PC-Compounds ::= {
  {
    id {
      id cid 3840
    },
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    },
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        single,
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        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single
      }
    },
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        type {
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        },
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        },
        conformers {
          {
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              { -32819, 10, -4 },
              { 281, 10, -2 },
              { 20867, 10, -4 },
              { -11472, 10, -4 },
              { -2195, 10, -4 },
              { -2608, 10, -3 },
              { 1207, 10, -3 },
              { 15084, 10, -4 },
              { 4824, 10, -4 },
              { -4702, 10, -4 },
              { -2946, 10, -3 },
              { -28501, 10, -4 },
              { 5821, 10, -4 },
              { -42339, 10, -4 },
              { 28138, 10, -4 }
            },
            y {
              { 10962, 10, -4 },
              { 333, 10, -3 },
              { 10396, 10, -4 },
              { -16843, 10, -4 },
              { -2555, 10, -4 },
              { -1218, 10, -3 },
              { -5473, 10, -4 },
              { -8379, 10, -4 },
              { 612, 10, -3 },
              { 14623, 10, -4 },
              { -22721, 10, -4 },
              { -3599, 10, -4 },
              { -15783, 10, -4 },
              { 25386, 10, -4 },
              { 1572, 10, -4 },
              { 2012, 10, -3 }
            },
            z {
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              { -5633, 10, -4 },
              { -1173, 10, -4 },
              { -1403, 10, -4 },
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              { 3091, 10, -4 },
              { -355, 10, -4 },
              { -165, 10, -4 },
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              { 13331, 10, -4 },
              { 328, 10, -4 },
              { 1226, 10, -4 },
              { -4718, 10, -4 },
              { -876, 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 "00000F0000000001"
              },
              {
                urn {
                  label "Energy",
                  name "MMFF94 NoEstat",
                  datatype double,
                  version "1.6.0",
                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
                },
                value fval { 156087, 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 { 30454, 10, -3 }
              },
              {
                urn {
                  label "Fingerprint",
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                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.11.26"
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                  "241688 4 18121223082318705912",
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                  "29004967 10 18335427897416366577",
                  "5084963 1 18130223731532146483",
                  "63268167 104 18413392042301871217"
                }
              },
              {
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                  software "OEShape",
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                },
                value fvec {
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              },
              {
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              {
                urn {
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                  release "2012.01.18"
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        data {
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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",
          datatype stringlist,
          version "1.9.0",
          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
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      },
      {
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          source "ncbi.nlm.nih.gov",
          release "2012.01.18"
        },
        value fval { 1, 10, 0 }
      },
      {
        urn {
          label "Features",
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          datatype stringlist,
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          software "OEShape",
          source "openeye.com",
          release "2012.11.26"
        },
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          "1 2 donor",
          "1 3 donor",
          "1 4 acceptor",
          "6 1 5 6 8 9 10 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 2
    }
  }
}