pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.3	AttenGpKa training set	0	-1	O=C1CCCc2c1c(O)c1c(O)cccc1c2O	O=C1CCCc2c1c([O-])c1c(O)cccc1c2O,O=C1CCCc2c1c(O)c1c([O-])cccc1c2O,O=C1CCCc2c1c(O)c1c(O)cccc1c2[O-]	mol30784	O=C1CCCc2c1c(O)c1c(O)cccc1c2O
