0  B2R0.1  Cl[Cu]Cl CDS007432 [0,0,0,0,0,0|3,0,0]=3
1  B3R0.1  C=CCN CDS000416 [0,1,0,0,0,0|3,0,0]=4
2  B3R0.1  C=C[Hg]Cl S881899 [0,1,0,0,0,0|3,0,0]=4
3  B3R0.1  CCCC S124796 [0,1,0,0,0,0|3,0,0]=4
4  B3R0.1  CCNC CDS013740 [0,1,0,0,0,0|2,0,1]=4
5  B3R0.1  CC[Hg]Cl S659541 [0,1,0,0,0,0|3,0,0]=4
6  B3R0.1  N#CCN R288616 [0,1,0,0,0,0|3,0,0]=4
7  B3R0.1  NCCN S573019 [0,1,0,0,0,0|3,0,0]=4
8  B3R0.1  [O-]CC[O-] R647071 [0,1,0,0,0,0|1,0,2]=4
9  B3R0.2  BC(=O)O R277436 [0,1,0,0,0,0|1,0,0]=2
10  B3R0.2  CC(=O)O R252506 [0,1,0,0,0,0|1,0,0]=2
11  B3R0.2  CC(=O)O R252999 [0,1,0,0,0,0|1,0,0]=2
12  B3R0.2  CC(C)N CDS000378 [0,1,0,0,0,0|3,0,0]=4
13  B3R0.2  CN(C)C S434639 [0,1,0,0,0,0|2,0,1]=4
14  B3R0.2  CS(=O)[O-] S946621 [0,1,0,0,0,0|1,0,1]=3
15  B3R0.2  O=[N+]([O-])[O-] CDS001582 [0,1,0,0,0,0|0,0,2]=3
16  B4R0.1  C(=O)C(=O)[O-] S573140 [0,2,0,0,0,0|1,0,1]=4
17  B4R0.1  CC(=O)CN CDS020585 [0,2,0,0,0,0|2,0,0]=4
18  B4R0.1  CCB(O)O CDS003542 [0,2,0,0,0,0|1,0,1]=4
19  B4R0.1  CCC(=O)[O-] CDS000543 [0,2,0,0,0,0|1,0,1]=4
20  B4R0.1  CNC(=O)Cl CDS009330 [0,2,0,0,0,0|1,0,1]=4
21  B4R0.1  CSC(=O)C CDS001513 [0,2,0,0,0,0|1,1,0]=4
22  B4R0.1  O=C(O)CS CDS000504 [0,2,0,0,0,0|1,0,0]=3
23  B4R0.1  O=C([O-])CO CDS000626 [0,2,0,0,0,0|1,0,0]=3
24  B4R0.1  O=S(O)O[TlH2] S826111 [0,2,0,0,0,0|1,0,0]=3
25  B4R0.2  C#CCON SYX00221 [0,2,0,0,0,0|2,0,0]=4
26  B4R0.2  OC/C=C/Br S880973 [0,2,0,0,0,0|2,0,0]=4
27  B4R0.2  OCCCF CDS002969 [0,2,0,0,0,0|2,0,0]=4
28  B4R0.2  OCNCCl R464872 [0,2,0,0,0,0|1,0,1]=4
29  B4R0.3  C[SH+](C)(C)O S311383 [0,2,0,0,0,0|2,0,0]=4
30  B4R0.3  NS(=O)(=O)[O-] S828300 [0,2,0,0,0,0|1,0,1]=4
31  B4R0.3  O=S(=O)(O)O R278998 [0,2,0,0,0,0|1,0,0]=3
32  B4R0.3  O=S(=O)([O-])[O-] CDS004010 [0,2,0,0,0,0|1,0,1]=4
33  B4R0.3  O=S(=O)([O-])[O-] S461083 [0,2,0,0,0,0|1,0,1]=4
34  B4R0.3  O=S(=O)([O-])[O-] S461768 [0,2,0,0,0,0|1,0,1]=4
35  B4R0.3  O=[Cr](=O)([O-])[O-] CDS001277 [0,2,0,0,0,0|1,0,1]=4