pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.85	AttenGpKa training set	0	-1	O=P(O)(O)C(c1ccccc1)(c1ccccc1)c1ccccc1	O=P([O-])(O)C(c1ccccc1)(c1ccccc1)c1ccccc1	mol29055	O=P(O)(O)C(c1ccccc1)(c1ccccc1)c1ccccc1
9.0	AttenGpKa training set	-1	-2	O=P([O-])(O)C(c1ccccc1)(c1ccccc1)c1ccccc1	O=P([O-])([O-])C(c1ccccc1)(c1ccccc1)c1ccccc1	mol29055	O=P(O)(O)C(c1ccccc1)(c1ccccc1)c1ccccc1