PC-Compounds ::= {
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    },
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        single,
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      }
    },
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        },
        conformers {
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              { 21916, 10, -4 },
              { -12986, 10, -4 },
              { 12986, 10, -4 },
              { -11691, 10, -4 },
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              { -35108, 10, -4 },
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              { 3409, 10, -4 },
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              { -9017, 10, -4 },
              { 8988, 10, -4 },
              { -9018, 10, -4 },
              { -14, 10, -4 }
            },
            data {
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                  release "2009.12.11"
                },
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              {
                urn {
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                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
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                value fval { 168579, 10, -4 }
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              {
                urn {
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                  software "PubChem",
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    count {
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      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
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}