PC-Compounds ::= {
  {
    id {
      id cid 54690469
    },
    atoms {
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        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
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        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        1,
        2,
        3,
        3,
        4,
        4,
        4,
        5,
        5,
        6,
        6,
        6,
        6,
        7,
        7,
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        8,
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        9,
        10,
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        10,
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        13,
        13,
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        14,
        15,
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        17,
        18,
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        22,
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        23,
        24,
        24,
        25,
        25,
        26,
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        27,
        27
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        11,
        15,
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        5,
        11,
        13,
        7,
        10,
        7,
        8,
        9,
        28,
        29,
        30,
        12,
        14,
        11,
        15,
        31,
        32,
        33,
        16,
        34,
        35,
        36,
        17,
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        19,
        18,
        38,
        18,
        39,
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        20,
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        21,
        43,
        22,
        23,
        24,
        44,
        25,
        45,
        26,
        46,
        26,
        47,
        27,
        48,
        49,
        50
      },
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        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
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        double,
        single,
        single,
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        single,
        single,
        double,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 5,
        above 1,
        top 4,
        bottom 7,
        below 10,
        parity any,
        type tetrahedral
      },
      tetrahedral {
        center 6,
        above 7,
        top 8,
        bottom 9,
        below 28,
        parity any,
        type tetrahedral
      },
      planar {
        left 9,
        ltop 6,
        lbottom 11,
        right 15,
        rtop 3,
        rbottom 19,
        parity same,
        type planar
      },
      planar {
        left 19,
        ltop 15,
        lbottom 41,
        right 20,
        rtop 43,
        rbottom 21,
        parity opposite,
        type planar
      }
    },
    coords {
      {
        type {
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          units-angstroms
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        aid {
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          46,
          47,
          48,
          49,
          50
        },
        conformers {
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            },
            data {
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                value fval { 3699, 10, -2 }
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              {
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                  release "2012.11.26"
                },
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              {
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                },
                value fval { 1171824, 10, -3 }
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              {
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        data {
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            },
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          {
            urn {
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            },
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    },
    props {
      {
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          label "Charge",
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          datatype stringlist,
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          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
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      {
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          release "2012.11.26"
        },
        value fval { 26, 10, -1 }
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      {
        urn {
          label "Features",
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          source "openeye.com",
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        },
        value slist {
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          "6 4 5 6 7 9 11 rings",
          "6 8 12 14 16 17 18 rings"
        }
      }
    },
    count {
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      atom-chiral 2,
      atom-chiral-def 0,
      atom-chiral-undef 2,
      bond-chiral 2,
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      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 3
    }
  }
}