pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.3	AttenGpKa training set	1	0	Nc1c2ccccc2[nH+]c2c(Cl)cccc12,[NH3+]c1c2ccccc2nc2c(Cl)cccc12	Nc1c2ccccc2nc2c(Cl)cccc12	mol26668	Nc1c2ccccc2nc2c(Cl)cccc12