PC-Compound ::= {
  id {
    id cid 68672
  },
  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,
      27,
      28,
      29,
      30
    },
    element {
      cl,
      cl,
      o,
      o,
      n,
      n,
      n,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h
    }
  },
  bonds {
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      2,
      3,
      3,
      4,
      5,
      5,
      5,
      6,
      6,
      7,
      7,
      8,
      8,
      9,
      10,
      11,
      11,
      12,
      12,
      14,
      14,
      15,
      16,
      16,
      17,
      17,
      19,
      19,
      20,
      20,
      21
    },
    aid2 {
      15,
      18,
      12,
      30,
      13,
      10,
      13,
      23,
      8,
      12,
      9,
      18,
      9,
      11,
      10,
      14,
      15,
      16,
      13,
      22,
      17,
      24,
      19,
      20,
      25,
      18,
      26,
      21,
      27,
      21,
      28,
      29
    },
    order {
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      single,
      single,
      single,
      double,
      single,
      single,
      single,
      double,
      single,
      single,
      double,
      single,
      single,
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      single,
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      double,
      single,
      single,
      double,
      single,
      double,
      single,
      single,
      single,
      single,
      single,
      single,
      double,
      single,
      single
    }
  },
  stereo {
    tetrahedral {
      center 12,
      above 3,
      top 6,
      bottom 13,
      below 22,
      parity any,
      type tetrahedral
    }
  },
  coords {
    {
      type {
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        units-angstroms
      },
      aid {
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        2,
        3,
        4,
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        21,
        22,
        23,
        24,
        25,
        26,
        27,
        28,
        29,
        30
      },
      conformers {
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          y {
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          z {
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            { 2813, 10, -4 },
            { -12327, 10, -4 }
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          data {
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            {
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            {
              urn {
                label "Feature",
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              value fval { 45723, 10, -3 }
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            {
              urn {
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            },
            {
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              },
              value fvec {
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            {
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            {
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      data {
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        {
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  },
  props {
    {
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        name "MMFF94 Partial",
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        version "1.7.6",
        software "OEChem",
        source "openeye.com",
        release "2012.05.21"
      },
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    },
    {
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    {
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        "7 5 6 8 9 10 12 13 rings"
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    }
  },
  count {
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    atom-chiral 1,
    atom-chiral-def 0,
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    bond-chiral-undef 0,
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    covalent-unit 1,
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  }
}