%maxcore 4000
%pal nprocs 16 end
! TPSSh D4 DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           0.10681045726096     13.19746512412441      6.53863707069884
  S           0.93663404761623     15.37754835001190      7.78355130141357
  N           1.04342803466563     13.78049367944259      7.66015121214833
  O          -0.81087396683901     12.16399598296836      6.95122477918869
  C          -0.33630595287592     15.59136263147854      6.46117141758727
  N          -0.68855968459312     14.46515440231614      5.88986923298123
  O           0.38470668527099     15.78525736455132      9.05726937675078
  C          -1.80196566391791     16.95452924757175      5.08560419945046
  H          -2.71488491366976     17.35481960299920      5.53294826387200
  H          -2.00687941910158     15.98842870386586      4.63100425595526
  N          -0.81763471954282     16.77487333683293      6.16512324242751
  O           2.15797186534227     16.03502663179651      7.36632488303910
  C          -1.23149572653639     17.93475248240052      4.06868236485459
  H          -0.34863712321298     17.49847553913769      3.58468647706811
  H          -1.98414287458724     18.16251204203996      3.31428741906924
  O          -0.88238961564808     19.16982420385138      4.69134861042672
  C           0.11529428405826     18.96867770276230      5.69009352810568
  H           0.33853170915592     19.94662703158117      6.11566699934827
  H           1.02203485757058     18.55090483481555      5.23483954055345
  C          -0.38968666184865     18.03638314046911      6.78443370395886
  H           0.39058772860676     17.85380738637616      7.51861049184554
  H          -1.25858224132504     18.47082382595424      7.28408106296918
  C           1.12131832687124     12.56399456517791      5.25695830017892
  C           2.32484912055121     13.19995767214950      4.95684767555557
  H           2.65517828334760     14.05421763915640      5.53460187433887
  C           3.09394823530274     12.71305621269574      3.91275317268255
  H           4.03281779017210     13.19981150147792      3.67346415364118
  C           2.68152400131696     11.60133584318215      3.16635494161033
  C           1.46952101784444     10.98715899669336      3.49201786868253
  H           1.13633759459016     10.12651549051568      2.92314921150826
  C           0.68186345808854     11.45932600785622      4.53427903214766
  H          -0.25490555956096     10.97934285727605      4.78492428517193
  C           3.54052824547623     11.07079756667224      2.05381187645205
  H           3.93650517965097     11.88575541005473      1.44389193015443
  H           2.97988052042328     10.38839307291170      1.41395922858588
  H           4.39664968007621     10.52530891683047      2.46354301557633
*
