0  B3R0.1  C(=O)CCl HMDB0013860 [1,0,0,0,0,0|1,0,2]=4
1  B3R0.1  NCCN HMDB0031225 [1,0,0,0,0,0|2,0,0]=3
2  B2R0.1  CC=O HMDB0000990 [2,0,0,0,0,0|0,0,2]=4
3  B2R0.1  CSC HMDB0002303 [2,0,0,0,0,0|1,0,0]=3
4  B2R0.1  OC=O HMDB0000142 [2,0,0,0,0,0|1,0,1]=4
5  B6R0.3  CC[C@H](N)C(O)=O HMDB0000452 [0,2,0,0,0,0|0,0,1]=3
6  B6R0.3  N[C@@H](CS)C(O)=O HMDB0000574 [0,2,0,0,0,0|1,0,1]=4
7  B6R0.6  ClCCNCCCl HMDB0060688 [0,2,0,0,0,0|1,0,0]=3