PC-Compounds ::= {
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    props {
      {
        urn {
          label "Charge",
          name "MMFF94 Partial",
          datatype stringlist,
          version "1.9.0",
          software "OEChem",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
          "24",
          "1 -0.11",
          "17 0.28",
          "18 0.28",
          "19 0.5",
          "2 -0.56",
          "20 0.5",
          "21 0.5",
          "22 0.65",
          "23 0.28",
          "24 0.28",
          "25 -0.14",
          "26 -0.15",
          "27 0.11",
          "28 0.08",
          "29 -0.15",
          "3 -0.56",
          "30 0.08",
          "31 0.28",
          "32 0.28",
          "4 -0.36",
          "5 -0.36",
          "6 -1.01",
          "66 0.15",
          "67 0.15"
        }
      },
      {
        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 { 122, 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 {
          "10",
          "1 1 hydrophobe",
          "1 2 acceptor",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 5 acceptor",
          "1 6 cation",
          "3 8 14 15 hydrophobe",
          "6 25 26 27 28 29 30 rings",
          "6 3 6 20 21 23 24 rings",
          "7 7 8 9 10 11 12 13 rings"
        }
      }
    },
    count {
      heavy-atom 32,
      atom-chiral 3,
      atom-chiral-def 0,
      atom-chiral-undef 3,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 1
    }
  }
}