PC-Compounds ::= {
  {
    id {
      id cid 6184
    },
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      }
    },
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      order {
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      }
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          18,
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        },
        conformers {
          {
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              { 11988, 10, -4 },
              { -1966, 10, -4 },
              { 2291, 10, -3 },
              { -13094, 10, -4 },
              { 36789, 10, -4 },
              { -27017, 10, -4 },
              { 13029, 10, -4 },
              { 13177, 10, -4 },
              { -2935, 10, -4 },
              { -3188, 10, -4 },
              { 21811, 10, -4 },
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              { -12407, 10, -4 },
              { -12112, 10, -4 },
              { 44441, 10, -4 },
              { 38264, 10, -4 },
              { 38337, 10, -4 },
              { -35154, 10, -4 }
            },
            y {
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              { 4684, 10, -4 },
              { -163, 10, -3 },
              { -6014, 10, -4 },
              { 8817, 10, -4 },
              { 193, 10, -4 },
              { 2966, 10, -4 },
              { 10873, 10, -4 },
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              { -8029, 10, -4 },
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              { -12306, 10, -4 },
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              { 653, 10, -3 },
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            },
            z {
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              { -175, 10, -4 },
              { 125, 10, -4 },
              { 15, 10, -4 },
              { 222, 10, -4 },
              { -1, 10, -4 },
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              { -9168, 10, -4 },
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              { -8724, 10, -4 },
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              { -8479, 10, -4 },
              { 126, 10, -4 },
              { 8802, 10, -4 },
              { -8943, 10, -4 },
              { -644, 10, -4 }
            },
            data {
              {
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                  label "Conformer",
                  name "ID",
                  datatype uint64,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2009.12.11"
                },
                value sval "0000182800000001"
              },
              {
                urn {
                  label "Energy",
                  name "MMFF94 NoEstat",
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                  version "1.6.0",
                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
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                value fval { -19823, 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 { 15223, 10, -3 }
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              {
                urn {
                  label "Fingerprint",
                  name "Shape",
                  datatype stringlist,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.11.26"
                },
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              },
              {
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                  software "OEShape",
                  source "openeye.com",
                  release "2012.01.18"
                },
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              },
              {
                urn {
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                  datatype double,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.01.18"
                },
                value fval { 240234, 10, -3 }
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              {
                urn {
                  label "Shape",
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                  software "OEShape",
                  source "openeye.com",
                  release "2012.01.18"
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                value fval { 914, 10, -1 }
              }
            }
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        data {
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          {
            urn {
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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"
        },
        value slist {
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        }
      },
      {
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          source "ncbi.nlm.nih.gov",
          release "2012.01.18"
        },
        value fval { 4, 10, 0 }
      },
      {
        urn {
          label "Features",
          name "Pharmacophore",
          datatype stringlist,
          parameters "ImplicitMillsDean merged",
          version "1.8.3",
          software "OEShape",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
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          "1 6 hydrophobe",
          "4 2 3 4 5 hydrophobe"
        }
      }
    },
    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
    }
  }
}