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          "32 0.07",
          "33 -0.15",
          "34 -0.15",
          "35 -0.07",
          "36 -0.2",
          "37 0.47",
          "38 0.27",
          "39 0.27",
          "4 -0.57",
          "45 0.15",
          "5 -0.6",
          "6 -0.62",
          "65 0.15",
          "66 0.15",
          "67 0.4",
          "7 -0.66",
          "71 0.15",
          "72 0.15",
          "8 -0.81",
          "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 { 98, 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 {
          "11",
          "1 3 acceptor",
          "1 3 donor",
          "1 4 acceptor",
          "1 6 acceptor",
          "1 8 cation",
          "1 9 cation",
          "4 15 20 21 22 hydrophobe",
          "5 5 10 11 12 13 rings",
          "6 23 29 30 32 33 34 rings",
          "6 6 11 13 16 17 19 rings",
          "6 7 8 25 26 27 28 rings"
        }
      }
    },
    count {
      heavy-atom 39,
      atom-chiral 2,
      atom-chiral-def 1,
      atom-chiral-undef 1,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
  }
}