[
  {
    "molid": "mol15534",
    "smiles": "Oc1n[nH]c(-c2ccccc2)c1Cc1ccccc1",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "Oc1n[nH]c(-c2ccccc2)c1Cc1ccccc1",
        "std_free_energy": -6.209358215332031,
        "relative_population": 1.0
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "[O-]c1n[nH]c(-c2ccccc2)c1Cc1ccccc1",
        "std_free_energy": -3.461622476577759,
        "relative_population": 0.9125429081678101
      },
      {
        "id": "-1_2",
        "charge": -1,
        "smiles": "Oc1n[n-]c(-c2ccccc2)c1Cc1ccccc1",
        "std_free_energy": -1.1165356636047363,
        "relative_population": 0.08745709183218994
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 7.7,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "Datawarrior"
      },
      {
        "pka_value": 7.6999998,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "OCHEM"
      }
    ]
  }
]