%maxcore 4000
%pal nprocs 16 end
! B3LYP DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           4.53907781830879      3.31565245696199    -13.43442301217251
  S           5.58066767023351      4.02573489396247    -15.79737915564269
  O           4.29086356583197      1.93437433418437    -13.05463062234788
  N           4.17077191891161      3.79759813347306    -14.87785503901212
  C           6.68281979027659      3.98788194503369    -14.39953070571881
  C           3.63476227649224      4.32207350159309    -12.28836856058476
  N           6.11886361166990      3.69131951595457    -13.24928918106164
  C           3.05957829243460      3.74289993537391    -11.16272628530238
  H           3.14333370458649      2.67836988694131    -10.99648389170919
  N           7.97789482166165      4.23058723416417    -14.58082660493393
  H           8.25591838040559      4.48727043516860    -15.51671215805279
  C           2.37582749277208      4.54816440216489    -10.25844670942540
  H           1.92764931589994      4.09598832488246     -9.38185657041162
  C           2.25732400310477      5.92413110331692    -10.46076877633583
  C           2.84638762995665      6.48196055528272    -11.60317764316174
  H           2.76541123635596      7.54805384724722    -11.77996029580008
  C           3.53032504899573      5.69443778671930    -12.51454629605381
  H           3.97568966378835      6.13789325003427    -13.39510872569051
  C           1.50879718526617      6.79278349894517     -9.48768266724697
  H           1.21477271185765      6.23269638718335     -8.60037915280132
  H           2.11837290970813      7.64367672612026     -9.17532899324834
  H           0.60443189664999      7.19844257392729     -9.94939297554760
  C           9.08098246206199      4.13783696639334    -13.57963473547603
  C           9.17132040013291      2.71154111487340    -13.02190912423994
  H           9.32861489379385      1.99386764843354    -13.82931162149076
  H          10.01591197527355      2.64597537212728    -12.33381781104976
  H           8.26699730263218      2.43741168621921    -12.48061925966682
  C           8.86278110909904      5.15956764509748    -12.45604128107663
  H           7.95103600139799      4.94912153104500    -11.89892164536901
  H           9.70544028701480      5.12039904517225    -11.76345435290983
  H           8.79935260757024      6.17000573560949    -12.86427779053534
  C          10.36196711465899      4.47729155305442    -14.34819417540051
  H          10.30965667405719      5.48436750871926    -14.76817804626123
  H          11.21617361430673      4.43247349765966    -13.67281782896494
  H          10.52945061283161      3.76680396696013    -15.16084230529607
*
