0  B9R1.8  OCCN1CCOCC1 HMDB0060650 [0,0,0,1,0,0|2,0,1]=4
1  B6R0.6  OCCNCCO HMDB0004437 [2,0,0,0,0,0|2,0,0]=4
2  B10R1.17  OCCON1CCOCC1 HMDB0061157 [0,1,0,1,0,0|2,0,0]=4