0  B6R0.4  NCCCC(=O)O DB02530 [0,0,0,0,0,0|3,0,0]=3
1  B6R0.4  O=C([O-])CCCO DB01440 [0,0,0,0,0,0|3,0,0]=3
2  B6R0.4  O=C([O-])CCCO DB09072 [0,0,0,0,0,0|3,0,0]=3
3  B7R0.6  CC(=O)CCC(=O)[O-] DB13800 [0,1,0,0,0,0|2,0,0]=3
4  B7R0.6  O=C(O)CCC(=O)O DB00139 [0,1,0,0,0,0|3,0,0]=4
5  B4R0.1  CC(=O)NO DB00551 [2,0,0,0,0,0|1,1,0]=4
6  B4R0.1  CCC(=O)O DB03766 [2,0,0,0,0,0|1,0,0]=3
7  B4R0.1  NCC(=O)O DB00145 [2,0,0,0,0,0|2,0,0]=4
8  B4R0.1  NCC(=O)[O-] DB11189 [2,0,0,0,0,0|2,0,0]=4
9  B4R0.1  NCC(=O)[O-] DB11200 [2,0,0,0,0,0|2,0,0]=4
10  B4R0.1  NCC(=O)[O-] DB11210 [2,0,0,0,0,0|2,0,0]=4
11  B4R0.1  O=C(O)CO DB03085 [2,0,0,0,0,0|1,1,0]=4
12  B6R0.3  N[C@@H](CO)C(=O)O DB00133 [1,1,0,0,0,0|1,1,0]=4
13  B6R0.3  N[C@@H](CS)C(=O)O DB00151 [1,1,0,0,0,0|1,0,0]=3
14  B6R0.3  N[C@H](CO)C(=O)O DB03929 [1,1,0,0,0,0|1,1,0]=4
15  B6R0.3  [C@H](N)(CS)C(=O)O DB11197 [1,1,0,0,0,0|1,0,0]=3
16  B6R0.5  O=S(=O)(O)CCS DB09110 [1,1,0,0,0,0|2,0,0]=4
17  B8R0.2  CC[C@H](C)[C@H](N)C(=O)O DB00167 [0,2,0,0,0,0|2,0,0]=4
18  B8R0.23  CC(C)C[C@H](N)C(=O)O DB00149 [0,2,0,0,0,0|2,0,0]=4
19  B8R0.8  CSCCC(N)C(=O)O DB13972 [0,2,0,0,0,0|1,0,0]=3
20  B8R0.8  CSCC[C@@H](N)C(=O)O DB02893 [0,2,0,0,0,0|1,0,0]=3
21  B8R0.8  CSCC[C@H](N)C(=O)O DB00134 [0,2,0,0,0,0|1,0,0]=3
22  B8R0.8  C[Se]CC[C@H](N)C(=O)O DB11142 [0,2,0,0,0,0|1,1,0]=4
23  B8R0.8  NCCC[C@H](N)C(=O)O DB00129 [0,2,0,0,0,0|2,0,0]=4
24  B8R0.9  NCC(=O)CCC(=O)O DB00855 [0,2,0,0,0,0|2,0,0]=4
25  B8R0.7  NCCCCCC(=O)O DB00513 [0,2,0,0,0,0|2,0,0]=4
26  B6R1.1  C1CNCCN1 DB00592 [1,0,0,1,0,0|2,0,0]=4
27  B8R1.7  O=C(O)[C@@H]1CCCN1 DB00172 [0,1,0,1,0,0|2,0,0]=4