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          "46 0.15",
          "47 0.15",
          "5 -0.43",
          "50 0.36",
          "51 0.15",
          "54 0.4",
          "55 0.15",
          "56 0.15",
          "57 0.15",
          "58 0.15",
          "6 -0.57",
          "61 0.15",
          "62 0.15",
          "65 0.15",
          "66 0.15",
          "7 -0.9",
          "8 -0.6",
          "9 -0.62"
        }
      },
      {
        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 {
          "13",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 6 acceptor",
          "1 7 cation",
          "1 7 donor",
          "1 8 donor",
          "3 8 10 20 cation",
          "3 9 10 28 cation",
          "5 3 12 14 18 21 rings",
          "6 11 13 16 17 19 23 rings",
          "6 25 26 27 29 31 32 rings",
          "6 34 35 36 38 39 40 rings",
          "6 9 10 13 17 20 28 rings"
        }
      }
    },
    count {
      heavy-atom 41,
      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
    }
  }
}