0  B4R0.2  C/C=C\C=O HMDB0034233 [0,0,0,0,0,0|0,1,3]=4
1  B3R0.1  C(=O)CCl HMDB0013860 [1,0,0,0,0,0|1,1,1]=4
2  B3R0.1  NCCN HMDB0031225 [1,0,0,0,0,0|2,0,0]=3
3  B5R0.3  OCC(S)CS HMDB0015677 [0,1,0,0,0,0|1,0,0]=2
4  B5R1.3  ClCC1CO1 HMDB0014796 [0,0,0,1,0,0|1,1,0]=3
5  B2R0.1  CC=O HMDB0000990 [2,0,0,0,0,0|0,1,1]=4
6  B2R0.1  CSC HMDB0002303 [2,0,0,0,0,0|1,0,0]=3
7  B4R0.1  CC(O)CO HMDB0001881 [1,1,0,0,0,0|0,1,0]=3
8  B6R0.3  CC[C@H](N)C(O)=O HMDB0000452 [0,2,0,0,0,0|0,1,1]=4
9  B6R0.3  N[C@@H](CS)C(O)=O HMDB0000574 [0,2,0,0,0,0|1,0,1]=4
10  B6R0.4  CCCOC(C)=O HMDB0034237 [0,2,0,0,0,0|0,1,1]=4
11  B6R0.4  OCCCC([O-])=O HMDB0015507 [0,2,0,0,0,0|0,1,1]=4
12  B6R0.5  C[N+](C)(C)CCO HMDB0000097 [0,2,0,0,0,0|1,1,0]=4
13  B6R0.6  ClCCNCCCl HMDB0060688 [0,2,0,0,0,0|1,0,0]=3
14  B6R0.6  OCCNCCO HMDB0004437 [0,2,0,0,0,0|0,1,0]=3
15  B6R1.1  C1CNCCN1 HMDB0014730 [0,1,0,1,0,0|1,0,0]=3