pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.29	AttenGpKa training set	0	-1	O=C(O)[C@]12C[C@](F)(C1)C2	O=C([O-])[C@]12C[C@](F)(C1)C2	mol22243	O=C(O)C12CC(F)(C1)C2