PC-Compounds ::= {
  {
    id {
      id cid 14812
    },
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        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
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        o,
        o,
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        o,
        o,
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        o,
        o,
        o,
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      }
    },
    bonds {
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        1,
        1,
        1,
        2,
        2,
        2,
        2,
        3,
        3,
        3,
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      },
      order {
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        single,
        double,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        double
      }
    },
    coords {
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        type {
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        },
        aid {
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          8,
          9,
          10,
          11,
          12,
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          14
        },
        conformers {
          {
            x {
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              { 17195, 10, -4 },
              { -283, 10, -3 },
              { -5341, 10, -4 },
              { 7188, 10, -4 },
              { -10426, 10, -4 },
              { -12637, 10, -4 },
              { 12637, 10, -4 },
              { 10427, 10, -4 },
              { -7188, 10, -4 },
              { -16692, 10, -4 },
              { 31811, 10, -4 },
              { -5239, 10, -4 },
              { -9882, 10, -4 }
            },
            y {
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              { 762, 10, -3 },
              { 10793, 10, -4 },
              { -16198, 10, -4 },
              { -6579, 10, -4 },
              { -3787, 10, -4 },
              { 3789, 10, -4 },
              { 6577, 10, -4 },
              { 16198, 10, -4 },
              { -27936, 10, -4 },
              { -6134, 10, -4 },
              { 14101, 10, -4 },
              { 19971, 10, -4 }
            },
            z {
              { -887, 10, -4 },
              { -1885, 10, -4 },
              { 15623, 10, -4 },
              { -12851, 10, -4 },
              { -2439, 10, -4 },
              { 12963, 10, -4 },
              { -12085, 10, -4 },
              { 12086, 10, -4 },
              { -12964, 10, -4 },
              { 2439, 10, -4 },
              { -1641, 10, -4 },
              { -3489, 10, -4 },
              { 28902, 10, -4 },
              { -23775, 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 "000039DC00000001"
              },
              {
                urn {
                  label "Energy",
                  name "MMFF94 NoEstat",
                  datatype double,
                  version "1.7.2",
                  software "Szybki",
                  source "openeye.com",
                  release "2012.11.26"
                },
                value fval { 235259, 10, -4 }
              },
              {
                urn {
                  label "Feature",
                  name "Self Overlap",
                  datatype double,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.11.26"
                },
                value fval { 51178, 10, -3 }
              },
              {
                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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                  "68419 9 11696255116044913958",
                  "76951 1 17049584069811295925"
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              },
              {
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                  software "OEShape",
                  source "openeye.com",
                  release "2012.11.26"
                },
                value fvec {
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                  { -17, 10, -2 },
                  { 154, 10, -2 },
                  { 2, 10, -1 }
                }
              },
              {
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                  version "2.1",
                  software "PubChem",
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                  release "2012.11.26"
                },
                value fval { 469773, 10, -3 }
              },
              {
                urn {
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                  release "2012.11.26"
                },
                value fval { 1445, 10, -1 }
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          }
        },
        data {
          {
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          {
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            value ivec {
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    },
    props {
      {
        urn {
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          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
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          "11 -0.7",
          "12 -0.7",
          "13 -0.7",
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          "2 1.51",
          "3 1.51",
          "4 1.51",
          "5 -0.54",
          "6 -0.54",
          "7 -0.54",
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      },
      {
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          release "2012.11.26"
        },
        value fval { 12, 10, -1 }
      },
      {
        urn {
          label "Features",
          name "Pharmacophore",
          datatype stringlist,
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          software "OEShape",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
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          "1 13 acceptor",
          "1 14 acceptor",
          "6 1 2 3 5 6 8 rings",
          "6 1 2 4 5 7 9 rings",
          "6 1 3 4 6 7 10 rings",
          "6 2 3 4 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 1
    }
  }
}