PC-Compounds ::= {
  {
    id {
      id cid 8998
    },
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        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
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      },
      element {
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        o,
        o,
        o,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        2,
        2,
        3,
        3,
        4,
        4,
        5,
        5,
        5,
        6,
        6,
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      },
      aid2 {
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        6,
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        10,
        11,
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      },
      order {
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        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 5,
        above 1,
        top 6,
        bottom 7,
        below 9,
        parity any,
        type tetrahedral
      },
      tetrahedral {
        center 6,
        above 2,
        top 5,
        bottom 8,
        below 10,
        parity any,
        type tetrahedral
      }
    },
    coords {
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        type {
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        },
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          9,
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          16,
          17,
          18
        },
        conformers {
          {
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              { 8002, 10, -4 },
              { -30665, 10, -4 },
              { 30757, 10, -4 },
              { -6881, 10, -4 },
              { 6948, 10, -4 },
              { -18206, 10, -4 },
              { 18415, 10, -4 },
              { -799, 10, -3 },
              { 7932, 10, -4 },
              { -17721, 10, -4 },
              { -18104, 10, -4 },
              { 18043, 10, -4 },
              { 18421, 10, -4 },
              { -2712, 10, -4 },
              { 16806, 10, -4 },
              { -31004, 10, -4 },
              { 31038, 10, -4 }
            },
            y {
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              { 11704, 10, -4 },
              { -57, 10, -4 },
              { 295, 10, -4 },
              { -3404, 10, -4 },
              { 3273, 10, -4 },
              { 6837, 10, -4 },
              { -6804, 10, -4 },
              { -9774, 10, -4 },
              { 977, 10, -3 },
              { 13726, 10, -4 },
              { 12624, 10, -4 },
              { -13654, 10, -4 },
              { -12616, 10, -4 },
              { -19636, 10, -4 },
              { 15829, 10, -4 },
              { -5, 10, -1 },
              { 5282, 10, -4 }
            },
            z {
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              { -8584, 10, -4 },
              { 3016, 10, -4 },
              { 2935, 10, -4 },
              { 297, 10, -3 },
              { 2907, 10, -4 },
              { 2614, 10, -4 },
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              { 11685, 10, -4 },
              { 11102, 10, -4 },
              { -6672, 10, -4 },
              { 11127, 10, -4 },
              { -6665, 10, -4 },
              { -7145, 10, -4 },
              { -8372, 10, -4 },
              { 11384, 10, -4 },
              { 11279, 10, -4 }
            },
            data {
              {
                urn {
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                  name "ID",
                  datatype uint64,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2009.12.11"
                },
                value sval "0000232600000001"
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              {
                urn {
                  label "Energy",
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                  software "Szybki",
                  source "openeye.com",
                  release "2012.11.26"
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              {
                urn {
                  label "Feature",
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                  software "PubChem",
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                },
                value fval { 4062, 10, -2 }
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              {
                urn {
                  label "Fingerprint",
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                  datatype stringlist,
                  version "2.1",
                  software "PubChem",
                  source "ncbi.nlm.nih.gov",
                  release "2012.11.26"
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              },
              {
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                },
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              },
              {
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                value fval { 256342, 10, -3 }
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              {
                urn {
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        data {
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            },
            value fval { 6, 10, -1 }
          },
          {
            urn {
              label "Diverse Conformer",
              name "ID List",
              datatype uintvec,
              release "2012.02.08"
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    props {
      {
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          name "MMFF94 Partial",
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        },
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      },
      {
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        },
        value fval { 3, 10, 0 }
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      {
        urn {
          label "Features",
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          "1 4 donor"
        }
      }
    },
    count {
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      atom-chiral 2,
      atom-chiral-def 0,
      atom-chiral-undef 2,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
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}