PC-Compounds ::= {
  {
    id {
      id cid 72147
    },
    atoms {
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        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
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        33,
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        35,
        36,
        37,
        38,
        39,
        40,
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        42,
        43,
        44,
        45
      },
      element {
        cl,
        cl,
        s,
        o,
        o,
        o,
        o,
        c,
        c,
        c,
        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
      }
    },
    bonds {
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        1,
        2,
        3,
        3,
        4,
        4,
        5,
        5,
        6,
        6,
        7,
        8,
        8,
        8,
        8,
        9,
        9,
        9,
        10,
        10,
        11,
        11,
        12,
        13,
        13,
        14,
        16,
        16,
        17,
        17,
        18,
        19,
        19,
        20,
        20,
        21,
        21,
        23,
        23,
        24,
        24,
        25,
        25,
        26,
        26,
        27,
        27,
        29
      },
      aid2 {
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        28,
        12,
        22,
        10,
        35,
        15,
        18,
        15,
        44,
        14,
        9,
        11,
        12,
        30,
        10,
        31,
        32,
        13,
        33,
        14,
        15,
        17,
        19,
        20,
        16,
        18,
        23,
        21,
        34,
        24,
        25,
        36,
        26,
        37,
        22,
        38,
        27,
        39,
        29,
        40,
        28,
        41,
        28,
        42,
        29,
        43,
        45
      },
      order {
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        double,
        double,
        single,
        single,
        single,
        double,
        single,
        single,
        double,
        single,
        single,
        double,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        double,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 8,
        above 9,
        top 11,
        bottom 12,
        below 30,
        parity any,
        type tetrahedral
      },
      tetrahedral {
        center 10,
        above 4,
        top 9,
        bottom 13,
        below 33,
        parity any,
        type tetrahedral
      }
    },
    coords {
      {
        type {
          threed,
          computed,
          units-angstroms
        },
        aid {
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          8,
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          11,
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          32,
          33,
          34,
          35,
          36,
          37,
          38,
          39,
          40,
          41,
          42,
          43,
          44,
          45
        },
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              { -3997, 10, -4 }
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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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      {
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          "6 16 18 23 24 27 29 rings",
          "6 5 11 14 15 16 18 rings"
        }
      }
    },
    count {
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      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
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      covalent-unit 1,
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    }
  }
}