0  B6R0.1  CNC(=S)NCO DB13838 [0,0,0,0,0,0|3,1,0]=4
1  B7R0.7  CN(CCCl)CCCl DB00888 [0,1,0,0,0,0|3,0,0]=4
2  B7R1.4  N[C@@H]1CONC1=O DB00260 [0,0,0,1,0,0|3,0,0]=4
3  B4R0.1  CC(=O)NO DB00551 [2,0,0,0,0,0|2,0,0]=4
4  B4R0.1  CCC(=O)O DB03766 [2,0,0,0,0,0|1,0,0]=3
5  B4R0.1  NCC(=O)O DB00145 [2,0,0,0,0,0|2,0,0]=4
6  B4R0.1  NCC(=O)[O-] DB11189 [2,0,0,0,0,0|2,0,0]=4
7  B4R0.1  NCC(=O)[O-] DB11200 [2,0,0,0,0,0|2,0,0]=4
8  B4R0.1  NCC(=O)[O-] DB11210 [2,0,0,0,0,0|2,0,0]=4
9  B4R0.1  O=C(O)CO DB03085 [2,0,0,0,0,0|2,0,0]=4
10  B6R0.3  N[C@@H](CO)C(=O)O DB00133 [1,1,0,0,0,0|2,0,0]=4
11  B6R0.3  N[C@@H](CS)C(=O)O DB00151 [1,1,0,0,0,0|2,0,0]=4
12  B6R0.3  N[C@H](CO)C(=O)O DB03929 [1,1,0,0,0,0|2,0,0]=4
13  B6R0.3  [C@H](N)(CS)C(=O)O DB11197 [1,1,0,0,0,0|2,0,0]=4
14  B6R0.4  NCCCC(=O)O DB02530 [1,1,0,0,0,0|1,0,0]=3
15  B6R0.4  O=C([O-])CCCO DB01440 [1,1,0,0,0,0|1,0,0]=3
16  B6R0.4  O=C([O-])CCCO DB09072 [1,1,0,0,0,0|1,0,0]=3
17  B8R0.9  NCC(=O)CCC(=O)O DB00855 [0,2,0,0,0,0|1,0,1]=4
18  B6R1.1  C1CNCCN1 DB00592 [1,0,0,1,0,0|2,0,0]=4