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        "61 0.37",
        "65 0.15",
        "66 0.15",
        "67 0.15",
        "68 0.37",
        "69 0.15",
        "7 -0.81",
        "70 0.15",
        "71 0.15",
        "72 0.15",
        "73 0.15",
        "74 0.15",
        "8 -0.81",
        "9 -0.49"
      }
    },
    {
      urn {
        label "Count",
        name "Effective Rotor",
        datatype double,
        version "1.7.6",
        software "OEChem",
        source "ncbi.nlm.nih.gov",
        release "2012.01.18"
      },
      value fval { 128, 10, -1 }
    },
    {
      urn {
        label "Features",
        name "Pharmacophore",
        datatype stringlist,
        parameters "ImplicitMillsDean merged",
        version "1.8.1",
        software "OEShape",
        source "openeye.com",
        release "2012.02.08"
      },
      value slist {
        "12",
        "1 11 donor",
        "1 12 acceptor",
        "1 5 acceptor",
        "1 6 acceptor",
        "1 7 cation",
        "1 8 cation",
        "1 9 donor",
        "5 1 10 25 32 33 rings",
        "6 12 32 33 34 35 37 rings",
        "6 23 26 27 28 29 30 rings",
        "6 38 39 40 41 42 43 rings",
        "6 7 8 17 18 19 20 rings"
      }
    }
  },
  count {
    heavy-atom 43,
    atom-chiral 0,
    atom-chiral-def 0,
    atom-chiral-undef 0,
    bond-chiral 0,
    bond-chiral-def 0,
    bond-chiral-undef 0,
    isotope-atom 0,
    covalent-unit 1,
    tautomers 10
  }
}