[
  {
    "molid": "mol636",
    "smiles": "C[C@]12CC3CC(N)(C1)C[C@@](C)(C3)C2",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "C[C@]12C[C@@H]3C[C@](C)(C1)C[C@@](N)(C3)C2",
        "std_free_energy": -1.0926759243011475,
        "relative_population": 1.0
      },
      {
        "id": "1_1",
        "charge": 1,
        "smiles": "C[C@]12C[C@@H]3C[C@](C)(C1)C[C@@]([NH3+])(C3)C2",
        "std_free_energy": -8.957491874694824,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 10.66,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "OCHEM"
      }
    ]
  }
]