[
  {
    "id1": {
      "cas": "71-23-8",
      "name": "1-propanol",
      "iupac_name": "propan-1-ol",
      "smiles": "CCCO",
      "inchi": "InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0082028991398555,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-63-0",
      "name": "2-propanol",
      "iupac_name": "propan-2-ol",
      "smiles": "CC(C)O",
      "inchi": "InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0408153487915831,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "24959-67-9",
      "name": "bromide ion",
      "formula": "Br",
      "smiles": "[Br-]"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.25,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "24959-67-9",
      "name": "bromide ion",
      "formula": "Br",
      "smiles": "[Br-]"
    },
    "id2": {
      "cas": "17341-24-1",
      "name": "lithium ion",
      "formula": "Li",
      "smiles": "[Li+]"
    },
    "model_record": {
      "k_ij": [
        0.591,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "24959-67-9",
      "name": "bromide ion",
      "formula": "Br",
      "smiles": "[Br-]"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        0.29,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "24959-67-9",
      "name": "bromide ion",
      "formula": "Br",
      "smiles": "[Br-]"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        -0.102,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "106-97-8",
      "name": "n-butane",
      "iupac_name": "butane",
      "smiles": "CCCC",
      "inchi": "InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.12,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "16887-00-6",
      "name": "chloride ion",
      "formula": "Cl",
      "smiles": "[Cl-]"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.25,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "16887-00-6",
      "name": "chloride ion",
      "formula": "Cl",
      "smiles": "[Cl-]"
    },
    "id2": {
      "cas": "17341-24-1",
      "name": "lithium ion",
      "formula": "Li",
      "smiles": "[Li+]"
    },
    "model_record": {
      "k_ij": [
        0.669,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "16887-00-6",
      "name": "chloride ion",
      "formula": "Cl",
      "smiles": "[Cl-]"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        0.317,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "16887-00-6",
      "name": "chloride ion",
      "formula": "Cl",
      "smiles": "[Cl-]"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        0.064,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "64-17-5",
      "name": "ethanol",
      "iupac_name": "ethanol",
      "smiles": "CCO",
      "inchi": "InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0467683331710837,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "16984-48-8",
      "name": "fluoride ion",
      "formula": "F",
      "smiles": "[F-]"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        0.665,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "16984-48-8",
      "name": "fluoride ion",
      "formula": "F",
      "smiles": "[F-]"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        1.0,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "56-81-5",
      "name": "glycerol",
      "iupac_name": "propane-1,2,3-triol",
      "smiles": "OCC(O)CO",
      "inchi": "InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0132071917610433,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "20461-54-5",
      "name": "iodide ion",
      "formula": "I",
      "smiles": "[I-]"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.25,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "20461-54-5",
      "name": "iodide ion",
      "formula": "I",
      "smiles": "[I-]"
    },
    "id2": {
      "cas": "17341-24-1",
      "name": "lithium ion",
      "formula": "Li",
      "smiles": "[Li+]"
    },
    "model_record": {
      "k_ij": [
        0.002,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "20461-54-5",
      "name": "iodide ion",
      "formula": "I",
      "smiles": "[I-]"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        0.018,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "20461-54-5",
      "name": "iodide ion",
      "formula": "I",
      "smiles": "[I-]"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        -0.312,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "74-98-6",
      "name": "propane",
      "iupac_name": "propane",
      "smiles": "CCC",
      "inchi": "InChI=1S/C3H8/c1-3-2/h3H2,1-2H3"
    },
    "id2": {
      "cas": "106-97-8",
      "name": "n-butane",
      "iupac_name": "butane",
      "smiles": "CCCC",
      "inchi": "InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.003,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "74-98-6",
      "name": "propane",
      "iupac_name": "propane",
      "smiles": "CCC",
      "inchi": "InChI=1S/C3H8/c1-3-2/h3H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.109,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "126-33-0",
      "name": "sulfolane",
      "iupac_name": "thiolane 1,1-dioxide",
      "smiles": "O=S1(=O)CCCC1",
      "inchi": "InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0739586760276745,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "126-33-0",
      "name": "sulfolane",
      "iupac_name": "thiolane 1,1-dioxide",
      "smiles": "O=S1(=O)CCCC1",
      "inchi": "InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0489050805873503,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        -0.0021,
        0.000453,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "13968-08-6",
      "name": "hydronium",
      "formula": "H",
      "smiles": "[H+]"
    },
    "model_record": {
      "k_ij": [
        0.25,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "14280-30-9",
      "name": "hydroxide",
      "formula": "OH",
      "smiles": "[OH-]"
    },
    "model_record": {
      "k_ij": [
        -0.25,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "3812-32-6",
      "name": "carbonate",
      "formula": "CO3",
      "smiles": "O=C([O-])[O-]"
    },
    "model_record": {
      "k_ij": [
        -0.25,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-21-1",
      "name": "1,2-ethanediol",
      "iupac_name": "ethane-1,2-diol",
      "smiles": "OCCO",
      "inchi": "InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1036991738757209,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-46-6",
      "name": "diethylene glycol",
      "iupac_name": "2-(2-hydroxyethoxy)ethanol",
      "smiles": "OCCOCCO",
      "inchi": "InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.190431958074146,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "67-68-5",
      "name": "dimethyl sulfoxide",
      "iupac_name": "methylsulfinylmethane",
      "smiles": "CS(C)=O",
      "inchi": "InChI=1S/C2H6OS/c1-4(2)3/h1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.199184159517956,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "67-68-5",
      "name": "dimethyl sulfoxide",
      "iupac_name": "methylsulfinylmethane",
      "smiles": "CS(C)=O",
      "inchi": "InChI=1S/C2H6OS/c1-4(2)3/h1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0077980380682515,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "17341-24-1",
      "name": "lithium ion",
      "formula": "Li",
      "smiles": "[Li+]"
    },
    "model_record": {
      "k_ij": [
        -0.25,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        0.0045,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        0.1997,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "16887-00-6",
      "name": "chloride ion",
      "formula": "Cl",
      "smiles": "[Cl-]"
    },
    "id2": {
      "cas": "13968-08-6",
      "name": "hydronium",
      "formula": "H",
      "smiles": "[H+]"
    },
    "model_record": {
      "k_ij": [
        0.654,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "24959-67-9",
      "name": "bromide ion",
      "formula": "Br",
      "smiles": "[Br-]"
    },
    "id2": {
      "cas": "13968-08-6",
      "name": "hydronium",
      "formula": "H",
      "smiles": "[H+]"
    },
    "model_record": {
      "k_ij": [
        0.645,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "20461-54-5",
      "name": "iodide ion",
      "formula": "I",
      "smiles": "[I-]"
    },
    "id2": {
      "cas": "13968-08-6",
      "name": "hydronium",
      "formula": "H",
      "smiles": "[H+]"
    },
    "model_record": {
      "k_ij": [
        0.497,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "14280-30-9",
      "name": "hydroxide",
      "formula": "OH",
      "smiles": "[OH-]"
    },
    "id2": {
      "cas": "17341-24-1",
      "name": "lithium ion",
      "formula": "Li",
      "smiles": "[Li+]"
    },
    "model_record": {
      "k_ij": [
        -0.566,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "14280-30-9",
      "name": "hydroxide",
      "formula": "OH",
      "smiles": "[OH-]"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        0.649,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "3812-32-6",
      "name": "carbonate",
      "formula": "CO3",
      "smiles": "O=C([O-])[O-]"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        -1.0,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "72-52-3",
      "name": "hydrogen-carbonate",
      "formula": "HCO3",
      "smiles": "C(=O)(O)[O-]"
    },
    "id2": {
      "cas": "7440-23-5",
      "name": "sodium ion",
      "formula": "Na",
      "smiles": "[Na+]"
    },
    "model_record": {
      "k_ij": [
        -0.514,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "14280-30-9",
      "name": "hydroxide",
      "formula": "OH",
      "smiles": "[OH-]"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        1.0,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "3812-32-6",
      "name": "carbonate",
      "formula": "CO3",
      "smiles": "O=C([O-])[O-]"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        1.0,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "72-52-3",
      "name": "hydrogen-carbonate",
      "formula": "HCO3",
      "smiles": "C(=O)(O)[O-]"
    },
    "id2": {
      "cas": "24203-36-9",
      "name": "potassium ion",
      "formula": "K",
      "smiles": "[K+]"
    },
    "model_record": {
      "k_ij": [
        -0.476,
        0.0,
        0.0,
        0.0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-05-8",
      "name": "acetonitrile",
      "iupac_name": "acetonitrile",
      "smiles": "CC#N",
      "inchi": "InChI=1S/C2H3N/c1-2-3/h1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0235183645555301,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-05-8",
      "name": "acetonitrile",
      "iupac_name": "acetonitrile",
      "smiles": "CC#N",
      "inchi": "InChI=1S/C2H3N/c1-2-3/h1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0134442258239278,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-64-1",
      "name": "acetone",
      "iupac_name": "propan-2-one",
      "smiles": "CC(C)=O",
      "inchi": "InChI=1S/C3H6O/c1-3(2)4/h1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0966952683751774,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-64-1",
      "name": "acetone",
      "iupac_name": "propan-2-one",
      "smiles": "CC(C)=O",
      "inchi": "InChI=1S/C3H6O/c1-3(2)4/h1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        7.079328079240045e-05,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-21-1",
      "name": "1,2-ethanediol",
      "iupac_name": "ethane-1,2-diol",
      "smiles": "OCCO",
      "inchi": "InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0043177426487171,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-21-1",
      "name": "1,2-ethanediol",
      "iupac_name": "ethane-1,2-diol",
      "smiles": "OCCO",
      "inchi": "InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1036991738757209,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "64-17-5",
      "name": "ethanol",
      "iupac_name": "ethanol",
      "smiles": "CCO",
      "inchi": "InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0467683331710837,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "64-17-5",
      "name": "ethanol",
      "iupac_name": "ethanol",
      "smiles": "CCO",
      "inchi": "InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "60-29-7",
      "name": "diethyl ether",
      "iupac_name": "ethoxyethane",
      "smiles": "CCOCC",
      "inchi": "InChI=1S/C4H10O/c1-3-5-4-2/h3-4H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -6.964289640229629e-05,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "60-29-7",
      "name": "diethyl ether",
      "iupac_name": "ethoxyethane",
      "smiles": "CCOCC",
      "inchi": "InChI=1S/C4H10O/c1-3-5-4-2/h3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0671240055306299,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-66-3",
      "name": "methoxybenzene",
      "iupac_name": "anisole",
      "smiles": "COc1ccccc1",
      "inchi": "InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.019554701796091,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-66-3",
      "name": "methoxybenzene",
      "iupac_name": "anisole",
      "smiles": "COc1ccccc1",
      "inchi": "InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0248183612656379,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "141-78-6",
      "name": "ethyl acetate",
      "iupac_name": "ethyl acetate",
      "smiles": "CCOC(C)=O",
      "inchi": "InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0718296900915271,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "141-78-6",
      "name": "ethyl acetate",
      "iupac_name": "ethyl acetate",
      "smiles": "CCOC(C)=O",
      "inchi": "InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0066220889270075,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "78-92-2",
      "name": "2-butanol",
      "iupac_name": "butan-2-ol",
      "smiles": "CCC(C)O",
      "inchi": "InChI=1S/C4H10O/c1-3-4(2)5/h4-5H,3H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0230777971723218,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "78-92-2",
      "name": "2-butanol",
      "iupac_name": "butan-2-ol",
      "smiles": "CCC(C)O",
      "inchi": "InChI=1S/C4H10O/c1-3-4(2)5/h4-5H,3H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0005369014847726,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-51-6",
      "name": "benzyl alcohol",
      "iupac_name": "phenylmethanol",
      "smiles": "OCc1ccccc1",
      "inchi": "InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.1533125166316663,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-51-6",
      "name": "benzyl alcohol",
      "iupac_name": "phenylmethanol",
      "smiles": "OCc1ccccc1",
      "inchi": "InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1866863264040439,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-47-0",
      "name": "benzonitrile",
      "iupac_name": "benzonitrile",
      "smiles": "N#Cc1ccccc1",
      "inchi": "InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0218419969543324,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-47-0",
      "name": "benzonitrile",
      "iupac_name": "benzonitrile",
      "smiles": "N#Cc1ccccc1",
      "inchi": "InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0574430072129166,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-43-2",
      "name": "benzene",
      "iupac_name": "benzene",
      "smiles": "c1ccccc1",
      "inchi": "InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0209929648203559,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-43-2",
      "name": "benzene",
      "iupac_name": "benzene",
      "smiles": "c1ccccc1",
      "inchi": "InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.100143645448525,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-36-3",
      "name": "1-butanol",
      "iupac_name": "butan-1-ol",
      "smiles": "CCCCO",
      "inchi": "InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0012837625148752,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-36-3",
      "name": "1-butanol",
      "iupac_name": "butan-1-ol",
      "smiles": "CCCCO",
      "inchi": "InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.05,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "78-93-3",
      "name": "2-butanone",
      "iupac_name": "butan-2-one",
      "smiles": "CCC(C)=O",
      "inchi": "InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0670567003619999,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "78-93-3",
      "name": "2-butanone",
      "iupac_name": "butan-2-one",
      "smiles": "CCC(C)=O",
      "inchi": "InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0346234645294297,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-66-3",
      "name": "chloroform",
      "iupac_name": "chloroform",
      "smiles": "ClC(Cl)Cl",
      "inchi": "InChI=1S/CHCl3/c2-1(3)4/h1H"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0244998022990555,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-66-3",
      "name": "chloroform",
      "iupac_name": "chloroform",
      "smiles": "ClC(Cl)Cl",
      "inchi": "InChI=1S/CHCl3/c2-1(3)4/h1H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.064930020487503,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-39-4",
      "name": "3-methylphenol",
      "iupac_name": "3-methylphenol",
      "smiles": "Cc1cccc(O)c1",
      "inchi": "InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0002307493947612,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-39-4",
      "name": "3-methylphenol",
      "iupac_name": "3-methylphenol",
      "smiles": "Cc1cccc(O)c1",
      "inchi": "InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0747463568501905,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-82-7",
      "name": "cyclohexane",
      "iupac_name": "cyclohexane",
      "smiles": "C1CCCCC1",
      "inchi": "InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0001934524521156,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-82-7",
      "name": "cyclohexane",
      "iupac_name": "cyclohexane",
      "smiles": "C1CCCCC1",
      "inchi": "InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "142-96-1",
      "name": "dibutyl ether",
      "iupac_name": "1-butoxybutane",
      "smiles": "CCCCOCCCC",
      "inchi": "InChI=1S/C8H18O/c1-3-5-7-9-8-6-4-2/h3-8H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0769372589694087,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "142-96-1",
      "name": "dibutyl ether",
      "iupac_name": "1-butoxybutane",
      "smiles": "CCCCOCCCC",
      "inchi": "InChI=1S/C8H18O/c1-3-5-7-9-8-6-4-2/h3-8H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0973857970117667,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-18-5",
      "name": "decane",
      "iupac_name": "decane",
      "smiles": "CCCCCCCCCC",
      "inchi": "InChI=1S/C10H22/c1-3-5-7-9-10-8-6-4-2/h3-10H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0017044434441636,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-18-5",
      "name": "decane",
      "iupac_name": "decane",
      "smiles": "CCCCCCCCCC",
      "inchi": "InChI=1S/C10H22/c1-3-5-7-9-10-8-6-4-2/h3-10H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-06-2",
      "name": "1,2-dichloroethane",
      "iupac_name": "1,2-dichloroethane",
      "smiles": "ClCCCl",
      "inchi": "InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0285824356135643,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-06-2",
      "name": "1,2-dichloroethane",
      "iupac_name": "1,2-dichloroethane",
      "smiles": "ClCCCl",
      "inchi": "InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0542132289587505,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-09-2",
      "name": "dichloromethane",
      "iupac_name": "dichloromethane",
      "smiles": "ClCCl",
      "inchi": "InChI=1S/CH2Cl2/c2-1-3/h1H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0166484668410943,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-09-2",
      "name": "dichloromethane",
      "iupac_name": "dichloromethane",
      "smiles": "ClCCl",
      "inchi": "InChI=1S/CH2Cl2/c2-1-3/h1H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0494472242681603,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "68-12-2",
      "name": "n,n-dimethylformamide (dmf)",
      "iupac_name": "n,n-dimethylformamide",
      "smiles": "CN(C)C=O",
      "inchi": "InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.13488308276657,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "68-12-2",
      "name": "n,n-dimethylformamide (dmf)",
      "iupac_name": "n,n-dimethylformamide",
      "smiles": "CN(C)C=O",
      "inchi": "InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "123-91-1",
      "name": "1,4-dioxane",
      "iupac_name": "1,4-dioxane",
      "smiles": "C1COCCO1",
      "inchi": "InChI=1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0944178914786077,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "123-91-1",
      "name": "1,4-dioxane",
      "iupac_name": "1,4-dioxane",
      "smiles": "C1COCCO1",
      "inchi": "InChI=1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0008680439106283,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-52-7",
      "name": "benzaldehyde",
      "iupac_name": "benzaldehyde",
      "smiles": "O=Cc1ccccc1",
      "inchi": "InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0422541200644278,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "100-52-7",
      "name": "benzaldehyde",
      "iupac_name": "benzaldehyde",
      "smiles": "O=Cc1ccccc1",
      "inchi": "InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0006605253319403,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "123-86-4",
      "name": "butyl acetate",
      "iupac_name": "butyl acetate",
      "smiles": "CCCCOC(C)=O",
      "inchi": "InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0835392532916746,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "123-86-4",
      "name": "butyl acetate",
      "iupac_name": "butyl acetate",
      "smiles": "CCCCOC(C)=O",
      "inchi": "InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0571985291871286,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "79-20-9",
      "name": "methyl acetate",
      "iupac_name": "methyl acetate",
      "smiles": "COC(C)=O",
      "inchi": "InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.071079161463821,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "79-20-9",
      "name": "methyl acetate",
      "iupac_name": "methyl acetate",
      "smiles": "COC(C)=O",
      "inchi": "InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        -0.0074540241175647,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "98-01-1",
      "name": "furfural",
      "iupac_name": "furan-2-carbaldehyde",
      "smiles": "O=Cc1ccco1",
      "inchi": "InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0572275597839442,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "98-01-1",
      "name": "furfural",
      "iupac_name": "furan-2-carbaldehyde",
      "smiles": "O=Cc1ccco1",
      "inchi": "InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0294194838649127,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-54-3",
      "name": "hexane",
      "iupac_name": "hexane",
      "smiles": "CCCCCC",
      "inchi": "InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.212030466364169,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-54-3",
      "name": "hexane",
      "iupac_name": "hexane",
      "smiles": "CCCCCC",
      "inchi": "InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0479121061032195,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-63-0",
      "name": "2-propanol",
      "iupac_name": "propan-2-ol",
      "smiles": "CC(C)O",
      "inchi": "InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0408153487915831,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-63-0",
      "name": "2-propanol",
      "iupac_name": "propan-2-ol",
      "smiles": "CC(C)O",
      "inchi": "InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.04,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-20-3",
      "name": "diisopropyl ether",
      "iupac_name": "2-propan-2-yloxypropane",
      "smiles": "CC(C)OC(C)C",
      "inchi": "InChI=1S/C6H14O/c1-5(2)7-6(3)4/h5-6H,1-4H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        1.572728413015858,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-20-3",
      "name": "diisopropyl ether",
      "iupac_name": "2-propan-2-yloxypropane",
      "smiles": "CC(C)OC(C)C",
      "inchi": "InChI=1S/C6H14O/c1-5(2)7-6(3)4/h5-6H,1-4H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0833817669557184,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-56-1",
      "name": "methanol",
      "iupac_name": "methanol",
      "smiles": "CO",
      "inchi": "InChI=1S/CH4O/c1-2/h2H,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0503912653031522,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-56-1",
      "name": "methanol",
      "iupac_name": "methanol",
      "smiles": "CO",
      "inchi": "InChI=1S/CH4O/c1-2/h2H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "109-86-4",
      "name": "2-methoxyethanol",
      "iupac_name": "2-methoxyethanol",
      "smiles": "COCCO",
      "inchi": "InChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0306859683241532,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "109-86-4",
      "name": "2-methoxyethanol",
      "iupac_name": "2-methoxyethanol",
      "smiles": "COCCO",
      "inchi": "InChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0009622869321816,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-10-1",
      "name": "4-methyl-2-pentanone",
      "iupac_name": "4-methylpentan-2-one",
      "smiles": "CC(=O)CC(C)C",
      "inchi": "InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0741349450016057,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-10-1",
      "name": "4-methyl-2-pentanone",
      "iupac_name": "4-methylpentan-2-one",
      "smiles": "CC(=O)CC(C)C",
      "inchi": "InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0652999644861665,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "78-83-1",
      "name": "2-methyl-1-propanol",
      "iupac_name": "2-methylpropan-1-ol",
      "smiles": "CC(C)CO",
      "inchi": "InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0053245987965207,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "78-83-1",
      "name": "2-methyl-1-propanol",
      "iupac_name": "2-methylpropan-1-ol",
      "smiles": "CC(C)CO",
      "inchi": "InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-52-5",
      "name": "nitromethane",
      "iupac_name": "nitromethane",
      "smiles": "C[N+](=O)[O-]",
      "inchi": "InChI=1S/CH3NO2/c1-2(3)4/h1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0158918563141996,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-52-5",
      "name": "nitromethane",
      "iupac_name": "nitromethane",
      "smiles": "C[N+](=O)[O-]",
      "inchi": "InChI=1S/CH3NO2/c1-2(3)4/h1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0058850554379144,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-65-9",
      "name": "octane",
      "iupac_name": "octane",
      "smiles": "CCCCCCCC",
      "inchi": "InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0561019637486872,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-65-9",
      "name": "octane",
      "iupac_name": "octane",
      "smiles": "CCCCCCCC",
      "inchi": "InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "95-48-7",
      "name": "2-methylphenol",
      "iupac_name": "2-methylphenol",
      "smiles": "Cc1ccccc1O",
      "inchi": "InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0044909425933456,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "95-48-7",
      "name": "2-methylphenol",
      "iupac_name": "2-methylphenol",
      "smiles": "Cc1ccccc1O",
      "inchi": "InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-41-0",
      "name": "1-pentanol",
      "iupac_name": "pentan-1-ol",
      "smiles": "CCCCCO",
      "inchi": "InChI=1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        0.0245445065310065,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-41-0",
      "name": "1-pentanol",
      "iupac_name": "pentan-1-ol",
      "smiles": "CCCCCO",
      "inchi": "InChI=1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.080919435457781,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-95-2",
      "name": "phenol",
      "iupac_name": "phenol",
      "smiles": "Oc1ccccc1",
      "inchi": "InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0043237510460301,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-95-2",
      "name": "phenol",
      "iupac_name": "phenol",
      "smiles": "Oc1ccccc1",
      "inchi": "InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0794433744731733,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-23-8",
      "name": "1-propanol",
      "iupac_name": "propan-1-ol",
      "smiles": "CCCO",
      "inchi": "InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0082028991398555,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "71-23-8",
      "name": "1-propanol",
      "iupac_name": "propan-1-ol",
      "smiles": "CCCO",
      "inchi": "InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.05,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-86-1",
      "name": "pyridine",
      "iupac_name": "pyridine",
      "smiles": "c1ccncc1",
      "inchi": "InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0875229489739675,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-86-1",
      "name": "pyridine",
      "iupac_name": "pyridine",
      "smiles": "c1ccncc1",
      "inchi": "InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0547331801617018,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-68-5",
      "name": "dimethyl sulfoxide",
      "iupac_name": "methylsulfinylmethane",
      "smiles": "CS(C)=O",
      "inchi": "InChI=1S/C2H6OS/c1-4(2)3/h1-2H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.199184159517956,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "67-68-5",
      "name": "dimethyl sulfoxide",
      "iupac_name": "methylsulfinylmethane",
      "smiles": "CS(C)=O",
      "inchi": "InChI=1S/C2H6OS/c1-4(2)3/h1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0077980380682515,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-65-0",
      "name": "tert-butanol",
      "iupac_name": "2-methylpropan-2-ol",
      "smiles": "CC(C)(C)O",
      "inchi": "InChI=1S/C4H10O/c1-4(2,3)5/h5H,1-3H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.057229115332477,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "75-65-0",
      "name": "tert-butanol",
      "iupac_name": "2-methylpropan-2-ol",
      "smiles": "CC(C)(C)O",
      "inchi": "InChI=1S/C4H10O/c1-4(2,3)5/h5H,1-3H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0628840103151057,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "109-99-9",
      "name": "tetrahydrofuran",
      "iupac_name": "oxolane",
      "smiles": "C1CCOC1",
      "inchi": "InChI=1S/C4H8O/c1-2-4-5-3-1/h1-4H2"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0629245440377394,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "109-99-9",
      "name": "tetrahydrofuran",
      "iupac_name": "oxolane",
      "smiles": "C1CCOC1",
      "inchi": "InChI=1S/C4H8O/c1-2-4-5-3-1/h1-4H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0380374954598021,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-88-3",
      "name": "toluene",
      "iupac_name": "toluene",
      "smiles": "Cc1ccccc1",
      "inchi": "InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3"
    },
    "id2": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0397171696442134,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-88-3",
      "name": "toluene",
      "iupac_name": "toluene",
      "smiles": "Cc1ccccc1",
      "inchi": "InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "108-38-3",
      "name": "m-xylene",
      "iupac_name": "1,3-xylene",
      "smiles": "Cc1cccc(C)c1",
      "inchi": "InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.0114192147625697,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "96-41-3",
      "name": "cyclopentanol",
      "iupac_name": "cyclopentanol",
      "smiles": "OC1CCCC1",
      "inchi": "InChI=1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2"
    },
    "model_record": {
      "k_ij": [
        0.066207001137456,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "79-34-5",
      "name": "1,1,2,2-tetrachloroethane",
      "iupac_name": "1,1,2,2-tetrachloroethane",
      "smiles": "ClC(Cl)C(Cl)Cl",
      "inchi": "InChI=1S/C2H2Cl4/c3-1(4)2(5)6/h1-2H"
    },
    "model_record": {
      "k_ij": [
        -0.0111081460889378,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "110-71-4",
      "name": "1,2-dimethoxyethane",
      "iupac_name": "1,2-dimethoxyethane",
      "smiles": "COCCOC",
      "inchi": "InChI=1S/C4H10O2/c1-5-3-4-6-2/h3-4H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.1207978792585483,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "127-19-5",
      "name": "n,n-dimethylacetamide",
      "iupac_name": "n,n-dimethylacetamide",
      "smiles": "CC(=O)N(C)C",
      "inchi": "InChI=1S/C4H9NO/c1-4(6)5(2)3/h1-3H3"
    },
    "model_record": {
      "k_ij": [
        -0.1740270370945236,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "107-13-1",
      "name": "acrylonitrile",
      "iupac_name": "prop-2-enenitrile",
      "smiles": "C=CC#N",
      "inchi": "InChI=1S/C3H3N/c1-2-3-4/h2H,1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0001793258373042,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "56-81-5",
      "name": "glycerol",
      "iupac_name": "propane-1,2,3-triol",
      "smiles": "OCC(O)CO",
      "inchi": "InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2"
    },
    "model_record": {
      "k_ij": [
        -0.0132071917610433,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "109-60-4",
      "name": "propyl acetate",
      "iupac_name": "propyl acetate",
      "smiles": "CCCOC(C)=O",
      "inchi": "InChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.0680869166088541,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "108-94-1",
      "name": "cyclohexanone",
      "iupac_name": "cyclohexanone",
      "smiles": "O=C1CCCCC1",
      "inchi": "InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2"
    },
    "model_record": {
      "k_ij": [
        -0.0630335891254524,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "108-93-0",
      "name": "cyclohexanol",
      "iupac_name": "cyclohexanol",
      "smiles": "OC1CCCCC1",
      "inchi": "InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2"
    },
    "model_record": {
      "k_ij": [
        0.0682459972739822,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "80-62-6",
      "name": "methacrylic acid methyl ester",
      "iupac_name": "methyl 2-methylprop-2-enoate",
      "smiles": "C=C(C)C(=O)OC",
      "inchi": "InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3"
    },
    "model_record": {
      "k_ij": [
        -0.0671514728669884,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "123-51-3",
      "name": "3-methyl-1-butanol",
      "iupac_name": "3-methylbutan-1-ol",
      "smiles": "CC(C)CCO",
      "inchi": "InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0157469119045368,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "110-80-5",
      "name": "2-ethoxyethanol",
      "iupac_name": "2-ethoxyethanol",
      "smiles": "CCOCCO",
      "inchi": "InChI=1S/C4H10O2/c1-2-6-4-3-5/h5H,2-4H2,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0277279472017205,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "57-55-6",
      "name": "1,2-propanediol",
      "iupac_name": "propane-1,2-diol",
      "smiles": "CC(O)CO",
      "inchi": "InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.035643334842014,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "872-50-4",
      "name": "n-methyl-2-pyrrolidone",
      "iupac_name": "1-methylpyrrolidin-2-one",
      "smiles": "CN1CCCC1=O",
      "inchi": "InChI=1S/C5H9NO/c1-6-4-2-3-5(6)7/h2-4H2,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.1576731559074739,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "96-22-0",
      "name": "3-pentanone",
      "iupac_name": "pentan-3-one",
      "smiles": "CCC(=O)CC",
      "inchi": "InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.067426810422139,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "107-31-3",
      "name": "methyl formate",
      "iupac_name": "methyl formate",
      "smiles": "COC=O",
      "inchi": "InChI=1S/C2H4O2/c1-4-2-3/h2H,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0493133503887849,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "111-27-3",
      "name": "1-hexanol",
      "iupac_name": "hexan-1-ol",
      "smiles": "CCCCCCO",
      "inchi": "InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3"
    },
    "model_record": {
      "k_ij": [
        0.017493851087585,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "123-72-8",
      "name": "butyraldehyde",
      "iupac_name": "butanal",
      "smiles": "CCCC=O",
      "inchi": "InChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0700142632117565,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "140-88-5",
      "name": "2-propenoic acid ethyl ester",
      "iupac_name": "ethyl prop-2-enoate",
      "smiles": "C=CC(=O)OCC",
      "inchi": "InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3"
    },
    "model_record": {
      "k_ij": [
        -0.0482511377211992,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "95-47-6",
      "name": "o-xylene",
      "iupac_name": "1,2-xylene",
      "smiles": "Cc1ccccc1C",
      "inchi": "InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.0458434489204334,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "107-12-0",
      "name": "propionitrile",
      "iupac_name": "propanenitrile",
      "smiles": "CCC#N",
      "inchi": "InChI=1S/C3H5N/c1-2-3-4/h2H2,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0371394692548659,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "98-85-1",
      "name": "alpha.-phenylethanol",
      "iupac_name": "1-phenylethanol",
      "smiles": "CC(O)c1ccccc1",
      "inchi": "InChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0027349650234592,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "111-87-5",
      "name": "1-octanol",
      "iupac_name": "octan-1-ol",
      "smiles": "CCCCCCCCO",
      "inchi": "InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3"
    },
    "model_record": {
      "k_ij": [
        0.0531844623337508,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "98-86-2",
      "name": "acetophenone",
      "iupac_name": "1-phenylethanone",
      "smiles": "CC(=O)c1ccccc1",
      "inchi": "InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0493935357163134,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "104-76-7",
      "name": "2-ethyl-1-hexanol",
      "iupac_name": "2-ethylhexan-1-ol",
      "smiles": "CCCCC(CC)CO",
      "inchi": "InChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0532762365375429,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "108-21-4",
      "name": "acetic acid isopropyl ester",
      "iupac_name": "propan-2-yl acetate",
      "smiles": "CC(=O)OC(C)C",
      "inchi": "InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3"
    },
    "model_record": {
      "k_ij": [
        -0.0950461951193546,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "554-12-1",
      "name": "methyl propanoate",
      "iupac_name": "methyl propanoate",
      "smiles": "CCC(=O)OC",
      "inchi": "InChI=1S/C4H8O2/c1-3-4(5)6-2/h3H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.0933955669519829,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "628-63-7",
      "name": "amyl acetate",
      "iupac_name": "pentyl acetate",
      "smiles": "CCCCCOC(C)=O",
      "inchi": "InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.1066767608579135,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "109-21-7",
      "name": "butanoic acid butyl ester",
      "iupac_name": "butyl butanoate",
      "smiles": "CCCCOC(=O)CCC",
      "inchi": "InChI=1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.0935602652981689,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "91-22-5",
      "name": "quinoline",
      "iupac_name": "quinoline",
      "smiles": "c1ccc2ncccc2c1",
      "inchi": "InChI=1S/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7H"
    },
    "model_record": {
      "k_ij": [
        -0.0655561544833401,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "112-27-6",
      "name": "triethylene glycol",
      "iupac_name": "2-[2-(2-hydroxyethoxy)ethoxy]ethanol",
      "smiles": "OCCOCCOCCO",
      "inchi": "InChI=1S/C6H14O4/c7-1-3-9-5-6-10-4-2-8/h7-8H,1-6H2"
    },
    "model_record": {
      "k_ij": [
        -0.1097060099253249,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "111-77-3",
      "name": "diethylene glycol monomethyl ether",
      "iupac_name": "2-(2-methoxyethoxy)ethanol",
      "smiles": "COCCOCCO",
      "inchi": "InChI=1S/C5H12O3/c1-7-4-5-8-3-2-6/h6H,2-5H2,1H3"
    },
    "model_record": {
      "k_ij": [
        0.0237595677426331,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "111-90-0",
      "name": "diethylene glycol ethyl ether",
      "iupac_name": "2-(2-ethoxyethoxy)ethanol",
      "smiles": "CCOCCOCCO",
      "inchi": "InChI=1S/C6H14O3/c1-2-8-5-6-9-4-3-7/h7H,2-6H2,1H3"
    },
    "model_record": {
      "k_ij": [
        0.063611503195327,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "111-46-6",
      "name": "diethylene glycol",
      "iupac_name": "2-(2-hydroxyethoxy)ethanol",
      "smiles": "OCCOCCO",
      "inchi": "InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2"
    },
    "model_record": {
      "k_ij": [
        -0.0804165481756873,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "544-76-3",
      "name": "hexadecane",
      "iupac_name": "hexadecane",
      "smiles": "CCCCCCCCCCCCCCCC",
      "inchi": "InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0016218700511285,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "126-33-0",
      "name": "sulfolane",
      "iupac_name": "thiolane 1,1-dioxide",
      "smiles": "O=S1(=O)CCCC1",
      "inchi": "InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2"
    },
    "model_record": {
      "k_ij": [
        -0.0739586760276745,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "115-10-6",
      "name": "dimethyl ether",
      "iupac_name": "methoxymethane",
      "smiles": "COC",
      "inchi": "InChI=1S/C2H6O/c1-3-2/h1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "96-48-0",
      "name": "gamma-butyrolactone",
      "iupac_name": "oxolan-2-one",
      "smiles": "O=C1CCCO1",
      "inchi": "InChI=1S/C4H6O2/c5-4-2-1-3-6-4/h1-3H2"
    },
    "model_record": {
      "k_ij": [
        -0.0589165335043665,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "137-32-6",
      "name": "2-methyl-1-butanol",
      "iupac_name": "2-methylbutan-1-ol",
      "smiles": "CCC(C)CO",
      "inchi": "InChI=1S/C5H12O/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0027548615527647,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "6032-29-7",
      "name": "2-pentanol",
      "iupac_name": "pentan-2-ol",
      "smiles": "CCCC(C)O",
      "inchi": "InChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0082286971090173,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "93-89-0",
      "name": "ethyl benzoate",
      "iupac_name": "ethyl benzoate",
      "smiles": "CCOC(=O)c1ccccc1",
      "inchi": "InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0285840358447793,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "108-32-7",
      "name": "propylene carbonate",
      "iupac_name": "4-methyl-1,3-dioxolan-2-one",
      "smiles": "CC1COC(=O)O1",
      "inchi": "InChI=1S/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3"
    },
    "model_record": {
      "k_ij": [
        -0.0350979093212003,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "142-68-7",
      "name": "tetrahydropyran",
      "iupac_name": "oxane",
      "smiles": "C1CCOCC1",
      "inchi": "InChI=1S/C5H10O/c1-2-4-6-5-3-1/h1-5H2"
    },
    "model_record": {
      "k_ij": [
        -0.0893462704912775,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "95-50-1",
      "name": "o-dichlorobenzene",
      "iupac_name": "1,2-dichlorobenzene",
      "smiles": "Clc1ccccc1Cl",
      "inchi": "InChI=1S/C6H4Cl2/c7-5-3-1-2-4-6(5)8/h1-4H"
    },
    "model_record": {
      "k_ij": [
        -0.0374590290661321,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "90-05-1",
      "name": "2-methoxyphenol",
      "iupac_name": "2-methoxyphenol",
      "smiles": "COc1ccccc1O",
      "inchi": "InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3"
    },
    "model_record": {
      "k_ij": [
        0.0712886038173356,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "111-96-6",
      "name": "diethylene glycol dimethyl ether",
      "iupac_name": "1-methoxy-2-(2-methoxyethoxy)ethane",
      "smiles": "COCCOCCOC",
      "inchi": "InChI=1S/C6H14O3/c1-7-3-5-9-6-4-8-2/h3-6H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.1333336534246509,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "75-46-7",
      "name": "fluoroform [r23]",
      "iupac_name": "fluoroform",
      "smiles": "FC(F)F",
      "inchi": "InChI=1S/CHF3/c2-1(3)4/h1H"
    },
    "model_record": {
      "k_ij": [
        -0.0536500689208833,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "75-89-8",
      "name": "2,2,2-trifluoroethanol",
      "iupac_name": "2,2,2-trifluoroethanol",
      "smiles": "OCC(F)(F)F",
      "inchi": "InChI=1S/C2H3F3O/c3-2(4,5)1-6/h6H,1H2"
    },
    "model_record": {
      "k_ij": [
        -0.0356478435848886,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "126-73-8",
      "name": "tributyl phosphate",
      "iupac_name": "tributyl phosphate",
      "smiles": "CCCCOP(=O)(OCCCC)OCCCC",
      "inchi": "InChI=1S/C12H27O4P/c1-4-7-10-14-17(13,15-11-8-5-2)16-12-9-6-3/h4-12H2,1-3H3"
    },
    "model_record": {
      "k_ij": [
        -0.210411963479296,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "109-97-7",
      "name": "pyrrole",
      "iupac_name": "1h-pyrrole",
      "smiles": "c1cc[nH]c1",
      "inchi": "InChI=1S/C4H5N/c1-2-4-5-3-1/h1-5H"
    },
    "model_record": {
      "k_ij": [
        -0.0281484510148058,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "96-49-1",
      "name": "ethylene carbonate",
      "iupac_name": "1,3-dioxolan-2-one",
      "smiles": "O=C1OCCO1",
      "inchi": "InChI=1S/C3H4O3/c4-3-5-1-2-6-3/h1-2H2"
    },
    "model_record": {
      "k_ij": [
        -0.0049813457218044,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "143-24-8",
      "name": "tetraethylene glycol dimethyl ether",
      "iupac_name": "1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane",
      "smiles": "COCCOCCOCCOCCOC",
      "inchi": "InChI=1S/C10H22O5/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2/h3-10H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        -0.1313051701143411,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "547-64-8",
      "name": "methyl lactate",
      "iupac_name": "methyl 2-hydroxypropanoate",
      "smiles": "COC(=O)C(C)O",
      "inchi": "InChI=1S/C4H8O3/c1-3(5)4(6)7-2/h3,5H,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0065998646975817,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "7732-18-5",
      "name": "water",
      "iupac_name": "oxidane",
      "smiles": "O",
      "inchi": "InChI=1S/H2O/h1H2"
    },
    "id2": {
      "cas": "97-64-3",
      "name": "ethyl lactate",
      "iupac_name": "ethyl 2-hydroxypropanoate",
      "smiles": "CCOC(=O)C(C)O",
      "inchi": "InChI=1S/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0714060888978248,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-38-3",
      "name": "m-xylene",
      "iupac_name": "1,3-xylene",
      "smiles": "Cc1cccc(C)c1",
      "inchi": "InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.00205569387377,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "96-41-3",
      "name": "cyclopentanol",
      "iupac_name": "cyclopentanol",
      "smiles": "OC1CCCC1",
      "inchi": "InChI=1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1677001434351702,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "79-34-5",
      "name": "1,1,2,2-tetrachloroethane",
      "iupac_name": "1,1,2,2-tetrachloroethane",
      "smiles": "ClC(Cl)C(Cl)Cl",
      "inchi": "InChI=1S/C2H2Cl4/c3-1(4)2(5)6/h1-2H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0734757324507478,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-71-4",
      "name": "1,2-dimethoxyethane",
      "iupac_name": "1,2-dimethoxyethane",
      "smiles": "COCCOC",
      "inchi": "InChI=1S/C4H10O2/c1-5-3-4-6-2/h3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        -0.0921522975793166,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "127-19-5",
      "name": "n,n-dimethylacetamide",
      "iupac_name": "n,n-dimethylacetamide",
      "smiles": "CC(=O)N(C)C",
      "inchi": "InChI=1S/C4H9NO/c1-4(6)5(2)3/h1-3H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0281526772954842,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-13-1",
      "name": "acrylonitrile",
      "iupac_name": "prop-2-enenitrile",
      "smiles": "C=CC#N",
      "inchi": "InChI=1S/C3H3N/c1-2-3-4/h2H,1H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0541603269733913,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "56-81-5",
      "name": "glycerol",
      "iupac_name": "propane-1,2,3-triol",
      "smiles": "OCC(O)CO",
      "inchi": "InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1361448159131787,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "109-60-4",
      "name": "propyl acetate",
      "iupac_name": "propyl acetate",
      "smiles": "CCCOC(C)=O",
      "inchi": "InChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0180766961671895,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-94-1",
      "name": "cyclohexanone",
      "iupac_name": "cyclohexanone",
      "smiles": "O=C1CCCCC1",
      "inchi": "InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0668736626895395,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-93-0",
      "name": "cyclohexanol",
      "iupac_name": "cyclohexanol",
      "smiles": "OC1CCCCC1",
      "inchi": "InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "80-62-6",
      "name": "methacrylic acid methyl ester",
      "iupac_name": "methyl 2-methylprop-2-enoate",
      "smiles": "C=C(C)C(=O)OC",
      "inchi": "InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0087065078497441,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "123-51-3",
      "name": "3-methyl-1-butanol",
      "iupac_name": "3-methylbutan-1-ol",
      "smiles": "CC(C)CCO",
      "inchi": "InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0627748918563876,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "110-80-5",
      "name": "2-ethoxyethanol",
      "iupac_name": "2-ethoxyethanol",
      "smiles": "CCOCCO",
      "inchi": "InChI=1S/C4H10O2/c1-2-6-4-3-5/h5H,2-4H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.039798823992022,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "57-55-6",
      "name": "1,2-propanediol",
      "iupac_name": "propane-1,2-diol",
      "smiles": "CC(O)CO",
      "inchi": "InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0606017367649909,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "872-50-4",
      "name": "n-methyl-2-pyrrolidone",
      "iupac_name": "1-methylpyrrolidin-2-one",
      "smiles": "CN1CCCC1=O",
      "inchi": "InChI=1S/C5H9NO/c1-6-4-2-3-5(6)7/h2-4H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.046249534480888,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "96-22-0",
      "name": "3-pentanone",
      "iupac_name": "pentan-3-one",
      "smiles": "CCC(=O)CC",
      "inchi": "InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0546742952361146,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-31-3",
      "name": "methyl formate",
      "iupac_name": "methyl formate",
      "smiles": "COC=O",
      "inchi": "InChI=1S/C2H4O2/c1-4-2-3/h2H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        -0.0820404699106444,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-27-3",
      "name": "1-hexanol",
      "iupac_name": "hexan-1-ol",
      "smiles": "CCCCCCO",
      "inchi": "InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0505183207940796,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "123-72-8",
      "name": "butyraldehyde",
      "iupac_name": "butanal",
      "smiles": "CCCC=O",
      "inchi": "InChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.048883320301424,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "140-88-5",
      "name": "2-propenoic acid ethyl ester",
      "iupac_name": "ethyl prop-2-enoate",
      "smiles": "C=CC(=O)OCC",
      "inchi": "InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0492958189207969,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "95-47-6",
      "name": "o-xylene",
      "iupac_name": "1,2-xylene",
      "smiles": "Cc1ccccc1C",
      "inchi": "InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0549465606806672,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "107-12-0",
      "name": "propionitrile",
      "iupac_name": "propanenitrile",
      "smiles": "CCC#N",
      "inchi": "InChI=1S/C3H5N/c1-2-3-4/h2H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0726155400727583,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "98-85-1",
      "name": "alpha.-phenylethanol",
      "iupac_name": "1-phenylethanol",
      "smiles": "CC(O)c1ccccc1",
      "inchi": "InChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.001729209404429,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-87-5",
      "name": "1-octanol",
      "iupac_name": "octan-1-ol",
      "smiles": "CCCCCCCCO",
      "inchi": "InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1168032688467164,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "98-86-2",
      "name": "acetophenone",
      "iupac_name": "1-phenylethanone",
      "smiles": "CC(=O)c1ccccc1",
      "inchi": "InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.073430985784991,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "104-76-7",
      "name": "2-ethyl-1-hexanol",
      "iupac_name": "2-ethylhexan-1-ol",
      "smiles": "CCCCC(CC)CO",
      "inchi": "InChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0241891125993619,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-21-4",
      "name": "acetic acid isopropyl ester",
      "iupac_name": "propan-2-yl acetate",
      "smiles": "CC(=O)OC(C)C",
      "inchi": "InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0213860935828283,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "554-12-1",
      "name": "methyl propanoate",
      "iupac_name": "methyl propanoate",
      "smiles": "CCC(=O)OC",
      "inchi": "InChI=1S/C4H8O2/c1-3-4(5)6-2/h3H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0307552828359581,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "628-63-7",
      "name": "amyl acetate",
      "iupac_name": "pentyl acetate",
      "smiles": "CCCCCOC(C)=O",
      "inchi": "InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "109-21-7",
      "name": "butanoic acid butyl ester",
      "iupac_name": "butyl butanoate",
      "smiles": "CCCCOC(=O)CCC",
      "inchi": "InChI=1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0699657981829007,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "91-22-5",
      "name": "quinoline",
      "iupac_name": "quinoline",
      "smiles": "c1ccc2ncccc2c1",
      "inchi": "InChI=1S/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0495868556431497,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "112-27-6",
      "name": "triethylene glycol",
      "iupac_name": "2-[2-(2-hydroxyethoxy)ethoxy]ethanol",
      "smiles": "OCCOCCOCCO",
      "inchi": "InChI=1S/C6H14O4/c7-1-3-9-5-6-10-4-2-8/h7-8H,1-6H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1854881410780541,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-77-3",
      "name": "diethylene glycol monomethyl ether",
      "iupac_name": "2-(2-methoxyethoxy)ethanol",
      "smiles": "COCCOCCO",
      "inchi": "InChI=1S/C5H12O3/c1-7-4-5-8-3-2-6/h6H,2-5H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1854573801137602,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-90-0",
      "name": "diethylene glycol ethyl ether",
      "iupac_name": "2-(2-ethoxyethoxy)ethanol",
      "smiles": "CCOCCOCCO",
      "inchi": "InChI=1S/C6H14O3/c1-2-8-5-6-9-4-3-7/h7H,2-6H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.3107127255087356,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-46-6",
      "name": "diethylene glycol",
      "iupac_name": "2-(2-hydroxyethoxy)ethanol",
      "smiles": "OCCOCCO",
      "inchi": "InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.190431958074146,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "544-76-3",
      "name": "hexadecane",
      "iupac_name": "hexadecane",
      "smiles": "CCCCCCCCCCCCCCCC",
      "inchi": "InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "126-33-0",
      "name": "sulfolane",
      "iupac_name": "thiolane 1,1-dioxide",
      "smiles": "O=S1(=O)CCCC1",
      "inchi": "InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0489050805873503,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "115-10-6",
      "name": "dimethyl ether",
      "iupac_name": "methoxymethane",
      "smiles": "COC",
      "inchi": "InChI=1S/C2H6O/c1-3-2/h1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.008164978984522,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "96-48-0",
      "name": "gamma-butyrolactone",
      "iupac_name": "oxolan-2-one",
      "smiles": "O=C1CCCO1",
      "inchi": "InChI=1S/C4H6O2/c5-4-2-1-3-6-4/h1-3H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0256890798138157,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "137-32-6",
      "name": "2-methyl-1-butanol",
      "iupac_name": "2-methylbutan-1-ol",
      "smiles": "CCC(C)CO",
      "inchi": "InChI=1S/C5H12O/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1052467473544215,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "6032-29-7",
      "name": "2-pentanol",
      "iupac_name": "pentan-2-ol",
      "smiles": "CCCC(C)O",
      "inchi": "InChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0395129281575886,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "93-89-0",
      "name": "ethyl benzoate",
      "iupac_name": "ethyl benzoate",
      "smiles": "CCOC(=O)c1ccccc1",
      "inchi": "InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0890292191659756,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "108-32-7",
      "name": "propylene carbonate",
      "iupac_name": "4-methyl-1,3-dioxolan-2-one",
      "smiles": "CC1COC(=O)O1",
      "inchi": "InChI=1S/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.000715415324383,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "142-68-7",
      "name": "tetrahydropyran",
      "iupac_name": "oxane",
      "smiles": "C1CCOCC1",
      "inchi": "InChI=1S/C5H10O/c1-2-4-6-5-3-1/h1-5H2"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0622139656439586,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "95-50-1",
      "name": "o-dichlorobenzene",
      "iupac_name": "1,2-dichlorobenzene",
      "smiles": "Clc1ccccc1Cl",
      "inchi": "InChI=1S/C6H4Cl2/c7-5-3-1-2-4-6(5)8/h1-4H"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.1110143805175172,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "90-05-1",
      "name": "2-methoxyphenol",
      "iupac_name": "2-methoxyphenol",
      "smiles": "COc1ccccc1O",
      "inchi": "InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0197582314205109,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "111-96-6",
      "name": "diethylene glycol dimethyl ether",
      "iupac_name": "1-methoxy-2-(2-methoxyethoxy)ethane",
      "smiles": "COCCOCCOC",
      "inchi": "InChI=1S/C6H14O3/c1-7-3-5-9-6-4-8-2/h3-6H2,1-2H3"
    },
    "id2": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "model_record": {
      "k_ij": [
        0.0420846662268638,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "75-46-7",
      "name": "fluoroform [r23]",
      "iupac_name": "fluoroform",
      "smiles": "FC(F)F",
      "inchi": "InChI=1S/CHF3/c2-1(3)4/h1H"
    },
    "model_record": {
      "k_ij": [
        0.0116563255625742,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "75-89-8",
      "name": "2,2,2-trifluoroethanol",
      "iupac_name": "2,2,2-trifluoroethanol",
      "smiles": "OCC(F)(F)F",
      "inchi": "InChI=1S/C2H3F3O/c3-2(4,5)1-6/h6H,1H2"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "126-73-8",
      "name": "tributyl phosphate",
      "iupac_name": "tributyl phosphate",
      "smiles": "CCCCOP(=O)(OCCCC)OCCCC",
      "inchi": "InChI=1S/C12H27O4P/c1-4-7-10-14-17(13,15-11-8-5-2)16-12-9-6-3/h4-12H2,1-3H3"
    },
    "model_record": {
      "k_ij": [
        0.0581051176824191,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "109-97-7",
      "name": "pyrrole",
      "iupac_name": "1h-pyrrole",
      "smiles": "c1cc[nH]c1",
      "inchi": "InChI=1S/C4H5N/c1-2-4-5-3-1/h1-5H"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "96-49-1",
      "name": "ethylene carbonate",
      "iupac_name": "1,3-dioxolan-2-one",
      "smiles": "O=C1OCCO1",
      "inchi": "InChI=1S/C3H4O3/c4-3-5-1-2-6-3/h1-2H2"
    },
    "model_record": {
      "k_ij": [
        -0.0051887916765761,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "143-24-8",
      "name": "tetraethylene glycol dimethyl ether",
      "iupac_name": "1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane",
      "smiles": "COCCOCCOCCOCCOC",
      "inchi": "InChI=1S/C10H22O5/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2/h3-10H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0311154631841018,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "547-64-8",
      "name": "methyl lactate",
      "iupac_name": "methyl 2-hydroxypropanoate",
      "smiles": "COC(=O)C(C)O",
      "inchi": "InChI=1S/C4H8O3/c1-3(5)4(6)7-2/h3,5H,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  },
  {
    "id1": {
      "cas": "124-38-9",
      "name": "carbon dioxide",
      "iupac_name": "carbon dioxide",
      "smiles": "O=C=O",
      "inchi": "InChI=1S/CO2/c2-1-3"
    },
    "id2": {
      "cas": "97-64-3",
      "name": "ethyl lactate",
      "iupac_name": "ethyl 2-hydroxypropanoate",
      "smiles": "CCOC(=O)C(C)O",
      "inchi": "InChI=1S/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3"
    },
    "model_record": {
      "k_ij": [
        0.0,
        0,
        0,
        0
      ]
    }
  }
]