0  B7R0.5  CCOC(=O)C(C)=O DB05869 [0,0,0,0,0,0|3,0,1]=4
1  B7R0.5  C[Se]C[C@H](N)C(=O)O DB12697 [0,0,0,0,0,0|2,0,0]=2
2  B6R0.3  N[C@H](CO)C(=O)O DB03929 [1,0,0,0,0,0|2,0,0]=3
3  B6R0.4  NCCCC(=O)O DB02530 [1,0,0,0,0,0|1,0,0]=2
4  B6R0.4  O=C([O-])CCCO DB01440 [1,0,0,0,0,0|1,0,1]=3
5  B8R0.2  CC[C@H](C)[C@H](N)C(=O)O DB00167 [0,1,0,0,0,0|1,0,0]=2
6  B8R0.8  CSCC[C@@H](N)C(=O)O DB02893 [0,1,0,0,0,0|1,0,0]=2
7  B8R0.8  C[Se]CC[C@H](N)C(=O)O DB11142 [0,1,0,0,0,0|1,0,0]=2
8  B8R0.23  NC(=O)C[C@H](N)C(=O)O DB00174 [0,1,0,0,0,0|2,0,1]=4
9  B8R0.23  O=C(O)CC(O)C(=O)O DB12751 [0,1,0,0,0,0|2,0,1]=4
10  B8R1.7  O=C(O)C1CSCN1 DB12856 [0,0,0,1,0,0|2,0,0]=3
11  B5R0.1  CCCC(=O)O DB03568 [2,0,0,0,0,0|0,0,0]=2
12  B5R0.1  CNCC(=O)O DB12519 [2,0,0,0,0,0|1,0,0]=3
13  B5R0.5  CC(=O)C(=O)O DB00119 [2,0,0,0,0,0|1,0,1]=4
14  B5R0.5  CC(O)C(=O)[O-] DB13231 [2,0,0,0,0,0|1,0,1]=4
15  B5R0.5  O=C(O)C(Cl)Cl DB08809 [2,0,0,0,0,0|2,0,0]=4
16  B7R0.8  NCCCS(=O)(=O)O DB06527 [1,1,0,0,0,0|2,0,0]=4
17  B9R0.29  CCC(C)C(CC)C(N)=O DB13099 [0,2,0,0,0,0|1,0,0]=3
18  B9R0.79  C[C@H](C(=O)O)[C@@H](N)C(=O)O DB04313 [0,2,0,0,0,0|1,0,1]=4
19  B9R0.7  NC(=O)CC[C@H](N)C(=O)O DB00130 [0,2,0,0,0,0|1,0,1]=4
20  B9R0.15  CCCC(CCC)C(=O)O DB00313 [0,2,0,0,0,0|0,0,0]=2
21  B9R0.39  CC(=O)N[C@@H](CS)C(=O)O DB06151 [0,2,0,0,0,0|1,0,1]=4
22  B7R1.4  CN1CCCC1=O DB12521 [1,0,0,1,0,0|1,0,0]=3
23  B9R1.35  O=C1CC[C@@H](C(=O)O)N1 DB03088 [0,1,0,1,0,0|1,0,1]=4