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          "28 0.66",
          "29 -0.28",
          "3 -0.68",
          "30 0.14",
          "31 -0.1",
          "32 0.18",
          "33 -0.11",
          "34 0.2",
          "35 0.18",
          "4 -0.43",
          "5 -0.57",
          "6 -0.68",
          "68 0.4",
          "69 0.4",
          "7 -0.57",
          "70 0.4",
          "74 0.15",
          "75 0.15",
          "8 -0.57"
        }
      },
      {
        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 { 48, 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 {
          "12",
          "1 2 acceptor",
          "1 2 donor",
          "1 3 acceptor",
          "1 3 donor",
          "1 30 hydrophobe",
          "1 5 acceptor",
          "1 6 acceptor",
          "1 6 donor",
          "1 7 acceptor",
          "1 8 acceptor",
          "3 12 23 24 hydrophobe",
          "5 1 8 32 33 34 rings"
        }
      }
    },
    count {
      heavy-atom 35,
      atom-chiral 7,
      atom-chiral-def 6,
      atom-chiral-undef 1,
      bond-chiral 1,
      bond-chiral-def 1,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 4
    }
  }
}