0  B3R0.1  C#CC=O BCP06452 [0,0,0,0,0,0|1,1,2]=4
1  B3R0.1  C=CC=O BCP07056 [0,0,0,0,0,0|1,1,2]=4
2  B3R0.1  CCCN BCP18818 [0,0,0,0,0,0|2,0,1]=3
3  B3R0.1  COCCl BCP08223 [0,0,0,0,0,0|2,0,1]=3
4  B3R0.1  NCCS BCP15015 [0,0,0,0,0,0|2,0,2]=4
5  B3R0.1  NCCS BCP15033 [0,0,0,0,0,0|2,0,2]=4
6  B3R0.1  [*]=[N+]=N[Na] BCP05568 [0,0,0,0,0,0|3,0,0]=3
7  B2R0.1  CC#N BCP16195 [1,0,0,0,0,0|1,0,1]=3
8  B2R0.1  CNC BCP26000 [1,0,0,0,0,0|0,0,2]=3
9  B2R0.1  CNN BCP07836 [1,0,0,0,0,0|1,0,1]=3
10  B2R0.1  CSC BCP12489 [1,0,0,0,0,0|1,0,1]=3
11  B2R0.1  Cl[Pt]Cl BCP01792 [1,0,0,0,0,0|3,0,0]=4
12  B2R0.1  Cl[Pt]Cl BCP18182 [1,0,0,0,0,0|3,0,0]=4
13  B2R0.1  Cl[Sr]Cl BCP28245 [1,0,0,0,0,0|3,0,0]=4
14  B2R0.1  FCBr BCP07051 [1,0,0,0,0,0|2,0,1]=4
15  B4R0.1  CC(C)[Mg]Cl BCP10965 [0,1,0,0,0,0|3,0,0]=4
16  B4R0.1  CC(CBr)=O BCP06577 [0,1,0,0,0,0|2,0,1]=4
17  B4R0.1  CC(Cl)C#N BCP10983 [0,1,0,0,0,0|2,0,1]=4
18  B4R0.1  CC(O)C#C BCP05896 [0,1,0,0,0,0|2,0,1]=4
19  B4R0.1  CC(O)CN BCP08083 [0,1,0,0,0,0|2,0,1]=4
20  B4R0.1  CN(C)NC BCP16365 [0,1,0,0,0,0|2,0,1]=4
21  B4R0.1  C[C@@H](O)C#C BCP15480 [0,1,0,0,0,0|2,0,1]=4
22  B4R0.1  C[C@@H](O)CC BCP06774 [0,1,0,0,0,0|1,1,1]=4
23  B4R0.1  C[C@H](N)CN BCP05857 [0,1,0,0,0,0|2,0,1]=4
24  B4R0.1  C[C](N)CO BCP13388 [0,1,0,0,0,0|1,1,1]=4
25  B4R0.2  C#CCCN BCP19829 [0,1,0,0,0,0|2,0,1]=4
26  B4R0.2  CC#CCBr BCP17711 [0,1,0,0,0,0|2,0,1]=4
27  B4R0.2  CC#CCO BCP07121 [0,1,0,0,0,0|1,1,1]=4
28  B4R0.2  CCN=C=S BCP05940 [0,1,0,0,0,0|0,0,0]=1
29  B4R0.2  CSCCN BCP16561 [0,1,0,0,0,0|2,0,1]=4
30  B4R0.2  ClCCCBr BCP16557 [0,1,0,0,0,0|2,0,1]=4
31  B4R0.2  NCCOC BCP15361 [0,1,0,0,0,0|2,0,1]=4
32  B4R0.2  NOCCO BCP11232 [0,1,0,0,0,0|3,0,0]=4
33  B1R0.1  BrC BCP14546 [2,0,0,0,0,0|1,0,0]=3
34  B1R0.1  C[*] BCP08894 [2,0,0,0,0,0|1,0,0]=3
35  B1R0.1  C[*] BCP10590 [2,0,0,0,0,0|1,0,0]=3
36  B1R0.1  NO BCP03655 [2,0,0,0,0,0|0,1,1]=4
37  B1R0.1  NO BCP29537 [2,0,0,0,0,0|0,1,1]=4
38  B1R0.1  [Al]#P BCP11872 [2,0,0,0,0,0|1,1,0]=4
39  B3R0.2  CB(O)O BCP10976 [1,1,0,0,0,0|1,1,0]=4
40  B3R0.2  CC(Br)Cl BCP14483 [1,1,0,0,0,0|1,0,1]=4
41  B3R0.2  CC(O)=O BCP05544 [1,1,0,0,0,0|0,1,1]=4
42  B3R0.2  NC(N)=N BCP04785 [1,1,0,0,0,0|1,0,1]=4
43  B3R0.2  [O-]C(=O)C BCP05504 [1,1,0,0,0,0|0,1,1]=4
44  B5R0.1  CC(C)N=C=O BCP15287 [0,2,0,0,0,0|0,1,0]=3
45  B5R0.1  [S-]C(OCC)=S BCP29024 [0,2,0,0,0,0|1,0,1]=4