[
  {
    "molid": "mol23138",
    "smiles": "O=C(O)c1cccc2c1Cc1c(Cl)cccc1C2",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "O=C(O)c1cccc2c1Cc1c(Cl)cccc1C2",
        "std_free_energy": -3.1759581565856934,
        "relative_population": 1.0
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "O=C([O-])c1cccc2c1Cc1c(Cl)cccc1C2",
        "std_free_energy": -9.633977890014648,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 5.80000019073486,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "QSARToolbox"
      }
    ]
  }
]