PC-Compounds ::= {
  {
    id {
      id cid 25245094
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      tetrahedral {
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          "33 0.08",
          "39 0.4",
          "4 -0.68",
          "40 0.4",
          "41 0.4",
          "42 0.15",
          "43 0.15",
          "44 0.15",
          "45 0.45",
          "46 0.15",
          "47 0.15",
          "48 0.15",
          "49 0.45",
          "5 -0.68",
          "50 0.45",
          "6 -0.9",
          "7 -0.9",
          "8 -0.16",
          "9 -0.53"
        }
      },
      {
        urn {
          label "Count",
          name "Effective Rotor",
          datatype double,
          version "1.9.0",
          software "OEChem",
          source "ncbi.nlm.nih.gov",
          release "2012.11.26"
        },
        value fval { 52, 10, -1 }
      },
      {
        urn {
          label "Features",
          name "Pharmacophore",
          datatype stringlist,
          parameters "ImplicitMillsDean merged",
          version "1.8.3",
          software "OEShape",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
          "20",
          "1 1 acceptor",
          "1 10 acceptor",
          "1 11 donor",
          "1 12 donor",
          "1 2 acceptor",
          "1 3 acceptor",
          "1 3 donor",
          "1 4 acceptor",
          "1 4 donor",
          "1 5 acceptor",
          "1 5 donor",
          "1 6 acceptor",
          "1 7 acceptor",
          "1 8 acceptor",
          "1 9 donor",
          "3 6 7 18 anion",
          "6 1 13 14 15 16 17 rings",
          "6 19 20 21 22 23 24 rings",
          "6 28 29 30 31 32 33 rings",
          "6 8 22 23 25 26 27 rings"
        }
      }
    },
    count {
      heavy-atom 33,
      atom-chiral 5,
      atom-chiral-def 4,
      atom-chiral-undef 1,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 68
    }
  }
}