C(CO)S1 4050354 [1,0,0,1,0,0|2,0,0]=4
11  B7R1.1  CCC1C=CCN1 4090190 [1,0,0,1,0,0|1,0,1]=4
12  B7R1.1  CCN1C=CC=N1 3020409 [1,0,0,1,0,0|2,0,0]=4
13  B7R1.3  NC1C=CCCC1 4075151 [1,0,0,1,0,0|1,0,1]=4
14  B7R1.3  NC1CC=CCC1 4110793 [1,0,0,1,0,0|1,0,1]=4
15  B7R1.24  C1=CCCNCC1 4110732 [1,0,0,1,0,0|1,0,1]=4
16  B9R1.2  CCC1=CC=NC(O)=N1 4043209 [0,1,0,1,0,0|1,0,1]=4
17  B9R1.2  OCC1=NC=CC(Cl)=C1 4088987 [0,1,0,1,0,0|1,0,1]=4
18  B9R1.8  NCCC1=NC=CC=C1 3020070 [0,1,0,1,0,0|1,0,1]=4
19  B9R1.15  CC1=C(CCl)C=CN=C1 4010334 [0,1,0,1,0,0|1,0,1]=4
20  B9R1.15  CC1=C(CCl)N=CC=C1 4088897 [0,1,0,1,0,0|1,0,1]=4
21  B9R1.15  CC1=C(CN)C=CN=C1 4088420 [0,1,0,1,0,0|1,0,1]=4
22  B9R1.15  CC1=NC=CC=C1CCl 4088270 [0,1,0,1,0,0|1,0,1]=4
23  B9R1.15  CCC1=CC=CN=C1Cl 4037222 [0,1,0,1,0,0|1,0,1]=4
24  B9R1.14  CCN1C=CN=C1CCl 4089564 [0,1,0,1,0,0|2,0,0]=4
25  B9R1.14  CCN1C=CN=C1CN 4004956 [0,1,0,1,0,0|2,0,0]=4
26  B9R1.11  CCC(=O)C1=CC=CS1 3020389 [0,1,0,1,0,0|0,1,1]=4
27  B9R1.21  CCC1=NC(CCl)=CS1 4088461 [0,1,0,1,0,0|2,0,0]=4
28  B9R1.21  CCC1=NC(CN)=CS1 4089874 [0,1,0,1,0,0|2,0,0]=4
29  B9R1.21  CCC1=NC(CO)=CS1 4090454 [0,1,0,1,0,0|1,0,0]=3
30  B9R1.21  CCN1C=CC(CCl)=N1 4090802 [0,1,0,1,0,0|2,0,0]=4
31  B9R1.132  CC1=C(C)C(CO)=CS1 4027732 [0,1,0,1,0,0|1,0,1]=4
32  B9R1.6  CC(N)C1=CN=CC=C1 3002415 [0,1,0,1,0,0|2,0,0]=4
33  B9R1.6  CC(N)C1=NC=CC=C1 3001612 [0,1,0,1,0,0|1,0,1]=4
34  B9R1.41  CN1C=CC=C1C(=O)O 3020106 [0,1,0,1,0,0|1,0,1]=4