[
  {
    "molid": "mol25183",
    "smiles": "Cc1cc(Cl)cc(C)[n+]1O",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "Cc1cc(Cl)cc(C)[n+]1[O-]",
        "std_free_energy": -6.3385820388793945,
        "relative_population": 1.0
      },
      {
        "id": "1_1",
        "charge": 1,
        "smiles": "Cc1cc(Cl)cc(C)[n+]1O",
        "std_free_energy": 6.336116313934326,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 0.61,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "AttenGpKa training set"
      }
    ]
  }
]