%maxcore 4000
%pal nprocs 16 end
! O3LYP DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           3.80066316808216      6.43352458040435      3.82733352346444
  S           1.41095813127795      6.88028149193550      4.86694520474446
  S           3.71466134778711      6.02420569834031      8.45446241180805
  O           4.73671833358667      7.49361796032245      3.54483968179919
  C           2.64174529983698      6.36856205915494      5.95937109383348
  N           2.28889097891772      6.63398575082246      3.48432325469650
  C           2.41038651785017      6.29309868120229      7.37048116405202
  N           3.79454044424614      6.07186670681903      5.41302796502782
  C           1.22181054207878      6.41059179029112      8.05529806779339
  H           0.26746613976033      6.57086694631923      7.56997459452419
  C           1.38136772863075      6.28382503541243      9.44140875538312
  H           0.57001384502718      6.34234539226663     10.15409255690558
  C           2.68559819393865      6.07007046296201      9.79757144699938
  H           3.09184030519129      5.93456186658400     10.78924446198975
  C           4.35032961022383      5.01442155813268      2.96509108354304
  C           5.60573472378814      5.01006817131972      2.37905440384706
  H           6.23513967826655      5.88794614373223      2.43784750026879
  C           6.03619670604299      3.87323009369409      1.72011906114523
  H           7.01848526240727      3.86627697165044      1.26142035109809
  C           5.23272117756058      2.74089756474763      1.63438458982316
  C           3.97477175497155      2.77316717541073      2.23607899038816
  H           3.33458509855084      1.89963024094391      2.18232147412009
  C           3.52850700725416      3.89716289845518      2.89854986877145
  H           2.54815206640258      3.91216536887015      3.35800550841106
  C           5.69083411652783      1.52627415888509      0.90284453179159
  H           5.46556842314542      0.61883868647198      1.46576970369690
  H           6.76134074953502      1.55964207544606      0.70345386813307
  H           5.17386563911122      1.44132744940311     -0.05734813805927
*
