0  B3R0.1  CNNC 16369 [0,0,0,0,0,0|3,0,0]=3
1  B3R0.1  NCCN 21369 [0,0,0,0,0,0|2,0,0]=2
2  B3R0.1  NCCN 21544 [0,0,0,0,0,0|2,0,0]=2
3  B3R0.1  NCCS 21729 [0,0,0,0,0,0|1,0,0]=1
4  B3R0.1  OCCF 9966 [0,0,0,0,0,0|1,1,0]=2
5  B3R0.1  [S-]SS[S-] 19336 [0,0,0,0,0,0|3,0,1]=4
6  B3R0.1  [S-]SS[S-] 19339 [0,0,0,0,0,0|3,0,1]=4
7  B2R0.1  Cl[Pd]Cl 21411 [1,0,0,0,0,0|3,0,0]=4
8  B2R0.1  N#C[S-] 22075 [1,0,0,0,0,0|1,0,2]=4
9  B2R0.1  [Na]S[Na] 19338 [1,0,0,0,0,0|3,0,0]=4
10  B4R0.1  C=C(F)CBr 100838 [0,1,0,0,0,0|1,0,2]=4
11  B4R0.1  C=C(F)CO 100837 [0,1,0,0,0,0|0,1,2]=4
12  B4R0.1  CC(F)CO 9967 [0,1,0,0,0,0|0,1,0]=2
13  B4R0.1  NCC(=O)O 21671 [0,1,0,0,0,0|1,1,1]=4
14  B4R0.2  C\C=C/CO 102650 [0,1,0,0,0,0|0,1,1]=3
15  B4R0.2  NCCCN 21368 [0,1,0,0,0,0|1,0,0]=2
16  B4R0.2  NCCCN 21721 [0,1,0,0,0,0|1,0,0]=2
17  B4R0.2  NCCCN 21741 [0,1,0,0,0,0|1,0,0]=2
18  B4R0.2  NCCCN 22243 [0,1,0,0,0,0|1,0,0]=2
19  B4R0.2  OC\C=C/I 103154 [0,1,0,0,0,0|0,1,2]=4
20  B4R0.2  OC\C=C\I 103137 [0,1,0,0,0,0|0,1,2]=4
21  B1R0.1  [S-][S-] 19337 [2,0,0,0,0,0|1,0,1]=4
22  B5R0.1  CC(F)CCO 9969 [0,2,0,0,0,0|0,1,0]=3
23  B5R0.1  C\C(Br)=C/CO 103149 [0,2,0,0,0,0|0,1,1]=4
24  B5R0.1  C\C(I)=C\CO 103135 [0,2,0,0,0,0|0,1,1]=4
25  B5R0.3  C\C=C(/F)CBr 100835 [0,2,0,0,0,0|1,0,1]=4
26  B5R0.3  C\C=C(/F)CO 100834 [0,2,0,0,0,0|0,1,1]=4
27  B5R0.3  OC(CF)CF 9971 [0,2,0,0,0,0|1,0,0]=3
28  B5R0.3  OCC(Cl)CF 9968 [0,2,0,0,0,0|0,1,0]=3
29  B5R0.4  CC(C)(C)N=O 15082 [0,2,0,0,0,0|1,1,0]=4
30  B5R0.4  CC(C)(C)OCl 102264 [0,2,0,0,0,0|2,0,0]=4
31  B5R0.4  CCC(C)(F)F 9976 [0,2,0,0,0,0|1,0,0]=3
32  B5R0.2  C#CCCCO 102448 [0,2,0,0,0,0|0,1,0]=3