PC-Compounds ::= {
  {
    id {
      id cid 6428
    },
    atoms {
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        2,
        3,
        4,
        5,
        6,
        7,
        8
      },
      element {
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        cl,
        cl,
        f,
        f,
        f,
        c,
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      }
    },
    bonds {
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        2,
        3,
        4,
        5,
        6,
        7
      },
      aid2 {
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        7,
        8,
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        8,
        8,
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      },
      order {
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        single,
        single,
        single,
        single,
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      }
    },
    coords {
      {
        type {
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        },
        aid {
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          6,
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        },
        conformers {
          {
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              { -1411, 10, -3 },
              { 15275, 10, -4 },
              { -11759, 10, -4 },
              { 12074, 10, -4 },
              { 12194, 10, -4 },
              { -7491, 10, -4 },
              { 7754, 10, -4 }
            },
            y {
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              { 12481, 10, -4 },
              { -4002, 10, -4 },
              { 3001, 10, -4 },
              { 1255, 10, -3 },
              { -8393, 10, -4 },
              { 88, 10, -4 },
              { 223, 10, -4 }
            },
            z {
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              { -10442, 10, -4 },
              { -14827, 10, -4 },
              { 1315, 10, -3 },
              { 4482, 10, -4 },
              { 10239, 10, -4 },
              { 524, 10, -4 },
              { 699, 10, -4 }
            },
            data {
              {
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                  name "ID",
                  datatype uint64,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2009.12.11"
                },
                value sval "0000191C00000001"
              },
              {
                urn {
                  label "Energy",
                  name "MMFF94 NoEstat",
                  datatype double,
                  version "1.6.0",
                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
                },
                value fval { 25866, 10, -4 }
              },
              {
                urn {
                  label "Feature",
                  name "Self Overlap",
                  datatype double,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.01.18"
                },
                value fval { 0, 10, 0 }
              },
              {
                urn {
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                  datatype stringlist,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.11.26"
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                  "5084963 1 18051685835356983592",
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              {
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                  software "OEShape",
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                },
                value fvec {
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              },
              {
                urn {
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                  software "PubChem",
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                },
                value fval { 258975, 10, -3 }
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              {
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        data {
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            },
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          },
          {
            urn {
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              release "2010.05.05"
            },
            value ivec {
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          }
        }
      }
    },
    props {
      {
        urn {
          label "Charge",
          name "MMFF94 Partial",
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          version "1.9.0",
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        },
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      },
      {
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      {
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          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
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    },
    count {
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      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 1,
      tautomers 1
    }
  }
}