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        datatype stringlist,
        version "1.7.6",
        software "OEChem",
        source "openeye.com",
        release "2012.05.21"
      },
      value slist {
        "30",
        "1 -0.3",
        "10 -0.04",
        "12 0.16",
        "15 -0.05",
        "16 0.09",
        "2 -0.43",
        "21 0.51",
        "24 0.49",
        "27 -0.29",
        "28 -0.14",
        "29 0.28",
        "3 -0.57",
        "31 0.14",
        "32 0.66",
        "33 -0.28",
        "34 0.71",
        "35 -0.12",
        "36 0.06",
        "37 0.14",
        "38 0.42",
        "39 0.66",
        "4 -0.43",
        "40 0.06",
        "44 0.1",
        "5 -0.57",
        "6 -0.57",
        "64 0.15",
        "65 0.15",
        "7 -0.43",
        "8 -0.57"
      }
    },
    {
      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 { 92, 10, -1 }
    },
    {
      urn {
        label "Features",
        name "Pharmacophore",
        datatype stringlist,
        parameters "ImplicitMillsDean merged",
        version "1.8.1",
        software "OEShape",
        source "openeye.com",
        release "2012.05.21"
      },
      value slist {
        "11",
        "1 1 acceptor",
        "1 3 acceptor",
        "1 30 hydrophobe",
        "1 5 acceptor",
        "1 6 acceptor",
        "1 8 acceptor",
        "5 13 14 17 20 22 rings",
        "6 10 12 21 24 27 28 rings",
        "6 4 29 31 33 34 35 rings",
        "6 9 11 13 14 18 19 rings",
        "7 1 9 10 11 12 15 16 rings"
      }
    }
  },
  count {
    heavy-atom 40,
    atom-chiral 11,
    atom-chiral-def 11,
    atom-chiral-undef 0,
    bond-chiral 0,
    bond-chiral-def 0,
    bond-chiral-undef 0,
    isotope-atom 0,
    covalent-unit 1,
    tautomers 1
  }
}