PC-Compounds ::= {
  {
    id {
      id cid 10154
    },
    atoms {
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        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
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        17,
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        19,
        20,
        21,
        22,
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        28,
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        33,
        34,
        35,
        36,
        37,
        38,
        39,
        40,
        41,
        42,
        43,
        44,
        45
      },
      element {
        o,
        o,
        o,
        o,
        n,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
      aid1 {
        1,
        1,
        2,
        2,
        3,
        3,
        4,
        4,
        5,
        5,
        5,
        6,
        6,
        6,
        7,
        7,
        8,
        8,
        8,
        9,
        9,
        10,
        10,
        10,
        11,
        11,
        12,
        12,
        13,
        13,
        14,
        15,
        16,
        16,
        17,
        17,
        17,
        19,
        19,
        20,
        20,
        21,
        23,
        23,
        23,
        24,
        24,
        24
      },
      aid2 {
        15,
        23,
        18,
        38,
        21,
        24,
        22,
        42,
        6,
        10,
        17,
        7,
        8,
        25,
        9,
        11,
        13,
        26,
        27,
        12,
        16,
        12,
        28,
        29,
        14,
        15,
        30,
        31,
        14,
        19,
        20,
        18,
        18,
        32,
        33,
        34,
        35,
        22,
        36,
        21,
        37,
        22,
        39,
        40,
        41,
        43,
        44,
        45
      },
      order {
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        double,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 6,
        above 5,
        top 8,
        bottom 7,
        below 25,
        parity counterclockwise,
        type tetrahedral
      }
    },
    coords {
      {
        type {
          threed,
          computed,
          units-angstroms
        },
        aid {
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          4,
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          16,
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          18,
          19,
          20,
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          22,
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          35,
          36,
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          38,
          39,
          40,
          41,
          42,
          43,
          44,
          45
        },
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              { 246, 10, -3 }
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            data {
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        data {
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          {
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    props {
      {
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          source "openeye.com",
          release "2012.11.26"
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    },
    count {
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    }
  }
}