pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.45	IUPAC digitized pKa	0	-1	O=C(O)/C=C\Cl	O=C([O-])/C=C\Cl	mol9004	O=C(O)/C=C\Cl
3.385	AttenGpKa training set	0	-1	O=C(O)/C=C\Cl	O=C([O-])/C=C\Cl	mol9004	O=C(O)/C=C\Cl