0  B9R1.5  O=C1NCCCCC1Br 1651 [0,0,0,1,0,0|3,0,0]=4
1  B8R0.23  CC(=O)CC(C)C(=O)O 1624 [1,1,0,0,0,0|1,0,1]=4
2  B10R1.18  O=C(O)CC1CCCCO1 1370 [0,0,0,1,0,1|2,0,0]=4