[
    {
        "id1": {
            "cas": "67-56-1",
            "name": "methanol",
            "iupac_name": "methanol",
            "smiles": "CO",
            "inchi": "InChI=1/CH4O/c1-2/h2H,1H3",
            "formula": "CH4O"
        },
        "id2": {
            "cas": "110-82-7",
            "name": "cyclohexane",
            "iupac_name": "cyclohexane",
            "smiles": "C1CCCCC1",
            "inchi": "InChI=1/C6H12/c1-2-4-6-5-3-1/h1-6H2",
            "formula": "C6H12"
        },
        "model_record": {
            "k_ij": 0.051
        }
    },
    {
        "id1": {
            "cas": "67-56-1",
            "name": "methanol",
            "iupac_name": "methanol",
            "smiles": "CO",
            "inchi": "InChI=1/CH4O/c1-2/h2H,1H3",
            "formula": "CH4O"
        },
        "id2": {
            "cas": "111-87-5",
            "name": "1-octanol",
            "iupac_name": "octan-1-ol",
            "smiles": "CCCCCCCCO",
            "inchi": "InChI=1/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3",
            "formula": "C8H18O"
        },
        "model_record": {
            "k_ij": 0.02
        }
    },
    {
        "id1": {
            "cas": "64-17-5",
            "name": "ethanol",
            "iupac_name": "ethanol",
            "smiles": "CCO",
            "inchi": "InChI=1/C2H6O/c1-2-3/h3H,2H2,1H3",
            "formula": "C2H6O"
        },
        "id2": {
            "cas": "106-97-8",
            "name": "butane",
            "iupac_name": "butane",
            "smiles": "CCCC",
            "inchi": "InChI=1/C4H10/c1-3-4-2/h3-4H2,1-2H3",
            "formula": "C4H10"
        },
        "model_record": {
            "k_ij": 0.028
        }
    },
    {
        "id1": {
            "cas": "71-23-8",
            "name": "1-propanol",
            "iupac_name": "propan-1-ol",
            "smiles": "CCCO",
            "inchi": "InChI=1/C3H8O/c1-2-3-4/h4H,2-3H2,1H3",
            "formula": "C3H8O"
        },
        "id2": {
            "cas": "71-43-2",
            "name": "benzene",
            "iupac_name": "benzene",
            "smiles": "c1ccccc1",
            "inchi": "InChI=1/C6H6/c1-2-4-6-5-3-1/h1-6H",
            "formula": "C6H6"
        },
        "model_record": {
            "k_ij": 0.02
        }
    },
    {
        "id1": {
            "cas": "71-23-8",
            "name": "1-propanol",
            "iupac_name": "propan-1-ol",
            "smiles": "CCCO",
            "inchi": "InChI=1/C3H8O/c1-2-3-4/h4H,2-3H2,1H3",
            "formula": "C3H8O"
        },
        "id2": {
            "cas": "100-41-4",
            "name": "ethylbenzene",
            "iupac_name": "ethylbenzene",
            "smiles": "CCc1ccccc1",
            "inchi": "InChI=1/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3",
            "formula": "C8H10"
        },
        "model_record": {
            "k_ij": 0.023
        }
    },
    {
        "id1": {
            "cas": "67-63-0",
            "name": "2-propanol",
            "iupac_name": "propan-2-ol",
            "smiles": "CC(C)O",
            "inchi": "InChI=1/C3H8O/c1-3(2)4/h3-4H,1-2H3",
            "formula": "C3H8O"
        },
        "id2": {
            "cas": "71-43-2",
            "name": "benzene",
            "iupac_name": "benzene",
            "smiles": "c1ccccc1",
            "inchi": "InChI=1/C6H6/c1-2-4-6-5-3-1/h1-6H",
            "formula": "C6H6"
        },
        "model_record": {
            "k_ij": 0.021
        }
    },
    {
        "id1": {
            "cas": "71-36-3",
            "name": "1-butanol",
            "iupac_name": "butan-1-ol",
            "smiles": "CCCCO",
            "inchi": "InChI=1/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3",
            "formula": "C4H10O"
        },
        "id2": {
            "cas": "106-97-8",
            "name": "butane",
            "iupac_name": "butane",
            "smiles": "CCCC",
            "inchi": "InChI=1/C4H10/c1-3-4-2/h3-4H2,1-2H3",
            "formula": "C4H10"
        },
        "model_record": {
            "k_ij": 0.015
        }
    },
    {
        "id1": {
            "cas": "71-41-0",
            "name": "1-pentanol",
            "iupac_name": "pentan-1-ol",
            "smiles": "CCCCCO",
            "inchi": "InChI=1/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3",
            "formula": "C5H12O"
        },
        "id2": {
            "cas": "71-43-2",
            "name": "benzene",
            "iupac_name": "benzene",
            "smiles": "c1ccccc1",
            "inchi": "InChI=1/C6H6/c1-2-4-6-5-3-1/h1-6H",
            "formula": "C6H6"
        },
        "model_record": {
            "k_ij": 0.0135
        }
    },
    {
        "id1": {
            "cas": "7732-18-5",
            "name": "water",
            "iupac_name": "oxidane",
            "smiles": "O",
            "inchi": "InChI=1/H2O/h1H2",
            "formula": "H2O"
        },
        "id2": {
            "cas": "71-41-0",
            "name": "1-pentanol",
            "iupac_name": "pentan-1-ol",
            "smiles": "CCCCCO",
            "inchi": "InChI=1/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3",
            "formula": "C5H12O"
        },
        "model_record": {
            "k_ij": 0.016
        }
    }
]