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            }
          }
        }
      }
    },
    props {
      {
        urn {
          label "Charge",
          name "MMFF94 Partial",
          datatype stringlist,
          version "2.3.0",
          software "OEChem",
          source "OpenEye Scientific Software",
          release "2019.06.18"
        },
        value slist {
          "51",
          "1 -0.18",
          "12 0.27",
          "13 0.27",
          "14 -0.14",
          "15 0.27",
          "17 0.14",
          "19 0.3",
          "2 -0.18",
          "21 0.3",
          "22 -0.15",
          "23 -0.15",
          "24 0.28",
          "25 0.14",
          "26 -0.14",
          "27 -0.14",
          "28 0.54",
          "29 -0.15",
          "3 -0.56",
          "30 -0.15",
          "31 0.28",
          "32 0.09",
          "33 -0.15",
          "34 -0.15",
          "35 -0.15",
          "36 -0.15",
          "37 -0.15",
          "38 -0.15",
          "39 -0.15",
          "4 -0.43",
          "40 0.18",
          "41 -0.15",
          "42 0.18",
          "43 0.66",
          "44 0.06",
          "5 -0.57",
          "6 -0.57",
          "66 0.15",
          "67 0.15",
          "7 -0.81",
          "72 0.15",
          "73 0.15",
          "76 0.15",
          "77 0.15",
          "78 0.15",
          "79 0.15",
          "8 -0.66",
          "80 0.15",
          "81 0.15",
          "82 0.15",
          "83 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 { 154, 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 {
          "9",
          "1 3 acceptor",
          "1 5 acceptor",
          "1 6 acceptor",
          "1 7 cation",
          "6 14 22 23 29 30 34 rings",
          "6 26 35 36 40 41 42 rings",
          "6 27 32 33 37 38 39 rings",
          "6 7 9 10 11 12 13 rings",
          "6 8 17 18 19 20 21 rings"
        }
      }
    },
    count {
      heavy-atom 44,
      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 1
    }
  }
}