PC-Compounds ::= {
  {
    id {
      id cid 3050417
    },
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        5,
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        10,
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        12,
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        29,
        30,
        31,
        32,
        33,
        34,
        35,
        36,
        37,
        38,
        39,
        40,
        41
      },
      element {
        o,
        o,
        o,
        n,
        n,
        n,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      }
    },
    bonds {
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        1,
        2,
        3,
        4,
        4,
        4,
        5,
        5,
        5,
        6,
        6,
        6,
        7,
        7,
        7,
        8,
        8,
        8,
        9,
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        10,
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        11,
        11,
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        12,
        12,
        13,
        13,
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        14,
        17,
        17,
        18,
        18,
        20,
        20,
        21,
        21,
        22
      },
      aid2 {
        15,
        16,
        19,
        7,
        13,
        30,
        15,
        19,
        35,
        16,
        19,
        36,
        8,
        10,
        23,
        9,
        24,
        25,
        14,
        15,
        16,
        11,
        26,
        27,
        12,
        28,
        29,
        13,
        31,
        32,
        33,
        34,
        17,
        18,
        20,
        37,
        21,
        38,
        22,
        39,
        22,
        40,
        41
      },
      order {
        double,
        double,
        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,
        single,
        single,
        single,
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        single,
        single,
        single,
        double,
        single,
        double,
        single,
        single,
        single,
        single
      }
    },
    stereo {
      tetrahedral {
        center 7,
        above 4,
        top 8,
        bottom 10,
        below 23,
        parity any,
        type tetrahedral
      }
    },
    coords {
      {
        type {
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          computed,
          units-angstroms
        },
        aid {
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          31,
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          33,
          34,
          35,
          36,
          37,
          38,
          39,
          40,
          41
        },
        conformers {
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            y {
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            },
            data {
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              {
                urn {
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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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          source "OpenEye Scientific Software",
          release "2019.06.18"
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        },
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      {
        urn {
          label "Features",
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    },
    count {
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      atom-chiral 1,
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      atom-chiral-undef 1,
      bond-chiral 0,
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      bond-chiral-undef 0,
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  }
}