PC-Compound ::= {
  id {
    id cid 827
  },
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      2,
      3,
      4,
      5,
      6,
      7,
      8,
      9,
      10,
      11,
      12,
      13,
      14,
      15,
      16,
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    },
    element {
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      o,
      o,
      o,
      o,
      c,
      c,
      c,
      c,
      c,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h
    }
  },
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      1,
      2,
      2,
      3,
      3,
      4,
      4,
      5,
      5,
      6,
      6,
      6,
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      19,
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      20,
      9,
      21,
      10,
      22,
      7,
      8,
      11,
      9,
      12,
      10,
      13,
      14,
      15,
      16,
      17
    },
    order {
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      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 2,
      top 6,
      bottom 9,
      below 12,
      parity any,
      type tetrahedral
    },
    tetrahedral {
      center 8,
      above 3,
      top 6,
      bottom 10,
      below 13,
      parity any,
      type tetrahedral
    }
  },
  coords {
    {
      type {
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        units-angstroms
      },
      aid {
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        3,
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        22
      },
      conformers {
        {
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            { -25394, 10, -4 },
            { 21648, 10, -4 },
            { -244, 10, -4 },
            { -10961, 10, -4 },
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          y {
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            { 18584, 10, -4 },
            { -20617, 10, -4 },
            { -25296, 10, -4 }
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          z {
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          data {
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                release "2012.11.26"
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            {
              urn {
                label "Feature",
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                version "2.1",
                software "PubChem",
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                release "2012.11.26"
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              value fval { 50771, 10, -3 }
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            {
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                label "Fingerprint",
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                datatype stringlist,
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            {
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            {
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      data {
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        },
        {
          urn {
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        source "openeye.com",
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    {
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    {
      urn {
        label "Features",
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      }
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  },
  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
  }
}