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          "18 0.66",
          "2 -0.56",
          "20 0.06",
          "21 0.3",
          "25 0.14",
          "26 0.57",
          "27 -0.28",
          "28 0.14",
          "3 -0.43",
          "30 -0.29",
          "31 0.28",
          "33 0.14",
          "34 0.48",
          "35 -0.14",
          "36 -0.15",
          "37 -0.15",
          "38 -0.11",
          "4 -0.57",
          "44 0.15",
          "5 -0.57",
          "6 -0.57",
          "67 0.15",
          "68 0.37",
          "7 -0.47",
          "78 0.15",
          "79 0.15",
          "8 -0.73",
          "80 0.15",
          "9 0.2"
        }
      },
      {
        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 { 13, 10, 0 }
      },
      {
        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 {
          "10",
          "1 2 acceptor",
          "1 4 acceptor",
          "1 5 acceptor",
          "1 6 acceptor",
          "1 8 donor",
          "4 16 22 23 24 hydrophobe",
          "5 1 35 36 37 38 rings",
          "6 2 9 11 12 14 15 rings",
          "6 27 28 29 30 32 33 rings",
          "6 7 9 10 12 13 17 rings"
        }
      }
    },
    count {
      heavy-atom 38,
      atom-chiral 4,
      atom-chiral-def 4,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 4
    }
  }
}