[
  {
    "molid": "mol32766",
    "smiles": "CN(C)CC1C2CCC(C)(C1N)C2(C)C",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "CN(C)C[C@@H]1[C@@H](N)[C@@]2(C)CC[C@@H]1C2(C)C",
        "std_free_energy": -0.9841334819793701,
        "relative_population": 1.0
      },
      {
        "id": "1_1",
        "charge": 1,
        "smiles": "CN(C)C[C@@H]1[C@@H]([NH3+])[C@@]2(C)CC[C@@H]1C2(C)C",
        "std_free_energy": -7.324944019317627,
        "relative_population": 0.42880733713134167
      },
      {
        "id": "1_2",
        "charge": 1,
        "smiles": "C[NH+](C)C[C@@H]1[C@@H](N)[C@@]2(C)CC[C@@H]1C2(C)C",
        "std_free_energy": -7.611662864685059,
        "relative_population": 0.5711926628686583
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 9.8400002,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "OCHEM"
      }
    ]
  }
]