PC-Compounds ::= {
  {
    id {
      id cid 9795567
    },
    atoms {
      aid {
        1,
        2,
        3,
        4,
        5,
        6,
        7,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
        16,
        17,
        18,
        19,
        20,
        21,
        22,
        23,
        24,
        25,
        26,
        27,
        28,
        29,
        30,
        31,
        32,
        33,
        34,
        35,
        36,
        37,
        38,
        39,
        40,
        41,
        42,
        43
      },
      element {
        s,
        si,
        f,
        f,
        n,
        n,
        n,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        c,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h,
        h
      },
      charge {
        {
          aid 1,
          value 1
        },
        {
          aid 2,
          value -1
        }
      }
    },
    bonds {
      aid1 {
        1,
        1,
        1,
        2,
        2,
        2,
        2,
        2,
        5,
        5,
        6,
        6,
        7,
        7,
        8,
        8,
        8,
        9,
        9,
        9,
        10,
        10,
        10,
        11,
        11,
        11,
        12,
        12,
        12,
        13,
        13,
        13,
        14,
        14,
        14,
        15,
        15,
        15,
        16,
        16,
        16
      },
      aid2 {
        5,
        6,
        7,
        3,
        4,
        8,
        9,
        10,
        11,
        12,
        13,
        14,
        15,
        16,
        17,
        18,
        19,
        20,
        21,
        22,
        23,
        24,
        25,
        26,
        27,
        28,
        29,
        30,
        31,
        32,
        33,
        34,
        35,
        36,
        37,
        38,
        39,
        40,
        41,
        42,
        43
      },
      order {
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single,
        single
      }
    },
    coords {
      {
        type {
          twod,
          computed,
          units-unknown
        },
        aid {
          1,
          2,
          3,
          4,
          5,
          6,
          7,
          8,
          9,
          10,
          11,
          12,
          13,
          14,
          15,
          16,
          17,
          18,
          19,
          20,
          21,
          22,
          23,
          24,
          25,
          26,
          27,
          28,
          29,
          30,
          31,
          32,
          33,
          34,
          35,
          36,
          37,
          38,
          39,
          40,
          41,
          42,
          43
        },
        conformers {
          {
            x {
              { 2269, 10, -3 },
              { 21643, 10, -4 },
              { 30303, 10, -4 },
              { 11698, 10, -4 },
              { 3135, 10, -3 },
              { 1403, 10, -3 },
              { 2269, 10, -3 },
              { 17576, 10, -4 },
              { 19564, 10, -4 },
              { 29074, 10, -4 },
              { 4001, 10, -3 },
              { 3135, 10, -3 },
              { 5369, 10, -4 },
              { 1403, 10, -3 },
              { 1403, 10, -3 },
              { 3135, 10, -3 },
              { 11912, 10, -4 },
              { 15054, 10, -4 },
              { 2324, 10, -3 },
              { 25628, 10, -4 },
              { 18275, 10, -4 },
              { 13499, 10, -4 },
              { 24926, 10, -4 },
              { 33682, 10, -4 },
              { 33223, 10, -4 },
              { 3691, 10, -3 },
              { 4538, 10, -3 },
              { 4311, 10, -3 },
              { 3755, 10, -3 },
              { 3135, 10, -3 },
              { 2515, 10, -3 },
              { 2269, 10, -4 },
              { 0, 10, 0 },
              { 8469, 10, -4 },
              { 2023, 10, -3 },
              { 1403, 10, -3 },
              { 783, 10, -3 },
              { 1093, 10, -3 },
              { 866, 10, -3 },
              { 1713, 10, -3 },
              { 2825, 10, -3 },
              { 3672, 10, -3 },
              { 3445, 10, -3 }
            },
            y {
              { 20369, 10, -4 },
              { 76369, 10, -4 },
              { 81369, 10, -4 },
              { 77414, 10, -4 },
              { 25369, 10, -4 },
              { 25369, 10, -4 },
              { 10369, 10, -4 },
              { 67233, 10, -4 },
              { 8615, 10, -3 },
              { 69678, 10, -4 },
              { 20369, 10, -4 },
              { 35369, 10, -4 },
              { 20369, 10, -4 },
              { 35369, 10, -4 },
              { 5369, 10, -4 },
              { 5369, 10, -4 },
              { 69755, 10, -4 },
              { 61569, 10, -4 },
              { 64712, 10, -4 },
              { 87439, 10, -4 },
              { 92215, 10, -4 },
              { 84861, 10, -4 },
              { 6507, 10, -3 },
              { 65529, 10, -4 },
              { 74285, 10, -4 },
              { 15, 10, -1 },
              { 17269, 10, -4 },
              { 25739, 10, -4 },
              { 35369, 10, -4 },
              { 41569, 10, -4 },
              { 35369, 10, -4 },
              { 25739, 10, -4 },
              { 17269, 10, -4 },
              { 15, 10, -1 },
              { 35369, 10, -4 },
              { 41569, 10, -4 },
              { 35369, 10, -4 },
              { 10739, 10, -4 },
              { 2269, 10, -4 },
              { 0, 10, 0 },
              { 0, 10, 0 },
              { 2269, 10, -4 },
              { 10739, 10, -4 }
            }
          }
        }
      }
    },
    charge 0,
    props {
      {
        urn {
          label "Compound",
          name "Canonicalized",
          datatype uint,
          release "2021.10.14"
        },
        value ival 1
      },
      {
        urn {
          label "Compound Complexity",
          datatype double,
          implementation "E_COMPLEXITY",
          version "3.4.8.18",
          software "Cactvs",
          source "Xemistry GmbH",
          release "2021.10.14"
        },
        value fval { 129, 10, 0 }
      },
      {
        urn {
          label "Count",
          name "Hydrogen Bond Acceptor",
          datatype uint,
          implementation "E_NHACCEPTORS",
          version "3.4.8.18",
          software "Cactvs",
          source "Xemistry GmbH",
          release "2021.10.14"
        },
        value ival 6
      },
      {
        urn {
          label "Count",
          name "Hydrogen Bond Donor",
          datatype uint,
          implementation "E_NHDONORS",
          version "3.4.8.18",
          software "Cactvs",
          source "Xemistry GmbH",
          release "2021.10.14"
        },
        value ival 0
      },
      {
        urn {
          label "Count",
          name "Rotatable Bond",
          datatype uint,
          implementation "E_NROTBONDS",
          version "3.4.8.18",
          software "Cactvs",
          source "Xemistry GmbH",
          release "2021.10.14"
        },
        value ival 3
      },
      {
        urn {
          label "Fingerprint",
          name "SubStructure Keys",
          datatype fingerprint,
          parameters "extended 2",
          implementation "E_SCREEN",
          version "3.4.8.18",
          software "Cactvs",
          source "Xemistry GmbH",
          release "2021.10.14"
        },
        value binary '00000371E07301884000000000000000000000000000000000000000
000000000000000000000014100040000000000000044200020000010000000000000000000000
000000000800000000000000000000000000000000000000000000000000000000000000000000
000000000000000000'H
      },
      {
        urn {
          label "IUPAC Name",
          name "Allowed",
          datatype string,
          version "2.7.0",
          software "Lexichem TK",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "difluoro(trimethyl)silanuide;tris(dimethylamino)sulfonium"
      },
      {
        urn {
          label "IUPAC Name",
          name "CAS-like Style",
          datatype string,
          version "2.7.0",
          software "Lexichem TK",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "difluoro(trimethyl)silanuide;tris(dimethylamino)sulfonium"
      },
      {
        urn {
          label "IUPAC Name",
          name "Markup",
          datatype string,
          version "2.7.0",
          software "Lexichem TK",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "difluoro(trimethyl)silanuide;tris(dimethylamino)sulfanium"
      },
      {
        urn {
          label "IUPAC Name",
          name "Preferred",
          datatype string,
          version "2.7.0",
          software "Lexichem TK",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "difluoro(trimethyl)silanuide;tris(dimethylamino)sulfanium"
      },
      {
        urn {
          label "IUPAC Name",
          name "Systematic",
          datatype string,
          version "2.7.0",
          software "Lexichem TK",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "bis(fluoranyl)-trimethyl-silanuide;tris(dimethylamino)sulf
anium"
      },
      {
        urn {
          label "IUPAC Name",
          name "Traditional",
          datatype string,
          version "2.7.0",
          software "Lexichem TK",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "difluoro(trimethyl)silanuide;tris(dimethylamino)sulfonium"
      },
      {
        urn {
          label "InChI",
          name "Standard",
          datatype string,
          version "1.0.6",
          software "InChI",
          source "iupac.org",
          release "2021.10.14"
        },
        value sval "InChI=1S/C6H18N3S.C3H9F2Si/c1-7(2)10(8(3)4)9(5)6;1-6(2,3,4
)5/h1-6H3;1-3H3/q+1;-1"
      },
      {
        urn {
          label "InChIKey",
          name "Standard",
          datatype string,
          version "1.0.6",
          software "InChI",
          source "iupac.org",
          release "2021.10.14"
        },
        value sval "JMGVTLYEFSBAGJ-UHFFFAOYSA-N"
      },
      {
        urn {
          label "Mass",
          name "Exact",
          datatype string,
          version "2.2",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2021.10.14"
        },
        value sval "275.16630191"
      },
      {
        urn {
          label "Molecular Formula",
          datatype string,
          version "2.2",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2021.10.14"
        },
        value sval "C9H27F2N3SSi"
      },
      {
        urn {
          label "Molecular Weight",
          datatype string,
          version "2.2",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2021.10.14"
        },
        value sval "275.48"
      },
      {
        urn {
          label "SMILES",
          name "Canonical",
          datatype string,
          version "2.3.0",
          software "OEChem",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "CN(C)[S+](N(C)C)N(C)C.C[Si-](C)(C)(F)F"
      },
      {
        urn {
          label "SMILES",
          name "Isomeric",
          datatype string,
          version "2.3.0",
          software "OEChem",
          source "OpenEye Scientific Software",
          release "2021.10.14"
        },
        value sval "CN(C)[S+](N(C)C)N(C)C.C[Si-](C)(C)(F)F"
      },
      {
        urn {
          label "Topological",
          name "Polar Surface Area",
          datatype double,
          implementation "E_TPSA",
          version "3.4.8.18",
          software "Cactvs",
          source "Xemistry GmbH",
          release "2021.10.14"
        },
        value fval { 107, 10, -1 }
      },
      {
        urn {
          label "Weight",
          name "MonoIsotopic",
          datatype string,
          version "2.2",
          software "PubChem",
          source "ncbi.nlm.nih.gov",
          release "2021.10.14"
        },
        value sval "275.16630191"
      }
    },
    count {
      heavy-atom 16,
      atom-chiral 0,
      atom-chiral-def 0,
      atom-chiral-undef 0,
      bond-chiral 0,
      bond-chiral-def 0,
      bond-chiral-undef 0,
      isotope-atom 0,
      covalent-unit 2,
      tautomers -1
    }
  }
}