PC-Compounds ::= {
  {
    id {
      id cid 136071
    },
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        5,
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    },
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      },
      order {
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        single,
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        single,
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        single,
        single,
        double,
        single,
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      }
    },
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        },
        conformers {
          {
            x {
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              { 11959, 10, -4 },
              { 219, 10, -4 },
              { 22, 10, -3 },
              { -11805, 10, -4 },
              { -11805, 10, -4 },
              { -23855, 10, -4 },
              { -23855, 10, -4 },
              { 23482, 10, -4 },
              { 23482, 10, -4 },
              { -11886, 10, -4 },
              { -11887, 10, -4 },
              { -33279, 10, -4 },
              { -33279, 10, -4 },
              { 32338, 10, -4 },
              { 32339, 10, -4 }
            },
            y {
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              { -14198, 10, -4 },
              { 7001, 10, -4 },
              { -7002, 10, -4 },
              { 14027, 10, -4 },
              { -14028, 10, -4 },
              { 6989, 10, -4 },
              { -6989, 10, -4 },
              { 6673, 10, -4 },
              { -6673, 10, -4 },
              { 24888, 10, -4 },
              { -24888, 10, -4 },
              { 12392, 10, -4 },
              { -12392, 10, -4 },
              { 12841, 10, -4 },
              { -12839, 10, -4 }
            },
            z {
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              { -6, 10, -4 },
              { -7, 10, -4 },
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              { 0, 10, 0 },
              { -1, 10, -3 },
              { -6, 10, -4 },
              { -13, 10, -4 },
              { -15, 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 "0002138700000001"
              },
              {
                urn {
                  label "Energy",
                  name "MMFF94 NoEstat",
                  datatype double,
                  version "1.6.0",
                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
                },
                value fval { 280996, 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 { 20337, 10, -3 }
              },
              {
                urn {
                  label "Fingerprint",
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                  version "2.1",
                  software "PubChem",
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              },
              {
                urn {
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                value fvec {
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                  { 0, 10, 0 },
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              },
              {
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                },
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              {
                urn {
                  label "Shape",
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        data {
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            urn {
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              release "2010.05.05"
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            value ivec {
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    },
    props {
      {
        urn {
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          name "MMFF94 Partial",
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          version "1.9.0",
          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
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      },
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          source "ncbi.nlm.nih.gov",
          release "2012.01.18"
        },
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      {
        urn {
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          source "openeye.com",
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        },
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          "6 3 4 5 6 7 8 rings"
        }
      }
    },
    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
    }
  }
}