pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.15	AttenGpKa training set	0	-1	Fc1nc2ccccc2[nH]1	Fc1nc2ccccc2[n-]1	mol26365	Fc1nc2ccccc2[nH]1
2.7	AttenGpKa training set	1	0	Fc1[nH]c2ccccc2[nH+]1	Fc1nc2ccccc2[nH]1	mol26365	Fc1nc2ccccc2[nH]1
