%maxcore 4000
%pal nprocs 16 end
! wB97X-D4 DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           0.71506951917798      2.48700811553797     -4.03551784743980
  C           1.42085905820700      1.77987293821477     -1.91054486722208
  N          -0.49476544341970      2.06653097211452     -3.09606220048619
  O           0.10223738444630      1.81532131038743     -1.81753620146168
  C           0.69359761964462      1.45078887241489     -5.44291618922913
  N           1.94978910888550      2.04030297363800     -3.07035600597439
  O           0.83748386574712      3.84462291103302     -4.50381150398895
  C           0.48097904044932      0.08653691885267     -5.26396813428010
  H           0.31409358189361     -0.31531127481007     -4.27142874971111
  C           0.48350225954817     -0.74108490568144     -6.37069658561753
  H           0.32001102010497     -1.80611541708743     -6.24274414330800
  C           0.68986553392189     -0.22406316135558     -7.65440807745261
  C           0.90010882731551      1.14532120419846     -7.80340621445616
  H           1.06269411548590      1.55794494738816     -8.79333749212379
  C           0.90522071706128      1.99124769698330     -6.70288317615184
  H           1.06896534077631      3.05474587723941     -6.81951838395537
  C           0.66913115853058     -1.13886084764159     -8.84827682728063
  H           0.99744475973675     -0.62000408209458     -9.74978705433442
  H           1.31630792615321     -2.00356535678746     -8.68314462768289
  H          -0.34373407862491     -1.51557300179921     -9.01763248642873
  C           2.17344897987914      1.45574152835464     -0.69490503062805
  C           1.50499271632819      1.07574643883934      0.46938083463110
  H           0.42346674588619      1.01647938923210      0.48255800597122
  C           2.23479400028532      0.77013778428439      1.60822562218103
  H           1.71902077668487      0.47349230672116      2.51450089904444
  C           3.62397745273488      0.84243576817821      1.58608257295380
  H           4.19135079288460      0.60238665411777      2.47888511478024
  C           4.28866451770164      1.22114326691944      0.42381383116327
  H           5.37122366337767      1.27804370033599      0.40892611734655
  C           3.56616088002999      1.52894466040767     -0.71854621444993
  H           4.07272015916596      1.82854781186397     -1.62809198440793
*
