PC-Compounds ::= {
  {
    id {
      id cid 60196381
    },
    atoms {
      aid {
        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
        16,
        17,
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        20,
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        28,
        29,
        30,
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        40,
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        48,
        49,
        50,
        51,
        52,
        53,
        54,
        55,
        56,
        57,
        58,
        59,
        60,
        61,
        62
      },
      element {
        p,
        f,
        f,
        f,
        f,
        f,
        f,
        n,
        n,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      },
      charge {
        {
          aid 1,
          value -1
        },
        {
          aid 9,
          value 1
        }
      }
    },
    bonds {
      aid1 {
        1,
        1,
        1,
        1,
        1,
        1,
        8,
        8,
        8,
        9,
        9,
        9,
        10,
        10,
        10,
        10,
        11,
        11,
        11,
        12,
        12,
        12,
        13,
        13,
        13,
        14,
        14,
        14,
        15,
        15,
        15,
        16,
        16,
        16,
        17,
        17,
        17,
        18,
        18,
        18,
        19,
        19,
        19,
        20,
        20,
        21,
        21,
        21,
        22,
        22,
        22,
        23,
        24,
        24,
        25,
        25,
        25,
        26,
        27,
        27,
        27
      },
      aid2 {
        2,
        3,
        4,
        5,
        6,
        7,
        20,
        23,
        24,
        23,
        26,
        27,
        11,
        12,
        28,
        29,
        13,
        30,
        31,
        14,
        32,
        33,
        15,
        34,
        35,
        16,
        36,
        37,
        17,
        38,
        39,
        18,
        40,
        41,
        19,
        42,
        43,
        20,
        44,
        45,
        21,
        46,
        47,
        48,
        49,
        22,
        50,
        51,
        25,
        52,
        53,
        54,
        26,
        55,
        56,
        57,
        58,
        59,
        60,
        61,
        62
      },
      order {
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    coords {
      {
        type {
          twod,
          computed,
          units-unknown
        },
        aid {
          1,
          2,
          3,
          4,
          5,
          6,
          7,
          8,
          9,
          10,
          11,
          12,
          13,
          14,
          15,
          16,
          17,
          18,
          19,
          20,
          21,
          22,
          23,
          24,
          25,
          26,
          27,
          28,
          29,
          30,
          31,
          32,
          33,
          34,
          35,
          36,
          37,
          38,
          39,
          40,
          41,
          42,
          43,
          44,
          45,
          46,
          47,
          48,
          49,
          50,
          51,
          52,
          53,
          54,
          55,
          56,
          57,
          58,
          59,
          60,
          61,
          62
        },
        conformers {
          {
            x {
              { 110545, 10, -4 },
              { 119205, 10, -4 },
              { 101885, 10, -4 },
              { 101885, 10, -4 },
              { 110545, 10, -4 },
              { 110545, 10, -4 },
              { 119205, 10, -4 },
              { 65991, 10, -4 },
              { 70991, 10, -4 },
              { 4001, 10, -3 },
              { 4001, 10, -3 },
              { 48671, 10, -4 },
              { 3135, 10, -3 },
              { 48671, 10, -4 },
              { 3135, 10, -3 },
              { 57331, 10, -4 },
              { 2269, 10, -3 },
              { 57331, 10, -4 },
              { 2269, 10, -3 },
              { 65991, 10, -4 },
              { 1403, 10, -3 },
              { 1403, 10, -3 },
              { 74081, 10, -4 },
              { 57901, 10, -4 },
              { 5369, 10, -4 },
              { 60991, 10, -4 },
              { 76869, 10, -4 },
              { 3789, 10, -3 },
              { 33905, 10, -4 },
              { 42131, 10, -4 },
              { 46116, 10, -4 },
              { 50791, 10, -4 },
              { 54776, 10, -4 },
              { 2923, 10, -3 },
              { 25244, 10, -4 },
              { 4655, 10, -3 },
              { 42565, 10, -4 },
              { 33471, 10, -4 },
              { 37456, 10, -4 },
              { 59451, 10, -4 },
              { 63437, 10, -4 },
              { 20569, 10, -4 },
              { 16584, 10, -4 },
              { 5521, 10, -3 },
              { 51225, 10, -4 },
              { 2481, 10, -3 },
              { 28796, 10, -4 },
              { 68112, 10, -4 },
              { 72097, 10, -4 },
              { 11909, 10, -4 },
              { 7924, 10, -4 },
              { 1615, 10, -3 },
              { 20135, 10, -4 },
              { 79978, 10, -4 },
              { 52004, 10, -4 },
              { 2269, 10, -4 },
              { 0, 10, 0 },
              { 8469, 10, -4 },
              { 57347, 10, -4 },
              { 81885, 10, -4 },
              { 80513, 10, -4 },
              { 71853, 10, -4 }
            },
            y {
              { 69432, 10, -4 },
              { 74432, 10, -4 },
              { 64432, 10, -4 },
              { 74432, 10, -4 },
              { 59432, 10, -4 },
              { 79432, 10, -4 },
              { 64432, 10, -4 },
              { 110369, 10, -4 },
              { 125758, 10, -4 },
              { 65369, 10, -4 },
              { 55369, 10, -4 },
              { 70369, 10, -4 },
              { 50369, 10, -4 },
              { 80369, 10, -4 },
              { 40369, 10, -4 },
              { 85369, 10, -4 },
              { 35369, 10, -4 },
              { 95369, 10, -4 },
              { 25369, 10, -4 },
              { 100369, 10, -4 },
              { 20369, 10, -4 },
              { 10369, 10, -4 },
              { 116247, 10, -4 },
              { 116247, 10, -4 },
              { 5369, 10, -4 },
              { 125758, 10, -4 },
              { 133848, 10, -4 },
              { 71195, 10, -4 },
              { 64293, 10, -4 },
              { 49543, 10, -4 },
              { 56446, 10, -4 },
              { 64543, 10, -4 },
              { 71446, 10, -4 },
              { 56195, 10, -4 },
              { 49293, 10, -4 },
              { 86195, 10, -4 },
              { 79293, 10, -4 },
              { 34543, 10, -4 },
              { 41446, 10, -4 },
              { 79543, 10, -4 },
              { 86446, 10, -4 },
              { 41195, 10, -4 },
              { 34293, 10, -4 },
              { 101195, 10, -4 },
              { 94293, 10, -4 },
              { 19543, 10, -4 },
              { 26446, 10, -4 },
              { 94543, 10, -4 },
              { 101446, 10, -4 },
              { 26196, 10, -4 },
              { 19293, 10, -4 },
              { 4543, 10, -4 },
              { 11446, 10, -4 },
              { 114331, 10, -4 },
              { 114331, 10, -4 },
              { 10739, 10, -4 },
              { 2269, 10, -4 },
              { 0, 10, 0 },
              { 130774, 10, -4 },
              { 130204, 10, -4 },
              { 138864, 10, -4 },
              { 137492, 10, -4 }
            },
            style {
              annotation {
                aromatic,
                aromatic,
                aromatic,
                aromatic,
                aromatic
              },
              aid1 {
                8,
                8,
                9,
                9,
                24
              },
              aid2 {
                23,
                24,
                23,
                26,
                26
              }
            }
          }
        }
      }
    },
    charge 0,
    props {
      {
        urn {
          label "Compound",
          name "Canonicalized",
          datatype uint,
          release "2012.05.21"
        },
        value ival 1
      },
      {
        urn {
          label "Compound Complexity",
          datatype double,
          implementation "E_COMPLEXITY",
          version "3.4.6.11",
          software "Cactvs",
          source "xemistry.com",
          release "2019.06.18"
        },
        value fval { 268, 10, 0 }
      },
      {
        urn {
          label "Count",
          name "Hydrogen Bond Acceptor",
          datatype uint,
          implementation "E_NHACCEPTORS",
          version "3.4.6.11",
          software "Cactvs",
          source "xemistry.com",
          release "2019.06.18"
        },
        value ival 7
      },
      {
        urn {
          label "Count",
          name "Hydrogen Bond Donor",
          datatype uint,
          implementation "E_NHDONORS",
          version "3.4.6.11",
          software "Cactvs",
          source "xemistry.com",
          release "2019.06.18"
        },
        value ival 0
      },
      {
        urn {
          label "Count",
          name "Rotatable Bond",
          datatype uint,
          implementation "E_NROTBONDS",
          version "3.4.6.11",
          software "Cactvs",
          source "xemistry.com",
          release "2019.06.18"
        },
        value ival 13
      },
      {
        urn {
          label "Fingerprint",
          name "SubStructure Keys",
          datatype fingerprint,
          parameters "extended 2",
          implementation "E_SCREEN",
          version "3.4.6.11",
          software "Cactvs",
          source "xemistry.com",
          release "2019.06.18"
        },
        value binary '00000371F07B01C20000000000000000000000000001600000000000
00000000000000018000001C00000008000800C102042F90170C1000A0001027640000802D1112
A00940001830008048020088001400000800028000211080800000000000000000000000000000
000000000000000000'H
      },
      {
        urn {
          label "IUPAC Name",
          name "Allowed",
          datatype string,
          version "2.6.6",
          software "LexiChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "1-methyl-3-tetradecyl-imidazol-1-ium;hexafluorophosphate"
      },
      {
        urn {
          label "IUPAC Name",
          name "CAS-like Style",
          datatype string,
          version "2.6.6",
          software "LexiChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "1-methyl-3-tetradecylimidazol-1-ium;hexafluorophosphate"
      },
      {
        urn {
          label "IUPAC Name",
          name "Markup",
          datatype string,
          version "2.6.6",
          software "LexiChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "1-methyl-3-tetradecylimidazol-1-ium;hexafluorophosphate"
      },
      {
        urn {
          label "IUPAC Name",
          name "Preferred",
          datatype string,
          version "2.6.6",
          software "LexiChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "1-methyl-3-tetradecylimidazol-1-ium;hexafluorophosphate"
      },
      {
        urn {
          label "IUPAC Name",
          name "Systematic",
          datatype string,
          version "2.6.6",
          software "LexiChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "1-methyl-3-tetradecyl-imidazol-1-ium;hexafluorophosphate"
      },
      {
        urn {
          label "IUPAC Name",
          name "Traditional",
          datatype string,
          version "2.6.6",
          software "LexiChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "1-methyl-3-myristyl-imidazol-1-ium;hexafluorophosphate"
      },
      {
        urn {
          label "InChI",
          name "Standard",
          datatype string,
          version "1.0.5",
          software "InChI",
          source "iupac.org",
          release "2019.06.18"
        },
        value sval "InChI=1S/C18H35N2.F6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-2
0-17-16-19(2)18-20;1-7(2,3,4,5)6/h16-18H,3-15H2,1-2H3;/q+1;-1"
      },
      {
        urn {
          label "InChIKey",
          name "Standard",
          datatype string,
          version "1.0.5",
          software "InChI",
          source "iupac.org",
          release "2019.06.18"
        },
        value sval "VYARLXKWHFGQBN-UHFFFAOYSA-N"
      },
      {
        urn {
          label "Mass",
          name "Exact",
          datatype string,
          version "2.1",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2021.05.07"
        },
        value sval "424.24420510"
      },
      {
        urn {
          label "Molecular Formula",
          datatype string,
          version "2.1",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2019.06.18"
        },
        value sval "C18H35F6N2P"
      },
      {
        urn {
          label "Molecular Weight",
          datatype string,
          version "2.1",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2021.05.07"
        },
        value sval "424.4"
      },
      {
        urn {
          label "SMILES",
          name "Canonical",
          datatype string,
          version "2.1.5",
          software "OEChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "CCCCCCCCCCCCCCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)F"
      },
      {
        urn {
          label "SMILES",
          name "Isomeric",
          datatype string,
          version "2.1.5",
          software "OEChem",
          source "openeye.com",
          release "2019.06.18"
        },
        value sval "CCCCCCCCCCCCCCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)F"
      },
      {
        urn {
          label "Topological",
          name "Polar Surface Area",
          datatype double,
          implementation "E_TPSA",
          version "3.4.6.11",
          software "Cactvs",
          source "xemistry.com",
          release "2019.06.18"
        },
        value fval { 88, 10, -1 }
      },
      {
        urn {
          label "Weight",
          name "MonoIsotopic",
          datatype string,
          version "2.1",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2021.05.07"
        },
        value sval "424.24420510"
      }
    },
    count {
      heavy-atom 27,
      atom-chiral 0,
      atom-chiral-def 0,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 2,
      tautomers -1
    }
  }
}