%maxcore 4000
%pal nprocs 16 end
! O3LYP DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           0.16588622492223     13.22986431494899      6.50766077370402
  S           0.95788231715680     15.39406547936733      7.77656946092237
  N           1.10087835183144     13.81622322230523      7.61071080602579
  O          -0.75907370063386     12.21847389925456      6.92744088741638
  C          -0.27843401296024     15.61380727445536      6.42875945798241
  N          -0.61216269631060     14.49119491156906      5.85781103263105
  O           0.35187892460527     15.75491712848471      9.02924775308013
  C          -1.76410018892136     16.95273563327939      5.07916139103260
  H          -2.70217649659134     17.25355534581434      5.55438480467166
  H          -1.91118440929202     16.00358482591207      4.57045533882797
  N          -0.76518767224594     16.78944984116421      6.12660333266642
  O           2.17503491266714     16.07828129168429      7.43093628482388
  C          -1.30511546342727     18.01779653450071      4.10826794497106
  H          -0.41706612582924     17.66679108407332      3.56556288122914
  H          -2.10000394709775     18.21633097487895      3.38879290216593
  O          -1.02251405490592     19.22918600409842      4.76699715991351
  C          -0.00493579777841     19.05352831974784      5.72252242504005
  H           0.16260598459613     20.01898369163355      6.20066081907754
  H           0.92470900755359     18.73507085528720      5.23185539077251
  C          -0.39948206827538     18.03884063279444      6.77414777782816
  H           0.42214301244687     17.88885052953559      7.46877021675428
  H          -1.26948886028302     18.39638273246137      7.33185866080915
  C           1.16616304931822     12.56569362049904      5.23861050072668
  C           2.40272145645024     13.12853553517538      4.95810844640071
  H           2.77675069930176     13.95733107244162      5.54557386601126
  C           3.15528140368558     12.60953935048283      3.92470716010057
  H           4.12307861714000     13.04595722224270      3.70469694864404
  C           2.69707367665830     11.53569624473039      3.16335820310828
  C           1.45195719621820     10.99356491297525      3.46772353972010
  H           1.07590551704734     10.15925717595960      2.88651452575621
  C           0.68256554534999     11.49693417866422      4.49917080592407
  H          -0.28203890958671     11.06403919189733      4.72918356559220
  C           3.53402004974482     10.96707710566879      2.06961847787939
  H           4.10236193661649     11.74559730497272      1.55946341874695
  H           2.92642734026702     10.43523351026624      1.33770705881977
  H           4.25761618056154     10.25434404677117      2.47655198022311
*
