pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.23	AttenGpKa training set	0	-1	CC1(C)OC(O)(c2ccccc2)OC1(C)C	CC1(C)OC([O-])(c2ccccc2)OC1(C)C	mol31235	CC1(C)OC(O)(c2ccccc2)OC1(C)C
