0  B9R0.45  NCCCCNCCCN HMDB0001257 [0,0,0,0,0,0|3,0,0]=3
1  B8R0.4  CCCCCCCCO HMDB0001183 [1,0,0,0,0,0|3,0,0]=4
2  B9R0.2  CC(=O)NCCCCCN HMDB0002284 [1,1,0,0,0,0|1,0,1]=4
3  B9R1.8  OCCN1CCOCC1 HMDB0060650 [1,0,0,1,0,0|2,0,0]=4