%maxcore 4000
%pal nprocs 16 end
! r2SCAN DEF2-TZVP CPCM(DMSO) def2/j verytightscf rijcosx DefGrid3 FREQ
*xyz 0 1
  S           0.11782571335029     13.20052539768611      6.52502445496257
  S           0.94379505027438     15.38057929945666      7.77906703319008
  N           1.04913526642302     13.78276046252843      7.64971194878711
  O          -0.80637509436115     12.17396940702319      6.93331725209123
  C          -0.32286030214714     15.59775605222400      6.44356607367557
  N          -0.67161071834246     14.47139443239867      5.87101920304867
  O           0.38096941622605     15.78273210239211      9.04778190988978
  C          -1.80062484068417     16.97060644840651      5.08698786655749
  H          -2.71565291740672     17.34806691803860      5.55323201947117
  H          -2.00046924479863     16.01358028393359      4.61017104598884
  N          -0.80469590893271     16.78305485835726      6.15101260001910
  O           2.16927826508547     16.03713363714493      7.37887865937187
  C          -1.26430589590450     17.98128798315527      4.08521226003790
  H          -0.37911135711227     17.57041236280962      3.57982833249744
  H          -2.03237868628126     18.20364111891426      3.34357729829686
  O          -0.93167838054045     19.20874811068659      4.72378531045610
  C           0.07879065261183     19.00300462925630      5.70335323303697
  H           0.29451025492864     19.97410614210170      6.15024116189987
  H           0.98875592836627     18.61001821488186      5.22827554296323
  C          -0.39228643599779     18.04024387470534      6.78333375818137
  H           0.40261355234111     17.86595001729301      7.50506371791333
  H          -1.26309009442292     18.45196230041793      7.30216753357103
  C           1.13393646547190     12.55472649444807      5.24762419211985
  C           2.34593579536032     13.17589693249562      4.94946738070754
  H           2.68413878485754     14.02907228791510      5.52703525598355
  C           3.11444349252832     12.67792412108101      3.91036180161850
  H           4.06076688797688     13.15326865817003      3.67348892762596
  C           2.69401770388279     11.56938331864780      3.16412039072281
  C           1.47368554773252     10.97008383689172      3.48644949463429
  H           1.13320529634497     10.11115829286246      2.91772074417625
  C           0.68674639055882     11.45309716126304      4.52374571730297
  H          -0.25696367200301     10.98240306772717      4.76991613886746
  C           3.55223809740944     11.02852202164616      2.06218138429463
  H           3.98385357108933     11.83713688267552      1.46865761153346
  H           2.98659590336124     10.36689421048830      1.40560727209761
  H           4.38684251275396     10.45561365987436      2.47918147240694
*
