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              datatype double,
              release "2009.12.11"
            },
            value fval { 1, 10, 0 }
          },
          {
            urn {
              label "Diverse Conformer",
              name "ID List",
              datatype uintvec,
              release "2012.02.08"
            },
            value ivec {
              1,
              24,
              15,
              17,
              27,
              12,
              25,
              19,
              22,
              3,
              29,
              4,
              23,
              14,
              13,
              16,
              5,
              6,
              7,
              26,
              21,
              11,
              18,
              28,
              20,
              2,
              30,
              8,
              9,
              10
            }
          }
        }
      }
    },
    props {
      {
        urn {
          label "Charge",
          name "MMFF94 Partial",
          datatype stringlist,
          version "1.9.0",
          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
          "29",
          "1 -0.68",
          "10 0.28",
          "14 0.06",
          "15 0.28",
          "16 0.14",
          "2 -0.68",
          "27 0.28",
          "28 0.45",
          "29 -0.28",
          "3 -0.56",
          "30 0.42",
          "31 -0.14",
          "32 0.56",
          "33 0.71",
          "35 0.28",
          "36 0.28",
          "37 0.28",
          "39 0.28",
          "4 -0.57",
          "5 -0.43",
          "6 -0.56",
          "65 0.4",
          "66 0.06",
          "67 0.4",
          "7 -0.57",
          "70 0.15",
          "8 -0.56",
          "80 0.4",
          "9 -0.68"
        }
      },
      {
        urn {
          label "Count",
          name "Effective Rotor",
          datatype double,
          version "1.9.0",
          software "OEChem",
          source "ncbi.nlm.nih.gov",
          release "2012.11.26"
        },
        value fval { 88, 10, -1 }
      },
      {
        urn {
          label "Features",
          name "Pharmacophore",
          datatype stringlist,
          parameters "ImplicitMillsDean merged",
          version "1.8.3",
          software "OEShape",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
          "17",
          "1 1 acceptor",
          "1 1 donor",
          "1 2 acceptor",
          "1 2 donor",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 6 acceptor",
          "1 7 acceptor",
          "1 8 acceptor",
          "1 9 acceptor",
          "1 9 donor",
          "5 10 12 16 19 22 rings",
          "5 5 29 30 31 33 rings",
          "6 10 11 12 13 17 18 rings",
          "6 11 13 14 15 20 21 rings",
          "6 14 15 23 24 26 27 rings",
          "6 6 32 34 35 36 37 rings"
        }
      }
    },
    count {
      heavy-atom 39,
      atom-chiral 12,
      atom-chiral-def 12,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
  }
}