pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.5	AttenGpKa training set	1	0	COc1ccc(OC)c2[nH+]c[nH]c12	COc1ccc(OC)c2[nH]cnc12	mol26464	COc1ccc(OC)c2[nH]cnc12
