PC-Compounds ::= {
  {
    id {
      id cid 8087
    },
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        4,
        5,
        6,
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        10,
        11,
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        c,
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        h,
        h,
        h,
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    },
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        4,
        5,
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        12,
        13,
        14,
        15,
        16,
        17,
        18,
        19,
        20,
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      },
      order {
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        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
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      }
    },
    stereo {
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        above 2,
        top 6,
        bottom 8,
        below 10,
        parity any,
        type tetrahedral
      },
      tetrahedral {
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        above 3,
        top 7,
        bottom 9,
        below 11,
        parity any,
        type tetrahedral
      }
    },
    coords {
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        type {
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        },
        conformers {
          {
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              { -23819, 10, -4 },
              { 23817, 10, -4 },
              { -11677, 10, -4 },
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              { -26066, 10, -4 },
              { 26065, 10, -4 }
            },
            y {
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              { 9928, 10, -4 },
              { 2214, 10, -4 },
              { 2214, 10, -4 },
              { -691, 10, -3 },
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              { 9267, 10, -4 },
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            data {
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                  software "Szybki",
                  source "openeye.com",
                  release "2012.11.26"
                },
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              },
              {
                urn {
                  label "Feature",
                  name "Self Overlap",
                  datatype double,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.11.26"
                },
                value fval { 2538, 10, -2 }
              },
              {
                urn {
                  label "Fingerprint",
                  name "Shape",
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                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
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              {
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                  datatype double,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.11.26"
                },
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              {
                urn {
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                  release "2012.11.26"
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        data {
          {
            urn {
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          },
          {
            urn {
              label "Diverse Conformer",
              name "ID List",
              datatype uintvec,
              release "2012.02.08"
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      {
        urn {
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          name "MMFF94 Partial",
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      {
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        }
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    },
    count {
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      atom-chiral 2,
      atom-chiral-def 0,
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      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
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}