[
  {
    "molid": "mol11325",
    "smiles": "Cc1c(-c2ccccc2)[nH]oc1=O",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "Cc1c(-c2ccccc2)[nH]oc1=O",
        "std_free_energy": -3.198880672454834,
        "relative_population": 1.0
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "Cc1c(-c2ccccc2)[n-]oc1=O",
        "std_free_energy": -7.649921417236328,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 4.73,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "IUPAC digitized pKa"
      }
    ]
  }
]