PC-Compound ::= {
  id {
    id cid 91144
  },
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      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,
      31,
      32,
      33,
      34,
      35,
      36,
      37,
      38
    },
    element {
      o,
      o,
      o,
      o,
      o,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
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      h,
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      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h,
      h
    }
  },
  bonds {
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      1,
      1,
      2,
      3,
      3,
      4,
      4,
      5,
      5,
      6,
      6,
      6,
      7,
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      17,
      17,
      18,
      18,
      19,
      19,
      19,
      20,
      20,
      21,
      21
    },
    aid2 {
      6,
      9,
      10,
      13,
      36,
      15,
      37,
      22,
      38,
      7,
      11,
      23,
      10,
      24,
      25,
      9,
      10,
      13,
      12,
      17,
      18,
      15,
      16,
      14,
      15,
      19,
      26,
      27,
      28,
      20,
      29,
      21,
      30,
      31,
      32,
      33,
      22,
      34,
      22,
      35
    },
    order {
      single,
      single,
      double,
      single,
      single,
      single,
      single,
      single,
      single,
      single,
      single,
      single,
      single,
      single,
      single,
      single,
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      single,
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      single,
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      single,
      single,
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      single,
      single,
      single,
      single,
      double,
      single,
      single,
      single
    }
  },
  stereo {
    tetrahedral {
      center 6,
      above 1,
      top 7,
      bottom 11,
      below 23,
      parity any,
      type tetrahedral
    }
  },
  coords {
    {
      type {
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        computed,
        units-angstroms
      },
      aid {
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        28,
        29,
        30,
        31,
        32,
        33,
        34,
        35,
        36,
        37,
        38
      },
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          data {
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      data {
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    {
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  },
  count {
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  }
}