0  B4R0.3  C[SH+](C)(C)O S311383 [0,0,0,0,0,0|3,0,1]=4
1  B4R0.3  NS(=O)(=O)[O-] S828300 [0,0,0,0,0,0|1,0,1]=2
2  B4R0.3  O=S(=O)(O)O R278998 [0,0,0,0,0,0|0,0,0]=0
3  B4R0.3  O=S(=O)([O-])[O-] CDS004010 [0,0,0,0,0,0|0,0,2]=2
4  B4R0.3  O=S(=O)([O-])[O-] S461083 [0,0,0,0,0,0|0,0,2]=2
5  B4R0.3  O=S(=O)([O-])[O-] S461768 [0,0,0,0,0,0|0,0,2]=2
6  B4R0.3  O=[Cr](=O)([O-])[O-] CDS001277 [0,0,0,0,0,0|1,0,2]=3
7  B3R0.2  BC(=O)O R277436 [1,0,0,0,0,0|2,0,0]=3
8  B3R0.2  CC(=O)O R252506 [1,0,0,0,0,0|2,0,0]=3
9  B3R0.2  CC(=O)O R252999 [1,0,0,0,0,0|2,0,0]=3
10  B3R0.2  CS(=O)[O-] S946621 [1,0,0,0,0,0|1,0,2]=4
11  B3R0.2  O=[N+]([O-])[O-] CDS001582 [1,0,0,0,0,0|1,0,2]=4
12  B5R0.4  CCS(=O)(=O)[S-] S47822 [0,1,0,0,0,0|1,1,0]=3
13  B5R0.4  CNP(=S)(O)O PH013342 [0,1,0,0,0,0|2,1,0]=4
14  B5R0.4  CNS(=O)(=O)Cl CDS007250 [0,1,0,0,0,0|2,0,0]=3
15  B5R0.4  O=S(=O)([O-])CBr S613940 [0,1,0,0,0,0|1,0,1]=3
16  B4R0.1  C(=O)C(=O)[O-] S573140 [1,1,0,0,0,0|1,0,1]=4
17  B4R0.1  CCB(O)O CDS003542 [1,1,0,0,0,0|2,0,0]=4
18  B4R0.1  O=C(O)CS CDS000504 [1,1,0,0,0,0|1,1,0]=4
19  B4R0.1  O=C([O-])CO CDS000626 [1,1,0,0,0,0|1,0,1]=4
20  B4R0.1  O=S(O)O[TlH2] S826111 [1,1,0,0,0,0|0,0,1]=3
21  B6R0.5  C=CCS(=O)(=O)Cl CDS002116 [0,2,0,0,0,0|2,0,0]=4
22  B6R0.5  C=CCS(=O)(=O)O PH008546 [0,2,0,0,0,0|1,0,0]=3
23  B6R0.5  C=CCS(=O)(=O)[O-] CDS010541 [0,2,0,0,0,0|1,0,1]=4
24  B6R0.5  CCCS(=O)(=O)[S-] S47857 [0,2,0,0,0,0|1,1,0]=4
25  B6R0.5  CCNS(=O)(=O)Cl CDS007313 [0,2,0,0,0,0|2,0,0]=4
26  B6R0.5  CCNS(=O)(=O)[O-] R464244 [0,2,0,0,0,0|1,0,1]=4
27  B6R0.5  CS(=O)(=O)CCN CDS005167 [0,2,0,0,0,0|2,0,0]=4
28  B6R0.5  O=S(=O)(Cl)CCBr PH016099 [0,2,0,0,0,0|2,0,0]=4
29  B6R0.5  O=S(=O)([O-])CCO CDS003508 [0,2,0,0,0,0|0,0,1]=3
30  B6R0.7  CC(N)P(=O)(O)O R425923 [0,2,0,0,0,0|2,0,0]=4
31  B6R0.7  CN(C)S(=O)(=O)C S616672 [0,2,0,0,0,0|2,0,0]=4
32  B6R0.8  COP(=O)(O)OC CDS014665 [0,2,0,0,0,0|1,0,1]=4
33  B6R0.8  O=P(O)(CO)CO S406821 [0,2,0,0,0,0|1,0,1]=4
34  B6R1.10  O=S1(=O)CCC1 S620734 [0,1,0,1,0,0|2,0,0]=4