0  B3R0.2  CB(O)O BB55-7799 [0,0,0,0,0,0|3,0,0]=3
1  B4R0.1  CC(=O)NN BB01-6190 [0,1,0,0,0,0|1,0,1]=3
2  B4R0.1  CC(O)C#N BB58-1312 [0,1,0,0,0,0|1,0,2]=4
3  B4R0.1  CCC(N)=S BB58-4261 [0,1,0,0,0,0|1,1,0]=3
4  B4R0.1  CNC(N)=S BB20-1194 [0,1,0,0,0,0|0,1,1]=3
5  B4R0.1  COC(=S)[S-] BB57-1615 [0,1,0,0,0,0|2,0,0]=3
6  B4R0.1  NC(=O)CO BB58-4485 [0,1,0,0,0,0|1,0,0]=2
7  B4R0.1  NC(=O)NO BB58-1684 [0,1,0,0,0,0|1,0,0]=2
8  B4R0.1  NCC(F)F BB05-2701 [0,1,0,0,0,0|2,0,1]=4
9  B4R0.3  NS(N)(=O)=O BB53-1266 [0,1,0,0,0,0|1,0,2]=4
10  B3R0.1  CN=C=S BB01-6154 [1,1,0,0,0,0|0,1,1]=4
11  B3R0.1  CNNC BB57-2004 [1,1,0,0,0,0|2,0,0]=4
12  B5R0.1  CCCC(=N)N BB01-7895 [0,2,0,0,0,0|1,0,0]=3
13  B5R0.1  CCNC(N)=S BB20-1166 [0,2,0,0,0,0|0,1,1]=4
14  B5R0.3  C#CC(=O)OC BB53-1265 [0,2,0,0,0,0|2,0,0]=4
15  B5R0.3  CCC(=O)NN BB55-2154 [0,2,0,0,0,0|1,0,1]=4
16  B5R0.3  CCC(O)CN BB58-0207 [0,2,0,0,0,0|1,0,1]=4
17  B5R0.3  CC\C(N)=N\O BB05-3255 [0,2,0,0,0,0|1,0,0]=3
18  B5R0.3  CNC(=N)NN BB58-5065 [0,2,0,0,0,0|1,0,0]=3
19  B5R0.3  CNC(=O)CCl BB20-1612 [0,2,0,0,0,0|1,0,1]=4
20  B5R0.3  CNC(=O)CN BB58-0122 [0,2,0,0,0,0|0,0,2]=4
21  B5R0.3  COC(=O)CN BB17-0807 [0,2,0,0,0,0|1,0,0]=3
22  B5R0.3  COC(=O)NN BB17-2415 [0,2,0,0,0,0|1,0,0]=3
23  B5R0.3  COC(=S)NN BB58-1099 [0,2,0,0,0,0|1,0,0]=3
24  B5R0.3  CSC(=N)NN BB57-6632 [0,2,0,0,0,0|0,1,0]=3
25  B5R0.5  CC(C)C(N)=O BB01-6147 [0,2,0,0,0,0|1,0,1]=4
26  B5R0.5  CC(C)C(N)=S BB01-7896 [0,2,0,0,0,0|1,1,0]=4
27  B5R0.5  CN(C)C(N)=S BB55-6887 [0,2,0,0,0,0|0,1,1]=4