PC-Compounds ::= {
  {
    id {
      id cid 11768666
    },
    atoms {
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        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
        16,
        17,
        18,
        19,
        20,
        21
      },
      element {
        o,
        o,
        n,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        2,
        3,
        3,
        3,
        4,
        4,
        4,
        4,
        5,
        5,
        5,
        6,
        7,
        7,
        7,
        8,
        8,
        9,
        9
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      aid2 {
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        21,
        10,
        8,
        19,
        20,
        5,
        6,
        7,
        11,
        6,
        12,
        13,
        9,
        8,
        14,
        15,
        10,
        16,
        17,
        18
      },
      order {
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        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 4,
        above 5,
        top 6,
        bottom 7,
        below 11,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 8,
        above 3,
        top 7,
        bottom 10,
        below 16,
        parity clockwise,
        type tetrahedral
      }
    },
    coords {
      {
        type {
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          units-angstroms
        },
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          16,
          17,
          18,
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          20,
          21
        },
        conformers {
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              { 23488, 10, -4 },
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              { 1695, 10, -4 },
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            y {
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              { -21717, 10, -4 },
              { -19092, 10, -4 },
              { 20859, 10, -4 }
            },
            z {
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              { 3166, 10, -4 },
              { 4439, 10, -4 },
              { -478, 10, -3 },
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              { -2458, 10, -4 }
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            data {
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                },
                value fval { 25429, 10, -3 }
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              {
                urn {
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                  software "PubChem",
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              },
              {
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                },
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              },
              {
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              {
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        data {
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          {
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    },
    props {
      {
        urn {
          label "Charge",
          name "MMFF94 Partial",
          datatype stringlist,
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          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
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      {
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        },
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          "1 3 cation",
          "1 3 donor",
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        }
      }
    },
    count {
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      atom-chiral 2,
      atom-chiral-def 2,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
  }
}