0  B8R0.4  OCCCNCCCO ACI-02693 [0,1,0,0,0,0|3,0,0]=4
1  B7R0.4  CC(C)CCCCO JM-10D-001 [1,1,0,0,0,0|2,0,0]=4
2  B9R1.89  ClCC1SCCCCS1 ACI-01307 [0,1,0,1,0,0|2,0,0]=4