PC-Compounds ::= {
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          software "OEShape",
          source "openeye.com",
          release "2012.11.26"
        },
        value slist {
          "26",
          "1 12 acceptor",
          "1 13 acceptor",
          "1 14 acceptor",
          "1 15 acceptor",
          "1 16 acceptor",
          "1 22 cation",
          "1 22 donor",
          "1 23 donor",
          "1 3 acceptor",
          "1 4 acceptor",
          "1 5 acceptor",
          "1 5 donor",
          "1 6 acceptor",
          "1 6 donor",
          "1 7 acceptor",
          "1 7 donor",
          "1 8 acceptor",
          "1 8 donor",
          "3 17 19 35 cation",
          "3 17 20 34 cation",
          "3 20 21 43 cation",
          "5 17 19 34 35 38 rings",
          "5 3 24 25 26 27 rings",
          "5 4 28 29 30 31 rings",
          "6 18 36 37 39 40 41 rings",
          "6 20 21 34 38 42 43 rings"
        }
      }
    },
    count {
      heavy-atom 44,
      atom-chiral 8,
      atom-chiral-def 8,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 1,
      tautomers 6
    }
  }
}