PC-Compounds ::= {
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          "35 -0.15",
          "36 -0.15",
          "37 0.2",
          "38 0.57",
          "4 -0.57",
          "40 0.1",
          "47 0.1",
          "48 0.1",
          "49 0.1",
          "5 -0.66",
          "50 0.1",
          "6 -0.51",
          "63 0.37",
          "64 0.15",
          "65 0.15",
          "66 0.15",
          "67 0.15",
          "68 0.15",
          "69 0.15",
          "7 -0.55",
          "70 0.15",
          "71 0.15",
          "74 0.37",
          "8 -0.55",
          "9 0.05"
        }
      },
      {
        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 { 146, 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 {
          "10",
          "1 1 acceptor",
          "1 2 acceptor",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 7 donor",
          "1 8 donor",
          "4 9 11 12 13 rings",
          "6 25 27 28 31 32 33 rings",
          "6 26 29 30 34 35 36 rings",
          "6 5 17 18 19 20 21 rings"
        }
      }
    },
    count {
      heavy-atom 38,
      atom-chiral 1,
      atom-chiral-def 0,
      atom-chiral-undef 1,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 8
    }
  }
}