PC-Compounds ::= {
  {
    id {
      id cid 103023
    },
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      aid {
        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
        16,
        17,
        18,
        19,
        20,
        21,
        22,
        23
      },
      element {
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        o,
        o,
        o,
        o,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        2,
        2,
        3,
        3,
        4,
        4,
        5,
        5,
        6,
        6,
        6,
        7,
        7,
        8,
        8,
        9,
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        10,
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      aid2 {
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        10,
        7,
        20,
        8,
        21,
        9,
        22,
        11,
        23,
        7,
        9,
        12,
        8,
        13,
        10,
        14,
        11,
        15,
        16,
        17,
        18,
        19
      },
      order {
        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 6,
        above 1,
        top 7,
        bottom 9,
        below 12,
        parity any,
        type tetrahedral
      },
      tetrahedral {
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        above 2,
        top 8,
        bottom 6,
        below 13,
        parity counterclockwise,
        type tetrahedral
      },
      tetrahedral {
        center 8,
        above 3,
        top 7,
        bottom 10,
        below 14,
        parity any,
        type tetrahedral
      },
      tetrahedral {
        center 9,
        above 4,
        top 6,
        bottom 11,
        below 15,
        parity any,
        type tetrahedral
      }
    },
    coords {
      {
        type {
          threed,
          computed,
          units-angstroms
        },
        aid {
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          14,
          15,
          16,
          17,
          18,
          19,
          20,
          21,
          22,
          23
        },
        conformers {
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              { 448, 10, -4 },
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              { 22432, 10, -4 },
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              { -22305, 10, -4 },
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              { 6318, 10, -4 },
              { 2931, 10, -3 },
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              { -39021, 10, -4 }
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            y {
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              { -674, 10, -3 },
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              { -23048, 10, -4 },
              { 1103, 10, -4 },
              { 22818, 10, -4 },
              { 2286, 10, -4 }
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            z {
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              { 13328, 10, -4 },
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              { 678, 10, -4 },
              { 3052, 10, -4 },
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              { -3787, 10, -4 },
              { 1924, 10, -4 }
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            data {
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              {
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                  software "PubChem",
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                },
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              {
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              },
              {
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              {
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        data {
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          {
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    },
    props {
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      {
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          "1 5 acceptor",
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      }
    },
    count {
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      atom-chiral 4,
      atom-chiral-def 1,
      atom-chiral-undef 3,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
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      covalent-unit 1,
      tautomers 1
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}