PC-Compounds ::= {
  {
    id {
      id cid 201111
    },
    atoms {
      aid {
        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
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        16,
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        18,
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        20,
        21,
        22,
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        36,
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        38,
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        44,
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        49,
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        51,
        52,
        53,
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        n,
        c,
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        c,
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        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
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        c,
        c,
        c,
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        h,
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        h,
        h,
        h,
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        h,
        h,
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        h,
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        h,
        h,
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        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
      aid1 {
        1,
        2,
        3,
        3,
        3,
        4,
        4,
        4,
        5,
        5,
        5,
        6,
        6,
        6,
        7,
        7,
        8,
        8,
        8,
        9,
        9,
        9,
        9,
        10,
        10,
        11,
        11,
        12,
        12,
        13,
        14,
        15,
        16,
        17,
        17,
        17,
        19,
        19,
        20,
        20,
        21,
        22,
        23,
        23,
        23,
        24,
        24,
        24,
        25,
        25,
        25,
        26,
        26,
        26,
        27,
        27,
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        18,
        22,
        6,
        10,
        17,
        15,
        16,
        22,
        18,
        23,
        24,
        7,
        8,
        28,
        12,
        14,
        11,
        29,
        30,
        10,
        14,
        18,
        31,
        32,
        33,
        13,
        16,
        13,
        19,
        15,
        34,
        20,
        35,
        36,
        37,
        38,
        21,
        39,
        21,
        40,
        41,
        25,
        26,
        42,
        43,
        27,
        44,
        45,
        46,
        47,
        48,
        49,
        50,
        51,
        52,
        53,
        54
      },
      order {
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        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        double,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
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        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 6,
        above 3,
        top 7,
        bottom 8,
        below 28,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 9,
        above 10,
        top 14,
        bottom 18,
        below 31,
        parity clockwise,
        type tetrahedral
      }
    },
    coords {
      {
        type {
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          computed,
          units-angstroms
        },
        aid {
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          2,
          3,
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          51,
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          53,
          54
        },
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            data {
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    props {
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          "6 6 7 8 11 12 13 rings"
        }
      }
    },
    count {
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      atom-chiral 2,
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      atom-chiral-undef 0,
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}