%maxcore 4000
%pal nprocs 16 end
! TPSSh D4 DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           4.56706254545384      3.30729471252113    -13.41517482325320
  S           5.56516506308882      3.98059715228281    -15.78931045614320
  O           4.34648930096752      1.92219856201660    -13.02526133955627
  N           4.16511616090825      3.79621120552690    -14.85172471962064
  C           6.67710648629351      3.99173002194544    -14.41270418458016
  C           3.66692729676305      4.30653282443103    -12.28084062989408
  N           6.13410781702175      3.71555291847521    -13.24244341999470
  C           3.05761667351439      3.72271476584984    -11.17654535465440
  H           3.11844784310376      2.65290573213873    -11.02716389154335
  N           7.96916151335381      4.24003115702446    -14.60166631697475
  H           8.25406985998033      4.48284713891087    -15.54032291476858
  C           2.37392895315880      4.53382382298555    -10.27745301726592
  H           1.89552872150207      4.08541939417505     -9.41380098444896
  C           2.29438551875383      5.91486913528315    -10.46786604754526
  C           2.92138627647305      6.47570935327684    -11.58920490294247
  H           2.87025346813320      7.54695767170456    -11.75045960367970
  C           3.60463354010265      5.68287992240312    -12.49631200529834
  H           4.08441726633780      6.11910227423604    -13.36365309788219
  C           1.54270871306320      6.78657591916834     -9.50156402795523
  H           1.26021402903874      6.23064223618888     -8.60688010829634
  H           2.14533949201307      7.64880049735380     -9.20553714041997
  H           0.63052742138571      7.17350690141404     -9.96625304667788
  C           9.05069171142040      4.15188281715665    -13.58270169823962
  C           9.11992423339043      2.73028743618644    -13.01666179933680
  H           9.29674556371156      2.01010065314029    -13.81875952651211
  H           9.94576416272646      2.66880833345226    -12.30447464073648
  H           8.19625499893191      2.46747777893512    -12.50089249749422
  C           8.80758508759277      5.17964996570872    -12.47293449125658
  H           7.88097791437666      4.96877464529973    -11.93906279865799
  H           9.63625269516691      5.14119060491324    -11.76225215981946
  H           8.75463052628487      6.18680846450863    -12.89263100164613
  C          10.34345892287259      4.48313398993433    -14.32850769918433
  H          10.29773687513580      5.48891884128392    -14.75449312370508
  H          11.18340689064080      4.43964998797586    -13.63396611606535
  H          10.52120245733729      3.76506716219211    -15.13341441394946
*
