%maxcore 4000
%pal nprocs 16 end
! O3LYP DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           4.11934803363682      4.49635830744974    -12.04991124066149
  S           5.04876511947507      3.21901256458270    -14.16401152147959
  O           3.63762758676787      5.85547034647497    -12.08532875182793
  C           3.42592064720952      2.90529876574587    -13.74349429338699
  N           5.42204759003476      4.12831193141587    -12.83200581964711
  C           2.57331580739024      2.04768284339869    -14.60363025399150
  H           3.18079447037949      1.61440249018484    -15.40075115882727
  H           2.20530086805309      1.22114677570141    -13.98857510772361
  N           2.99830005451492      3.46983696492982    -12.64933227011995
  C           1.38539726430543      2.80777956533379    -15.20193674160106
  H           1.76579688264546      3.63927253892678    -15.79958663258371
  H           0.79577856973090      3.23234851131239    -14.38770792353266
  C           0.52541310801007      1.92323834926364    -16.04994598526456
  C           0.77032676854062      1.78404400878588    -17.41202043958434
  H           1.58083993790834      2.34444618990008    -17.86683617753162
  C          -0.00957704411124      0.94699226304602    -18.19360182094303
  H           0.19473989388242      0.85578923215012    -19.25454844653630
  C          -1.05095165628469      0.23265200909836    -17.62266474889560
  H          -1.66434138505730     -0.42020514570844    -18.23305821311600
  C          -1.30663163631116      0.36406723914614    -16.26665765727223
  H          -2.12310261795874     -0.18556676676955    -15.81172569321247
  C          -0.52403114584531      1.20224729426748    -15.48943031900113
  H          -0.73344181786871      1.30426128786878    -14.42940672315679
  C           4.37069231172075      4.08351349457452    -10.36811433855658
  C           5.04145417830163      2.91019064734867    -10.04905464832357
  H           5.42691876332867      2.27111033908831    -10.83348127028605
  C           5.21922851479438      2.57654580088170     -8.72313821463823
  H           5.74819638146621      1.66387962968187     -8.47193319417145
  C           4.73581321423539      3.39401601144550     -7.70138427977879
  C           4.06851682227853      4.56353511837428     -8.04997892882989
  H           3.69041197396596      5.21452629019507     -7.26989290540168
  C           3.88172528306436      4.91558861927538     -9.37431347950438
  H           3.36658044651848      5.82990546876834     -9.63677963490672
  C           4.93023410422960      3.01328623129814     -6.27385926674885
  H           5.98188470920456      2.80619685891522     -6.06439704020661
  H           4.59016972438166      3.79889202397925     -5.60041041602093
  H           4.37581825346173      2.10054990966817     -6.04001845272838
*
