0 B6R0.6 ClCCNCCCl HMDB0060688 [0,1,0,0,0,0|2,0,0]=3 1 B3R0.1 NCCN HMDB0031225 [2,0,0,0,0,0|2,0,0]=4 2 B7R0.3 NCC(=O)OCCO HMDB0061148 [0,2,0,0,0,0|0,1,1]=4