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          "32 -0.15",
          "33 -0.15",
          "34 -0.15",
          "35 -0.15",
          "38 -0.15",
          "39 0.16",
          "4 -0.65",
          "40 -0.15",
          "41 0.5",
          "5 -0.57",
          "6 -0.85",
          "67 0.15",
          "7 -0.66",
          "74 0.15",
          "75 0.15",
          "76 0.15",
          "77 0.15",
          "78 0.15",
          "79 0.15",
          "8 0.31",
          "80 0.15",
          "9 -0.42"
        }
      },
      {
        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 { 112, 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 {
          "10",
          "1 11 acceptor",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 5 acceptor",
          "3 24 29 30 hydrophobe",
          "5 8 9 10 27 28 rings",
          "6 11 37 38 39 40 41 rings",
          "6 12 13 14 15 16 17 rings",
          "6 31 32 33 34 35 36 rings",
          "7 1 6 7 18 21 22 23 rings"
        }
      }
    },
    count {
      heavy-atom 41,
      atom-chiral 1,
      atom-chiral-def 0,
      atom-chiral-undef 1,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 2
    }
  }
}