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        "22 -0.15",
        "23 0.27",
        "24 -0.15",
        "25 0.08",
        "26 -0.14",
        "27 -0.15",
        "28 0.08",
        "29 0.27",
        "3 -0.36",
        "30 -0.14",
        "31 0.08",
        "32 0.08",
        "33 -0.15",
        "34 -0.15",
        "35 -0.15",
        "36 -0.15",
        "37 0.08",
        "38 -0.15",
        "39 0.08",
        "4 -0.36",
        "40 -0.15",
        "41 -0.15",
        "42 0.08",
        "43 0.28",
        "44 0.28",
        "45 0.28",
        "46 0.28",
        "5 -0.17",
        "6 -0.36",
        "61 0.15",
        "65 0.15",
        "66 0.15",
        "7 -0.81",
        "70 0.15",
        "71 0.15",
        "72 0.15",
        "73 0.15",
        "74 0.15",
        "75 0.15",
        "76 0.15",
        "8 -0.81",
        "9 0.41"
      }
    },
    {
      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 { 6, 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 {
        "14",
        "1 1 acceptor",
        "1 2 acceptor",
        "1 3 acceptor",
        "1 4 acceptor",
        "1 5 acceptor",
        "1 6 acceptor",
        "1 7 cation",
        "1 8 cation",
        "6 11 13 21 24 28 31 rings",
        "6 15 18 22 25 27 32 rings",
        "6 26 33 34 37 38 42 rings",
        "6 30 35 36 39 40 41 rings",
        "6 7 9 11 12 13 14 rings",
        "6 8 10 15 17 18 19 rings"
      }
    }
  },
  count {
    heavy-atom 46,
    atom-chiral 2,
    atom-chiral-def 0,
    atom-chiral-undef 2,
    bond-chiral 0,
    bond-chiral-def 0,
    bond-chiral-undef 0,
    isotope-atom 0,
    covalent-unit 1,
    tautomers 1
  }
}