PC-Compounds ::= {
  {
    id {
      id cid 5487888
    },
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        2,
        3,
        4,
        5,
        6,
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        10,
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        31,
        32,
        33,
        34,
        35,
        36,
        37,
        38,
        39,
        40,
        41
      },
      element {
        s,
        s,
        o,
        o,
        o,
        o,
        o,
        n,
        n,
        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,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        2,
        2,
        3,
        4,
        4,
        5,
        6,
        7,
        7,
        8,
        8,
        8,
        9,
        9,
        9,
        10,
        11,
        11,
        12,
        12,
        12,
        13,
        13,
        14,
        14,
        16,
        16,
        17,
        17,
        17,
        18,
        19,
        19,
        19,
        21,
        22,
        23,
        24,
        26,
        26,
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      aid2 {
        13,
        17,
        24,
        25,
        15,
        20,
        35,
        20,
        21,
        10,
        26,
        13,
        15,
        16,
        14,
        21,
        31,
        22,
        23,
        25,
        25,
        37,
        38,
        14,
        27,
        15,
        28,
        18,
        20,
        18,
        29,
        30,
        19,
        32,
        33,
        34,
        22,
        23,
        24,
        36,
        39,
        40,
        41
      },
      order {
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        double,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 13,
        above 1,
        top 8,
        bottom 14,
        below 27,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 14,
        above 9,
        top 13,
        bottom 15,
        below 28,
        parity clockwise,
        type tetrahedral
      },
      planar {
        left 10,
        ltop -1,
        lbottom 7,
        right 22,
        rtop 23,
        rbottom 21,
        parity opposite,
        type planar
      }
    },
    coords {
      {
        type {
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          computed,
          units-angstroms
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        aid {
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          31,
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          33,
          34,
          35,
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          37,
          38,
          39,
          40,
          41
        },
        conformers {
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            data {
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}