0  B7R0.6  CC(=O)CCC(=O)[O-] DB13800 [0,0,0,0,0,0|1,0,2]=3
1  B7R0.6  O=C(O)CCC(=O)O DB00139 [0,0,0,0,0,0|2,0,1]=3
2  B6R0.4  NCCCC(=O)O DB02530 [1,0,0,0,0,0|1,0,2]=4
3  B8R0.9  NCC(=O)CCC(=O)O DB00855 [0,1,0,0,0,0|1,0,1]=3
4  B8R0.23  CC(C)C[C@H](N)C(=O)O DB00149 [0,1,0,0,0,0|0,0,2]=3
5  B8R0.23  CN(CC(=O)O)C(=N)N DB00148 [0,1,0,0,0,0|3,0,0]=4
6  B8R0.23  NC(=O)C[C@H](N)C(=O)O DB00174 [0,1,0,0,0,0|2,0,1]=4
7  B8R0.23  N[C@@H](CC(=O)O)C(=O)O DB00128 [0,1,0,0,0,0|2,0,1]=4
8  B7R0.9  C[N+](C)(C)CC(=O)[O-] DB06756 [0,1,0,0,1,0|1,0,1]=4
9  B7R0.16  CC(C)[C@H](N)C(=O)O DB00161 [0,1,0,0,1,0|0,0,1]=3
10  B7R0.16  C[C@@H](O)[C@H](N)C(=O)O DB00156 [0,1,0,0,1,0|1,0,1]=4
11  B9R0.7  CC(S)\C(O)=N\CC(=O)O DB06823 [0,1,0,0,0,1|1,0,1]=4
12  B9R0.24  C(C(=O)OC)=CC(=O)OC DB08908 [0,2,0,0,0,0|1,0,1]=4
13  B9R0.24  COC(=O)CCC(=O)CN DB00992 [0,2,0,0,0,0|1,0,1]=4
14  B9R0.39  CC(=O)N[C@@H](CS)C(=O)O DB06151 [0,2,0,0,0,0|2,0,0]=4
15  B5R0.5  CC(=O)C(=O)O DB00119 [0,0,0,0,2,0|1,0,0]=3
16  B5R0.5  CC(O)C(=O)O DB04398 [0,0,0,0,2,0|1,0,1]=4
17  B5R0.5  C[C@H](N)C(=O)O DB00160 [0,0,0,0,2,0|1,0,1]=4