0  B3R0.1  NCCS DB00847 [0,0,0,0,0,0|1,0,0]=1
1  B2R0.1  CCO DB00898 [1,0,0,0,0,0|0,1,0]=2
2  B2R0.1  Cl[223Ra]Cl DB08913 [1,0,0,0,0,0|3,0,0]=4
3  B2R0.1  Cl[Cu]Cl DB09131 [1,0,0,0,0,0|3,0,0]=4
4  B2R0.1  F[Sn]F DB11092 [1,0,0,0,0,0|3,0,0]=4
5  B2R0.1  O=C=O DB09157 [1,0,0,0,0,0|1,1,1]=4
6  B2R0.1  O=[Ti]=O DB09536 [1,0,0,0,0,0|2,1,0]=4
7  B2R0.1  S=[Se]=S DB00971 [1,0,0,0,0,0|2,0,1]=4
8  B2R0.1  [O-]N=O DB09112 [1,0,0,0,0,0|2,1,0]=4
9  B2R0.1  [O-][N+]#N DB06690 [1,0,0,0,0,0|2,1,0]=4
10  B4R0.1  CC(=O)NO DB00551 [0,1,0,0,0,0|1,1,1]=4
11  B4R0.1  CC(O)CO DB01839 [0,1,0,0,0,0|0,1,0]=2
12  B4R0.1  NCC(O)=O DB00145 [0,1,0,0,0,0|1,1,1]=4
13  B4R0.1  OCC(O)=O DB03085 [0,1,0,0,0,0|1,1,1]=4
14  B1R0.1  II DB05382 [2,0,0,0,0,0|2,0,0]=4
15  B1R0.1  N#N DB09152 [2,0,0,0,0,0|2,0,0]=4
16  B1R0.1  O=O DB09140 [2,0,0,0,0,0|1,1,0]=4
17  B1R0.1  O=[Mg] DB01377 [2,0,0,0,0,0|1,1,0]=4
18  B1R0.1  O=[Zn] DB09321 [2,0,0,0,0,0|1,1,0]=4
19  B1R0.1  OO DB11091 [2,0,0,0,0,0|1,1,0]=4
20  B1R0.1  [N]=O DB00435 [2,0,0,0,0,0|1,1,0]=4
21  B3R0.2  CC(C)O DB02325 [1,1,0,0,0,0|0,0,0]=2
22  B3R0.2  CC(O)=O DB03166 [1,1,0,0,0,0|0,1,1]=4
23  B3R0.2  CC([O-])=O DB00258 [1,1,0,0,0,0|0,1,1]=4
24  B3R0.2  CC([O-])=O DB09395 [1,1,0,0,0,0|0,1,1]=4
25  B3R0.2  CS(C)=O DB01093 [1,1,0,0,0,0|1,0,0]=3
26  B5R0.3  OCC(O)CO DB09462 [0,2,0,0,0,0|0,1,0]=3
27  B5R0.3  OCC(S)CS DB06782 [0,2,0,0,0,0|0,0,0]=2
28  B5R0.5  CC(O)C(O)=O DB04398 [0,2,0,0,0,0|0,1,1]=4
29  B5R0.5  CC(O)C([O-])=O DB06768 [0,2,0,0,0,0|0,1,1]=4
30  B5R0.5  C[C@H](N)C(O)=O DB00160 [0,2,0,0,0,0|0,1,1]=4
31  B5R1.3  ClCC1CO1 DB00658 [0,1,0,1,0,0|0,1,0]=3