0  B9R0.5  CCCC(=O)NCCSC 2245988 [1,0,0,0,0,0|3,0,0]=4
1  B12R0.103  CCCCS(=O)CC(COCC)O 2842988 [0,2,0,0,0,0|2,0,0]=4
2  B12R1.308  CCOC(=O)C1CCCNC1=O 97773 [0,1,0,1,0,0|0,0,2]=4