%nprocshared=20
%mem=41GB
#p opt freq=noraman b3lyp gen scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3
scf=(xqc,maxcyc=1024)

opt freq

0 1
 C                  0.21254901   -0.99214987   -0.06941412
 C                  0.45997212   -1.00959842    1.35771565
 C                  0.61046991   -1.76578605    3.60959111
 H                  1.51325011   -2.33537991    3.87557145
 H                 -0.14555720   -2.01937836    4.35893443
 C                  0.17849374   -2.02851741    2.19414300
 H                 -0.27598035   -2.96721265    1.89026725
 C                  0.54382307    0.02934060   -0.89236644
 C                  1.13069819    0.12919123    2.10269056
 H                  0.68165219    1.10398742    1.88805760
 H                  2.19159284    0.19168370    1.83628086
 H                 -0.26988365   -1.88198117   -0.47183282
 H                  1.02578129    0.90315414   -0.45514841
 C                  0.33199328    0.11244201   -2.33771709
 C                 -0.26164293   -0.90930671   -3.10176062
 C                  0.73928903    1.27577055   -3.02571981
 C                 -0.44508585   -0.78749203   -4.47762067
 H                 -0.59099229   -1.82501565   -2.61976172
 C                  0.56421492    1.41298484   -4.39545850
 H                  1.20198356    2.08679487   -2.46813805
 C                 -0.03097761    0.38059310   -5.13684933
 H                 -0.90743608   -1.60175854   -5.02315491
 H                  0.88072008    2.31178475   -4.91578915
 O                 -0.16002331    0.60608876   -6.47450000
 C                 -0.75399420   -0.40988884   -7.27821922
 H                 -0.75384801   -0.02209266   -8.29812482
 H                 -0.17294376   -1.34016402   -7.24247798
 H                 -1.78621280   -0.61525661   -6.96725599
 N                  0.94188699   -0.24126475    3.60387845
 S                 -0.35268285    0.62705746    4.30687596
 O                 -0.69896426   -0.01067546    5.81096568
 O                  0.07680553    2.23277089    4.46850557
 C                 -1.78893390    0.49918493    3.26321341
 H                 -2.20317030   -0.48394787    3.34542106
 H                 -2.51782146    1.22010168    3.56964767
 H                 -1.50917394    0.68453382    2.24720152

C H N S O 0
6-31G*
****






