0  B12R0.233  CCCCCC(CCCC(=O)[O-])O 45479721 [0,0,0,0,0,0|0,0,3]=3
1  B14R1.420  C1CCN(CC1)C(=O)CSCC(=O)O 822179 [0,1,0,1,0,0|1,0,0]=3