0  B5R0.3  CCC(C=C)O 776 [0,0,0,0,0,0|2,0,1]=3
1  B3R0.2  CC(C)O 275 [2,0,0,0,0,0|0,0,0]=2
2  B3R0.2  CS(=O)C 188 [2,0,0,0,0,0|1,0,1]=4
3  B5R0.1  CC(CCO)O 719 [1,1,0,0,0,0|0,0,0]=2
4  B5R0.5  CC(C(=O)[O-])O 1258 [1,1,0,0,0,0|0,0,2]=4
5  B5R0.5  CC(C(=O)[O-])O 293 [1,1,0,0,0,0|0,0,2]=4
6  B7R0.3  CCCCC(CC)O 730 [0,2,0,0,0,0|2,0,0]=4