[ { "identifier": { "cas": "1333-74-0", "name": "hydrogen", "iupac_name": "molecular hydrogen", "smiles": "[HH]", "inchi": "InChI=1S/H2/h1H", "formula": "H2" }, "model_record": { "m": 1.0, "sigma": 3.002, "epsilon_k": 51.343 }, "molarweight": 2.016 } ]