PC-Compounds ::= {
  {
    id {
      id cid 441467
    },
    atoms {
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        2,
        3,
        4,
        5,
        6,
        7,
        8,
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        10,
        11,
        12,
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        20,
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        25,
        26,
        27,
        28,
        29,
        30,
        31,
        32,
        33,
        34,
        35,
        36,
        37
      },
      element {
        o,
        o,
        o,
        o,
        o,
        o,
        n,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
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        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        1,
        2,
        2,
        3,
        3,
        4,
        4,
        5,
        5,
        6,
        6,
        7,
        8,
        8,
        8,
        9,
        9,
        10,
        10,
        11,
        11,
        12,
        13,
        13,
        14,
        14,
        14,
        15,
        15,
        15,
        16,
        16,
        16,
        17,
        17,
        17
      },
      aid2 {
        11,
        12,
        12,
        14,
        8,
        26,
        9,
        27,
        10,
        28,
        13,
        37,
        18,
        9,
        10,
        19,
        11,
        20,
        12,
        21,
        13,
        22,
        23,
        24,
        25,
        15,
        16,
        18,
        17,
        29,
        30,
        31,
        32,
        33,
        34,
        35,
        36
      },
      order {
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        triple,
        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 8,
        above 3,
        top 9,
        bottom 10,
        below 19,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 9,
        above 4,
        top 8,
        bottom 11,
        below 20,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 10,
        above 5,
        top 12,
        bottom 8,
        below 21,
        parity counterclockwise,
        type tetrahedral
      },
      tetrahedral {
        center 11,
        above 1,
        top 9,
        bottom 13,
        below 22,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 12,
        above 1,
        top 2,
        bottom 10,
        below 23,
        parity clockwise,
        type tetrahedral
      },
      tetrahedral {
        center 14,
        above 2,
        top 15,
        bottom 16,
        below 18,
        parity clockwise,
        type tetrahedral
      }
    },
    coords {
      {
        type {
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          computed,
          units-angstroms
        },
        aid {
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          29,
          30,
          31,
          32,
          33,
          34,
          35,
          36,
          37
        },
        conformers {
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              { -4913, 10, -3 },
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              { 24684, 10, -4 }
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            y {
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              { -19792, 10, -4 },
              { -19757, 10, -4 },
              { -21705, 10, -4 },
              { -14557, 10, -4 }
            },
            data {
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              {
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        data {
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    props {
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    },
    count {
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      atom-chiral 6,
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      tautomers 1
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}