PC-Compounds ::= {
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          "6 -0.62",
          "60 0.15",
          "61 0.4",
          "62 0.15",
          "63 0.15",
          "64 0.15",
          "65 0.15",
          "69 0.15",
          "7 -0.87",
          "70 0.15",
          "71 0.15",
          "72 0.15",
          "73 0.15",
          "8 0.37"
        }
      },
      {
        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 { 13, 10, 0 }
      },
      {
        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 {
          "12",
          "1 1 acceptor",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 5 cation",
          "1 6 acceptor",
          "1 7 cation",
          "1 7 donor",
          "5 5 8 9 10 11 rings",
          "6 15 18 19 21 24 25 rings",
          "6 27 28 29 30 32 33 rings",
          "6 34 36 37 38 39 40 rings",
          "6 6 13 14 16 17 20 rings"
        }
      }
    },
    count {
      heavy-atom 40,
      atom-chiral 2,
      atom-chiral-def 2,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 5
    }
  }
}