PC-Compounds ::= {
  {
    id {
      id cid 65533
    },
    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 {
        p,
        o,
        o,
        o,
        o,
        o,
        o,
        o,
        o,
        o,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        1,
        1,
        1,
        2,
        2,
        3,
        3,
        4,
        5,
        5,
        6,
        6,
        7,
        7,
        8,
        9,
        11,
        11,
        11,
        12,
        12,
        13,
        13,
        14,
        14,
        15,
        16,
        16
      },
      aid2 {
        4,
        8,
        9,
        10,
        14,
        15,
        11,
        24,
        15,
        12,
        25,
        13,
        26,
        16,
        27,
        28,
        29,
        12,
        13,
        17,
        14,
        18,
        15,
        19,
        16,
        20,
        21,
        22,
        23
      },
      order {
        single,
        single,
        single,
        double,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 11,
        above 3,
        top 12,
        bottom 13,
        below 17,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 12,
        above 5,
        top 11,
        bottom 14,
        below 18,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 13,
        above 6,
        top 15,
        bottom 11,
        below 19,
        parity counterclockwise,
        type tetrahedral
      },
      tetrahedral {
        center 14,
        above 2,
        top 12,
        bottom 16,
        below 20,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 15,
        above 2,
        top 13,
        bottom 4,
        below 21,
        parity counterclockwise,
        type tetrahedral
      }
    },
    coords {
      {
        type {
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          20,
          21,
          22,
          23,
          24,
          25,
          26,
          27,
          28,
          29
        },
        conformers {
          {
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              { -22645, 10, -4 },
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              { -28748, 10, -4 },
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              { 27813, 10, -4 },
              { -30589, 10, -4 },
              { -19542, 10, -4 },
              { -215, 10, -4 }
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            z {
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              { 1397, 10, -4 },
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              { 11753, 10, -4 },
              { 4423, 10, -4 },
              { -10346, 10, -4 },
              { -314, 10, -3 },
              { 19351, 10, -4 }
            },
            data {
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              {
                urn {
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                },
                value fval { 71104, 10, -3 }
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              {
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              },
              {
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        data {
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    props {
      {
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      {
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          "1 6 donor",
          "1 7 acceptor",
          "1 7 donor",
          "1 8 acceptor",
          "1 9 acceptor",
          "4 1 8 9 10 anion",
          "6 2 11 12 13 14 15 rings"
        }
      }
    },
    count {
      heavy-atom 16,
      atom-chiral 5,
      atom-chiral-def 5,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
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      tautomers 1
    }
  }
}