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        "56 0.15",
        "57 0.15",
        "58 0.15",
        "59 0.15",
        "6 -0.81",
        "62 0.15",
        "63 0.15",
        "64 0.15",
        "65 0.15",
        "66 0.15",
        "7 -0.6",
        "8 -0.62",
        "9 -0.62"
      }
    },
    {
      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 { 9, 10, 0 }
    },
    {
      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 {
        "13",
        "1 3 acceptor",
        "1 4 acceptor",
        "1 5 acceptor",
        "1 6 cation",
        "1 7 donor",
        "3 7 9 25 cation",
        "3 8 9 27 cation",
        "5 3 15 16 17 18 rings",
        "6 19 20 21 22 23 24 rings",
        "6 2 6 10 11 12 13 rings",
        "6 26 28 29 30 31 32 rings",
        "6 34 35 36 37 38 39 rings",
        "6 8 9 21 23 25 27 rings"
      }
    }
  },
  count {
    heavy-atom 39,
    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 3
  }
}