0  B18R2.488861  CC1(S(=O)(=O)O)CC(=O)c2ccccc2C1=O Amb17596997 [0,0,0,0,0,0|0,0,0]=0
1  B18R2.488861  CC1(S(=O)(=O)[O-])CC(=O)c2ccccc2C1=O Amb584960 [0,0,0,0,0,0|0,0,1]=1
2  B17R2.38282  O=C1C=C(S(=O)(=O)O)C(=O)c2ccccc21 Amb9860631 [1,0,0,0,0,0|0,0,2]=3
3  B16R2.387812  CC1(C(=O)O)CC(=O)c2ccccc2O1 Amb5723995 [2,0,0,0,0,0|2,0,0]=4
4  B18R2.2930785  O=C1C(O)=C(S(=O)(=O)O)C(=O)c2ccccc21 Amb17596993 [1,1,0,0,0,0|0,0,2]=4