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          "35 -0.15",
          "36 -0.15",
          "37 -0.15",
          "38 -0.15",
          "39 0.28",
          "4 -0.56",
          "5 -0.36",
          "55 0.15",
          "6 -0.81",
          "60 0.15",
          "65 0.15",
          "66 0.4",
          "7 -0.66",
          "71 0.15",
          "72 0.15",
          "73 0.15",
          "74 0.15",
          "8 0.05",
          "9 0.18"
        }
      },
      {
        urn {
          label "Count",
          name "Effective Rotor",
          datatype double,
          version "2.3.0",
          software "OEChem",
          source "ncbi.nlm.nih.gov",
          release "2019.06.18"
        },
        value fval { 88, 10, -1 }
      },
      {
        urn {
          label "Features",
          name "Pharmacophore",
          datatype stringlist,
          parameters "ImplicitMillsDean merged",
          version "2.0.4",
          software "Shape TK",
          source "OpenEye Scientific Software",
          release "2019.06.18"
        },
        value slist {
          "13",
          "1 2 acceptor",
          "1 2 donor",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 5 acceptor",
          "1 6 cation",
          "1 8 cation",
          "5 8 11 14 18 19 rings",
          "6 18 19 23 26 30 31 rings",
          "6 27 34 35 36 37 38 rings",
          "6 4 24 28 29 32 33 rings",
          "6 6 9 10 11 14 15 rings",
          "6 7 9 12 13 16 17 rings"
        }
      }
    },
    count {
      heavy-atom 39,
      atom-chiral 1,
      atom-chiral-def 1,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
  }
}