%maxcore 4000
%pal nprocs 16 end
! r2SCAN DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           4.53518820899463      3.28551304343947    -13.26376683550360
  S           5.63278225242826      3.82315525600333    -15.62874637884087
  O           4.28776503304248      1.92533876348953    -12.82148443828426
  N           4.20494837724569      3.70729394952358    -14.73957938935367
  C           6.69151275870122      3.87382175930549    -14.22072490699220
  C           3.60604628356959      4.34845023985428    -12.21457595461076
  N           6.11158710066904      3.67691917594519    -13.05805835066044
  C           2.96184116473418      3.82540376972847    -11.09780138118479
  H           3.01642047262189      2.76486917284267    -10.88655530059262
  N           8.00476842131036      4.08805357458262    -14.41115318514242
  H           8.27703614916454      4.29111035275638    -15.36417779798142
  C           2.25251660025176      4.68342868432930    -10.26676045795582
  H           1.74794800478798      4.28240749224849     -9.39379709667024
  C           2.17873194479728      6.05255382973956    -10.53508438096118
  C           2.84148764977858      6.55132011694198    -11.66436325295907
  H           2.79663147179422      7.61326738692541    -11.88367660872355
  C           3.55239830008177      5.71132656705290    -12.50528193793406
  H           4.06085746516287      6.10214799319639    -13.37938322162669
  C           1.39055689842916      6.97017709018094     -9.65149173574408
  H           1.20435413175175      6.52004757986278     -8.67591534204264
  H           1.90721034475035      7.92209173284833     -9.51320174248289
  H           0.42068173103917      7.19398558522969    -10.10777624989434
  C           9.07381156850597      4.04432118730978    -13.49897959298937
  C          10.34642419858466      4.29919277510188    -14.02597016207979
  C           8.93063540714007      3.76621963157390    -12.13682180244075
  C          11.46066970299167      4.27593157635026    -13.20156619049593
  H          10.45331168596117      4.51337380500322    -15.08489669112534
  C          10.06095869607550      3.74511784255992    -11.32503528465066
  H           7.95478789606472      3.56986198337153    -11.71927129384352
  C          11.32622676023303      3.99836262655365    -11.84301194157906
  H          12.43867903454083      4.47524996790460    -13.62575062614220
  H           9.94070456230447      3.52747818413364    -10.26915434599573
  H          12.19731983249069      3.98049260411048    -11.19810554251523
*
