PC-Compound ::= {
  id {
    id cid 94144
  },
  atoms {
    aid {
      1,
      2,
      3,
      4,
      5,
      6,
      7,
      8,
      9,
      10,
      11,
      12,
      13,
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      38,
      39,
      40,
      41,
      42,
      43,
      44,
      45,
      46,
      47,
      48,
      49,
      50,
      51
    },
    element {
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
      c,
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      c,
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      h,
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      h,
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      h,
      h,
      h,
      h,
      h,
      h,
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      h,
      h,
      h,
      h
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  },
  bonds {
    aid1 {
      1,
      1,
      1,
      1,
      2,
      2,
      2,
      3,
      3,
      3,
      4,
      4,
      4,
      5,
      5,
      5,
      6,
      6,
      6,
      7,
      7,
      7,
      8,
      8,
      9,
      9,
      9,
      10,
      10,
      10,
      11,
      11,
      12,
      12,
      12,
      13,
      13,
      13,
      14,
      14,
      15,
      15,
      15,
      16,
      16,
      16,
      17,
      17,
      17,
      18,
      18,
      18,
      19,
      19
    },
    aid2 {
      2,
      4,
      7,
      20,
      3,
      9,
      21,
      5,
      10,
      22,
      6,
      13,
      16,
      8,
      12,
      17,
      11,
      15,
      23,
      8,
      24,
      25,
      26,
      27,
      11,
      28,
      29,
      14,
      30,
      31,
      32,
      33,
      14,
      34,
      35,
      18,
      36,
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      38,
      39,
      19,
      40,
      41,
      42,
      43,
      44,
      45,
      46,
      47,
      19,
      48,
      49,
      50,
      51
    },
    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,
      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,
      single,
      single,
      single,
      single
    }
  },
  stereo {
    tetrahedral {
      center 1,
      above 2,
      top 4,
      bottom 7,
      below 20,
      parity clockwise,
      type tetrahedral
    },
    tetrahedral {
      center 2,
      above 1,
      top 9,
      bottom 3,
      below 21,
      parity counterclockwise,
      type tetrahedral
    },
    tetrahedral {
      center 3,
      above 2,
      top 5,
      bottom 10,
      below 22,
      parity clockwise,
      type tetrahedral
    },
    tetrahedral {
      center 4,
      above 1,
      top 13,
      bottom 6,
      below 16,
      parity counterclockwise,
      type tetrahedral
    },
    tetrahedral {
      center 5,
      above 3,
      top 12,
      bottom 8,
      below 17,
      parity counterclockwise,
      type tetrahedral
    },
    tetrahedral {
      center 6,
      above 4,
      top 11,
      bottom 15,
      below 23,
      parity clockwise,
      type tetrahedral
    }
  },
  coords {
    {
      type {
        threed,
        computed,
        units-angstroms
      },
      aid {
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        3,
        4,
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        6,
        7,
        8,
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        10,
        11,
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        30,
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        33,
        34,
        35,
        36,
        37,
        38,
        39,
        40,
        41,
        42,
        43,
        44,
        45,
        46,
        47,
        48,
        49,
        50,
        51
      },
      conformers {
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          data {
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            {
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      data {
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  props {
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      urn {
        label "Charge",
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        source "openeye.com",
        release "2012.05.21"
      },
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    {
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      urn {
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    }
  },
  count {
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    bond-chiral 0,
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    bond-chiral-undef 0,
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  }
}