0  B7R0.9  C[N+](C)(C)CC(=O)[O-] DB06756 [0,1,0,0,0,0|1,0,1]=3
1  B7R0.16  CC(C)[C@H](N)C(=O)O DB00161 [0,1,0,0,0,0|2,0,0]=3
2  B7R0.16  C[C@@H](O)[C@H](N)C(=O)O DB00156 [0,1,0,0,0,0|3,0,0]=4
3  B5R0.5  CC(=O)C(=O)O DB00119 [0,0,0,0,1,0|3,0,0]=4
4  B5R0.5  CC(O)C(=O)O DB04398 [0,0,0,0,1,0|3,0,0]=4
5  B5R0.5  CC(O)C(=O)[O-] DB06768 [0,0,0,0,1,0|3,0,0]=4
6  B5R0.5  CC(O)C(=O)[O-] DB13231 [0,0,0,0,1,0|3,0,0]=4
7  B5R0.5  C[C@H](N)C(=O)O DB00160 [0,0,0,0,1,0|3,0,0]=4
8  B7R0.6  CC(=O)CCC(=O)[O-] DB13800 [0,0,0,0,0,1|3,0,0]=4
9  B4R0.1  CC(=O)NO DB00551 [2,0,0,0,0,0|2,0,0]=4
10  B4R0.1  CCC(=O)O DB03766 [2,0,0,0,0,0|1,0,0]=3
11  B4R0.1  NC(=O)NO DB01005 [2,0,0,0,0,0|1,0,0]=3
12  B4R0.1  NCC(=O)O DB00145 [2,0,0,0,0,0|1,0,0]=3
13  B4R0.1  NCC(=O)[O-] DB11189 [2,0,0,0,0,0|1,0,0]=3
14  B4R0.1  NCC(=O)[O-] DB11200 [2,0,0,0,0,0|1,0,0]=3
15  B4R0.1  NCC(=O)[O-] DB11210 [2,0,0,0,0,0|1,0,0]=3
16  B4R0.1  O=C(O)CO DB03085 [2,0,0,0,0,0|2,0,0]=4
17  B6R0.4  NCCCC(=O)O DB02530 [1,1,0,0,0,0|2,0,0]=4
18  B6R0.4  O=C([O-])CCCO DB01440 [1,1,0,0,0,0|2,0,0]=4
19  B6R0.4  O=C([O-])CCCO DB09072 [1,1,0,0,0,0|2,0,0]=4
20  B8R0.23  CC(C)C[C@H](N)C(=O)O DB00149 [0,1,0,0,0,1|2,0,0]=4
21  B8R0.23  CN(C)C(=N)NC(=N)N DB00331 [0,1,0,0,0,1|1,0,1]=4
22  B8R0.2  CC[C@H](C)[C@H](N)C(=O)O DB00167 [0,2,0,0,0,0|2,0,0]=4
23  B8R0.27  [C@H](N)(C(=O)O)C(C)(C)S DB00859 [0,2,0,0,0,0|2,0,0]=4