PC-Compounds ::= {
  {
    id {
      id cid 14817
    },
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        2,
        3,
        4,
        5,
        6,
        7,
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        9,
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      },
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        s,
        s,
        s,
        s,
        s,
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        p,
        p,
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      }
    },
    bonds {
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        1,
        2,
        2,
        3,
        3,
        4,
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        5,
        5,
        6,
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      },
      order {
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        single,
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        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        double,
        double,
        double
      }
    },
    coords {
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        type {
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        },
        aid {
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          6,
          7,
          8,
          9,
          10,
          11,
          12,
          13,
          14
        },
        conformers {
          {
            x {
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              { 5632, 10, -4 },
              { -22624, 10, -4 },
              { 22619, 10, -4 },
              { -5645, 10, -4 },
              { 6249, 10, -4 },
              { -22864, 10, -4 },
              { 10564, 10, -4 },
              { 33959, 10, -4 },
              { -21655, 10, -4 },
              { -1183, 10, -3 },
              { 5465, 10, -4 },
              { 17571, 10, -4 },
              { -11208, 10, -4 }
            },
            y {
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              { -15151, 10, -4 },
              { 1395, 10, -4 },
              { -1387, 10, -4 },
              { 15155, 10, -4 },
              { 18729, 10, -4 },
              { -31965, 10, -4 },
              { -4887, 10, -4 },
              { 2135, 10, -4 },
              { 34716, 10, -4 },
              { -16544, 10, -4 },
              { -2529, 10, -4 },
              { 1108, 10, -4 },
              { 17966, 10, -4 }
            },
            z {
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              { 17921, 10, -4 },
              { 8284, 10, -4 },
              { -8298, 10, -4 },
              { -17916, 10, -4 },
              { 1388, 10, -3 },
              { 12134, 10, -4 },
              { -39444, 10, -4 },
              { 23111, 10, -4 },
              { 42, 10, -2 },
              { 6279, 10, -4 },
              { -20411, 10, -4 },
              { 11964, 10, -4 },
              { 2171, 10, -4 }
            },
            data {
              {
                urn {
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                  name "ID",
                  datatype uint64,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2009.12.11"
                },
                value sval "000039E100000001"
              },
              {
                urn {
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                  datatype double,
                  version "1.6.0",
                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
                },
                value fval { 315473, 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 { 2349, 10, -2 }
              },
              {
                urn {
                  label "Fingerprint",
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                  datatype stringlist,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
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                }
              },
              {
                urn {
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                  datatype doublevec,
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                  software "OEShape",
                  source "openeye.com",
                  release "2012.01.18"
                },
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              {
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                  software "PubChem",
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                },
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              {
                urn {
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                  software "OEShape",
                  source "openeye.com",
                  release "2012.01.18"
                },
                value fval { 254, 10, 0 }
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            }
          }
        },
        data {
          {
            urn {
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          {
            urn {
              label "Diverse Conformer",
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              release "2010.05.05"
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    props {
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          source "openeye.com",
          release "2012.11.26"
        },
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          "2 -0.5",
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      },
      {
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          release "2012.01.18"
        },
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      {
        urn {
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          "6 2 3 6 11 13 14 rings",
          "6 4 5 6 12 13 14 rings"
        }
      }
    },
    count {
      heavy-atom 14,
      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
    }
  }
}