PC-Compounds ::= {
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          version "2.3.0",
          software "OEChem",
          source "OpenEye Scientific Software",
          release "2019.06.18"
        },
        value slist {
          "58",
          "1 1.45",
          "10 -0.48",
          "11 -0.91",
          "12 0.3",
          "13 0.36",
          "14 0.36",
          "15 0.2",
          "16 0.09",
          "17 0.54",
          "18 0.12",
          "19 -0.01",
          "2 1.45",
          "20 -0.15",
          "21 -0.15",
          "22 -0.15",
          "23 -0.15",
          "24 -0.15",
          "25 -0.15",
          "26 -0.01",
          "27 -0.15",
          "28 -0.15",
          "29 -0.15",
          "3 -0.19",
          "30 -0.15",
          "31 -0.15",
          "32 -0.15",
          "33 0.19",
          "34 -0.14",
          "35 -0.15",
          "36 -0.15",
          "37 -0.15",
          "38 -0.15",
          "39 -0.14",
          "4 -0.65",
          "40 0.14",
          "41 0.14",
          "47 0.42",
          "48 0.15",
          "49 0.15",
          "5 -0.65",
          "50 0.15",
          "51 0.15",
          "52 0.15",
          "53 0.15",
          "54 0.15",
          "55 0.15",
          "56 0.15",
          "57 0.15",
          "58 0.15",
          "59 0.15",
          "6 -0.57",
          "60 0.15",
          "61 0.15",
          "62 0.15",
          "63 0.15",
          "7 -0.65",
          "8 -0.65",
          "9 -0.69"
        }
      },
      {
        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 { 78, 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 11 donor",
          "1 4 acceptor",
          "1 5 acceptor",
          "1 6 acceptor",
          "1 7 acceptor",
          "1 8 acceptor",
          "6 15 16 20 21 24 25 rings",
          "6 18 22 23 29 30 33 rings",
          "6 19 27 28 31 32 34 rings",
          "6 26 35 36 37 38 39 rings",
          "7 9 10 12 13 15 16 17 rings"
        }
      }
    },
    count {
      heavy-atom 41,
      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
    }
  }
}