%nprocshared=20
%mem=41GB
#p opt=(maxstep=17) freq=noraman b3lyp gen scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=512)

opt freq

1 1
 C                  0.48231775   -2.14120221   -0.57193428
 C                 -0.63434809   -1.48563598   -0.01995052
 C                 -1.66035410   -2.24284869    0.56292153
 C                 -0.45972707   -4.28190538    0.00751378
 H                 -2.51355206   -1.75203802    1.02227335
 H                 -0.39694507   -5.36670563    0.02555596
 C                 -0.46388547   -0.02197806   -0.15199583
 C                  1.46397120   -1.14805059   -1.14377102
 H                  1.41037205   -1.14283198   -2.24076918
 H                  2.50018165   -1.38196375   -0.87646194
 C                  0.98978413    0.22467209   -0.56437120
 H                  1.03381334    0.99583149   -1.34051647
 C                  1.89774130    0.66619851    0.58072645
 C                  1.60587860    0.46401442    1.86942511
 H                  2.29648881    0.75619095    2.65695895
 H                  0.66782874    0.01405041    2.18142503
 C                  3.18609586    1.31683751    0.14000826
 H                  2.97655681    2.25270280   -0.39619278
 H                  3.84068070    1.54496248    0.98704953
 H                  3.74024255    0.67490682   -0.55814439
 C                 -1.56908821   -3.63609127    0.56871112
 H                 -2.36146403   -4.22341342    1.02577274
 C                  0.57354040   -3.53117302   -0.56276978
 H                  1.44189517   -4.02678973   -0.99059674
 Cl                -0.96266842    2.82566951   -0.18489394
 C                 -1.54040540    1.02035534    0.04996931
 H                 -1.90968192    0.87292017    1.04334624
 H                 -2.26214720    0.66458858   -0.65530992

C H Cl 0
6-31G*
****








