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          "66 0.15",
          "67 0.15",
          "68 0.15",
          "69 0.15",
          "7 -0.81",
          "70 0.15",
          "71 0.15",
          "8 -0.66",
          "9 -0.81"
        }
      },
      {
        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 { 168, 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 1 acceptor",
          "1 11 donor",
          "1 2 acceptor",
          "1 3 acceptor",
          "1 42 hydrophobe",
          "1 5 acceptor",
          "1 6 acceptor",
          "1 7 cation",
          "1 9 cation",
          "5 8 10 17 20 21 rings",
          "6 24 26 27 28 29 30 rings",
          "6 31 32 33 35 36 37 rings",
          "6 7 9 13 14 18 19 rings"
        }
      }
    },
    count {
      heavy-atom 42,
      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 4
    }
  }
}