[
  {
    "molid": "mol30319",
    "smiles": "O=C1Nc2cc(Cl)c(C(=O)c3ccccc3F)cc2O1",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "O=C(c1ccccc1F)c1cc2oc(=O)[nH]c2cc1Cl",
        "std_free_energy": -5.191411972045898,
        "relative_population": 1.0
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "O=C(c1ccccc1F)c1cc2oc(=O)[n-]c2cc1Cl",
        "std_free_energy": -2.2108988761901855,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 7.15,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "AttenGpKa training set"
      }
    ]
  }
]