PC-Compounds ::= {
  {
    id {
      id cid 22226133
    },
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        6,
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      }
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        single,
        double,
        single,
        single,
        single,
        double,
        single,
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      }
    },
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        },
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        },
        conformers {
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              { -16811, 10, -4 },
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              { -8379, 10, -4 },
              { 5459, 10, -4 },
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              { -1242, 10, -3 },
              { 11864, 10, -4 },
              { -31883, 10, -4 }
            },
            y {
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              { 267, 10, -2 },
              { -9691, 10, -4 },
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              { -7352, 10, -4 },
              { -3859, 10, -4 },
              { 5507, 10, -4 },
              { 7253, 10, -4 },
              { -18463, 10, -4 },
              { -16717, 10, -4 },
              { -2904, 10, -4 },
              { -28553, 10, -4 },
              { -25509, 10, -4 },
              { -19278, 10, -4 }
            },
            z {
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              { -1, 10, -4 },
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              { -1, 10, -4 },
              { -3, 10, -4 }
            },
            data {
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                  software "PubChem",
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                  release "2009.12.11"
                },
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              {
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                  software "Szybki",
                  source "openeye.com",
                  release "2012.01.18"
                },
                value fval { 296441, 10, -4 }
              },
              {
                urn {
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                  software "PubChem",
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                },
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              {
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        data {
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      {
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          name "MMFF94 Partial",
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          release "2012.11.26"
        },
        value slist {
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      {
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        }
      }
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    count {
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      atom-chiral-def 0,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
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    }
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}