%maxcore 4000
%pal nprocs 16 end
! BP86 DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           3.19556046405245      8.24682757553994     18.40849554386783
  S           4.02339599674766      5.65328000781635     18.69771945842279
  C           5.23341906567087      7.10588491062848     19.15227144548262
  N           2.76770963159340      6.71173326320242     18.49647923345549
  O           2.37113228860485      9.14437602500321     19.20887837669422
  C           6.92627622017693      5.48319766679837     19.93536851672208
  H           7.69436575210701      5.19538351144847     19.20073325642336
  H           6.09873886116937      4.76577068790953     19.88439734513011
  N           4.77686983068698      8.30437137887708     18.86737018354803
  O           4.58629165666784      5.16070417866378     17.39229006502232
  C           7.52030892411141      5.49011416905994     21.34448200494997
  H           6.72408251343696      5.68549481005259     22.08683980204825
  H           7.97751152213620      4.51452774050431     21.55441847944100
  N           6.44789902872654      6.83430154358573     19.59836138906043
  O           8.55569876777421      6.47138048744611     21.46851680906128
  C           8.03240294328290      7.78117183726597     21.21553554091790
  H           8.86612653194679      8.48594644085344     21.33079954632152
  H           7.24902853287625      8.02285551216036     21.95762437385372
  C           7.46234773518786      7.88878016806834     19.80226225257141
  H           6.99590995917568      8.86642574578958     19.64057288369849
  H           8.25957663594084      7.73834927897216     19.05725259546868
  C           3.16073134199187      8.83983032644075     16.72838849220594
  C           2.71611981919367     10.14013523934874     16.46953323833692
  H           2.38691889468672     10.78208976824684     17.28605246424917
  C           2.70179312971434     10.59833774952912     15.15090140104154
  H           2.35774456450430     11.61369281697653     14.94374854043344
  C           3.12083769735807      9.77969121310259     14.08943389463549
  C           3.56473872556135      8.47692321294247     14.38479729892397
  H           3.89570359515616      7.82489312527664     13.57376435482402
  C           3.58553437719803      7.99893313633389     15.69294482426933
  H           3.92586562735089      6.98337966778037     15.91037231183504
  C           3.07346208812968     10.26982034839370     12.66696473159829
  H           3.94838517324304      9.92560537724237     12.09793992351385
  H           3.02886494204362     11.36571407130178     12.62215715285036
  H           2.17995616179474      9.87776200743715     12.15461926911913
*
