PC-Compounds ::= {
  {
    id {
      id cid 5780
    },
    atoms {
      aid {
        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
        16,
        17,
        18,
        19,
        20,
        21,
        22,
        23,
        24,
        25,
        26
      },
      element {
        o,
        o,
        o,
        o,
        o,
        o,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        1,
        2,
        2,
        3,
        3,
        4,
        4,
        5,
        5,
        6,
        6,
        7,
        7,
        7,
        8,
        8,
        9,
        9,
        10,
        10,
        11,
        11,
        12,
        12
      },
      aid2 {
        7,
        21,
        8,
        22,
        9,
        23,
        10,
        24,
        11,
        25,
        12,
        26,
        8,
        9,
        13,
        10,
        14,
        11,
        15,
        12,
        16,
        17,
        18,
        19,
        20
      },
      order {
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 7,
        above 1,
        top 8,
        bottom 9,
        below 13,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 8,
        above 2,
        top 7,
        bottom 10,
        below 14,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 9,
        above 3,
        top 7,
        bottom 11,
        below 15,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 10,
        above 4,
        top 12,
        bottom 8,
        below 16,
        parity counterclockwise,
        type tetrahedral
      }
    },
    coords {
      {
        type {
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          computed,
          units-angstroms
        },
        aid {
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          18,
          19,
          20,
          21,
          22,
          23,
          24,
          25,
          26
        },
        conformers {
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              { -28753, 10, -4 },
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              { -6183, 10, -4 },
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              { -4776, 10, -4 },
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              { -12043, 10, -4 },
              { 17241, 10, -4 },
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            y {
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              { -481, 10, -4 },
              { 15208, 10, -4 },
              { 24038, 10, -4 }
            },
            z {
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              { -1258, 10, -4 },
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              { 2474, 10, -3 },
              { 18, 10, -2 },
              { -6637, 10, -4 }
            },
            data {
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              {
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                  software "Szybki",
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                  release "2012.11.26"
                },
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              {
                urn {
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                },
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              },
              {
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              {
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        data {
          {
            urn {
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              name "RMSD",
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            },
            value fval { 6, 10, -1 }
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          {
            urn {
              label "Diverse Conformer",
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    },
    props {
      {
        urn {
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          software "OEChem",
          source "openeye.com",
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        value slist {
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      {
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          "1 5 acceptor",
          "1 5 donor",
          "1 6 acceptor",
          "1 6 donor"
        }
      }
    },
    count {
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      atom-chiral 4,
      atom-chiral-def 4,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
  }
}