pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.12	Datawarrior	0	-1	O=C(O)[C@@H]1C[C@@H]1Cl	O=C([O-])[C@@H]1C[C@@H]1Cl	mol16007	O=C(O)[C@@H]1C[C@@H]1Cl
4.11999988555908	QSARToolbox	0	-1	O=C(O)[C@@H]1C[C@@H]1Cl	O=C([O-])[C@@H]1C[C@@H]1Cl	mol16007	O=C(O)[C@@H]1C[C@@H]1Cl