PC-Compounds ::= {
  {
    id {
      id cid 2914772
    },
    atoms {
      aid {
        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
        16,
        17,
        18,
        19,
        20,
        21,
        22,
        23,
        24,
        25,
        26,
        27,
        28,
        29
      },
      element {
        cl,
        cl,
        o,
        o,
        n,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
      aid1 {
        1,
        2,
        3,
        3,
        4,
        5,
        5,
        5,
        6,
        6,
        6,
        6,
        7,
        7,
        7,
        8,
        8,
        9,
        9,
        9,
        10,
        10,
        11,
        11,
        12,
        13,
        15,
        16,
        16,
        17,
        17
      },
      aid2 {
        15,
        18,
        14,
        29,
        14,
        8,
        13,
        25,
        7,
        8,
        9,
        19,
        10,
        11,
        20,
        14,
        21,
        12,
        22,
        23,
        13,
        15,
        12,
        24,
        26,
        16,
        17,
        18,
        27,
        18,
        28
      },
      order {
        single,
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        double,
        single,
        double,
        single,
        single,
        single,
        double,
        double,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 6,
        above 7,
        top 8,
        bottom 9,
        below 19,
        parity any,
        type tetrahedral
      },
      tetrahedral {
        center 7,
        above 6,
        top 10,
        bottom 11,
        below 20,
        parity any,
        type tetrahedral
      },
      tetrahedral {
        center 8,
        above 5,
        top 6,
        bottom 14,
        below 21,
        parity any,
        type tetrahedral
      }
    },
    coords {
      {
        type {
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        },
        aid {
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          16,
          17,
          18,
          19,
          20,
          21,
          22,
          23,
          24,
          25,
          26,
          27,
          28,
          29
        },
        conformers {
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            y {
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              { -27709, 10, -4 },
              { 4571, 10, -4 },
              { -10589, 10, -4 }
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            z {
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              { 7, 10, -3 },
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              { 21402, 10, -4 },
              { 5053, 10, -4 },
              { -1767, 10, -4 },
              { -6538, 10, -4 }
            },
            data {
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              {
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                value fval { 4088, 10, -2 }
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              {
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        data {
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    },
    props {
      {
        urn {
          label "Charge",
          name "MMFF94 Partial",
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      {
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        urn {
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          "6 10 13 15 16 17 18 rings",
          "6 5 6 7 8 10 13 rings"
        }
      }
    },
    count {
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      bond-chiral-def 0,
      bond-chiral-undef 0,
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    }
  }
}