PC-Compounds ::= {
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      id cid 6405
    },
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      }
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        },
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        },
        conformers {
          {
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              { -4208, 10, -4 },
              { 888, 10, -3 },
              { -5477, 10, -4 },
              { -1624, 10, -3 },
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              { 9059, 10, -4 },
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              { -1513, 10, -3 },
              { -16624, 10, -4 },
              { -25645, 10, -4 },
              { -1585, 10, -3 },
              { 30364, 10, -4 },
              { 22525, 10, -4 },
              { 21809, 10, -4 },
              { -12923, 10, -4 }
            },
            y {
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              { -35, 10, -4 },
              { -7074, 10, -4 },
              { 13918, 10, -4 },
              { -859, 10, -3 },
              { 286, 10, -4 },
              { -866, 10, -3 },
              { -16985, 10, -4 },
              { 13606, 10, -4 },
              { 20731, 10, -4 },
              { 18448, 10, -4 },
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              { -5727, 10, -4 },
              { 9863, 10, -4 },
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            },
            z {
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              { 408, 10, -3 },
              { 6119, 10, -4 },
              { 4079, 10, -4 },
              { -45, 10, -4 },
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              { -628, 10, -4 },
              { 1703, 10, -3 },
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              { 3562, 10, -4 },
              { 1492, 10, -3 },
              { 886, 10, -4 },
              { -773, 10, -4 },
              { 2512, 10, -4 },
              { 5154, 10, -4 },
              { -10827, 10, -4 },
              { -16614, 10, -4 }
            },
            data {
              {
                urn {
                  label "Conformer",
                  name "ID",
                  datatype uint64,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2009.12.11"
                },
                value sval "0000190500000001"
              },
              {
                urn {
                  label "Energy",
                  name "MMFF94 NoEstat",
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                  version "1.6.0",
                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
                },
                value fval { 9026, 10, -3 }
              },
              {
                urn {
                  label "Feature",
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                  version "2.1",
                  software "PubChem",
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                  release "2012.01.18"
                },
                value fval { 20298, 10, -3 }
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                urn {
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                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
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              },
              {
                urn {
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                  software "OEShape",
                  source "openeye.com",
                  release "2012.01.18"
                },
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                  { -2, 10, -2 }
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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 { 206474, 10, -3 }
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              {
                urn {
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                  release "2012.01.18"
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        data {
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          {
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            value ivec {
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          }
        }
      }
    },
    props {
      {
        urn {
          label "Charge",
          name "MMFF94 Partial",
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          version "1.9.0",
          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
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        }
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      {
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          software "OEShape",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
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          "1 6 hydrophobe",
          "3 2 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 1
    }
  }
}