%chk=TTMCu-NTst-freq.chk
%nprocshared=24
%mem=124GB
#p freq b3lyp/genecp scrf=(smd,solvent=dichloromethane) nosymm
pop=full empiricaldispersion=gd3 gfinput gfprint scf=(maxcyc=400,xqc)

Title Card Required

1 3
 C                 -1.07780622   -1.01449274    0.01410925
 C                 -0.70451722   -1.80453374   -1.22492375
 C                  0.03682878   -1.10823174    1.04423425
 C                 -1.20863422    0.43427926   -0.42562875
 C                 -1.37371222    0.92597726   -1.70416775
 H                 -1.49447022    0.44956026   -2.66440875
 C                 -1.46253522   -2.63236474   -2.01780575
 H                 -2.46840222   -3.00905574   -1.92634075
 C                  0.03889078   -1.51925374    2.35697525
 H                 -0.73380122   -1.89764474    3.00706925
 N                  1.32169278   -1.34311974    2.76733025
 N                 -1.27811822    2.26550026   -1.56624575
 N                 -0.65880522   -2.91833074   -3.07543775
 N                 -1.03024022    1.49270626    0.41994325
 N                 -1.06149622    2.59981626   -0.27364275
 N                  0.52301278   -2.31560674   -2.97635175
 N                  0.49385278   -1.63521474   -1.85292375
 N                  1.30839978   -0.72517674    0.74660825
 N                  2.09298478   -0.87308274    1.78969025
 Cu                 2.02422878   -0.50312874   -1.17245275
 O                 -2.26625222   -1.60966774    0.51006225
 C                 -3.07362322   -0.78985774    1.36546625
 H                 -3.57606222    0.00368526    0.80052625
 H                 -3.82192022   -1.46158974    1.79190225
 H                 -2.48926022   -0.33597574    2.17355625
 C                 -1.02244822   -3.59896674   -4.33024675
 H                 -0.08705722   -3.97215974   -4.75285975
 H                 -1.65696422   -4.44762574   -4.06937575
 C                 -1.02487522    3.23125826   -2.64677675
 H                 -1.84727222    3.17217526   -3.36342275
 H                 -1.02838322    4.21844326   -2.18049275
 C                  1.91603178   -1.68009974    4.07407625
 H                  2.74369078   -0.98202374    4.21434725
 H                  1.15374978   -1.47740874    4.82810725
 C                 -1.72699222   -2.63618374   -5.26510375
 C                 -1.04619722   -1.51307974   -5.75808775
 C                 -3.06326322   -2.84394274   -5.62066275
 C                 -1.69915822   -0.61018874   -6.59775275
 H                 -0.00842622   -1.34742274   -5.48033675
 C                 -3.71517522   -1.94202774   -6.46739975
 H                 -3.59392722   -3.71194474   -5.23698975
 C                 -3.03557722   -0.82386574   -6.95460875
 H                 -1.16465522    0.25429426   -6.98225375
 H                 -4.75259722   -2.11306474   -6.74141675
 H                 -3.54194122   -0.12196774   -7.61157775
 C                  2.38023178   -3.11953274    4.12284125
 C                  1.66411078   -4.07080274    4.85743625
 C                  3.52806178   -3.50990474    3.41897525
 C                  2.09218378   -5.40110874    4.89333825
 H                  0.77544978   -3.76917974    5.40655825
 C                  3.95405678   -4.83811574    3.45333825
 H                  4.08317178   -2.77287374    2.84481825
 C                  3.23650678   -5.78609174    4.19118525
 H                  1.53325378   -6.13317074    5.46981825
 H                  4.84916278   -5.13197474    2.91218525
 H                  3.57145478   -6.81937174    4.22058625
 C                  0.30728878    2.89107326   -3.28577675
 C                  0.36133978    2.26620326   -4.53684475
 C                  1.49175978    3.08776226   -2.56172275
 C                  1.58697178    1.84111626   -5.06111175
 H                 -0.55696622    2.09827426   -5.09464875
 C                  2.71529378    2.66571326   -3.08580275
 H                  1.45146378    3.55895326   -1.58264775
 C                  2.76372378    2.03555326   -4.33549975
 H                  1.61956578    1.35506426   -6.03252675
 H                  3.62985878    2.82532226   -2.52380875
 H                  3.71572978    1.69187326   -4.72714075
 N                  3.61164878    0.64170326   -0.80132175
 S                  4.52922378   -0.13629174   -1.93535375
 O                  3.47258778   -0.91193474   -2.71733675
 O                  5.44659178    0.70377326   -2.71265675
 C                  5.41638878   -1.27523274   -0.90925775
 C                  4.78289178   -2.45330674   -0.48405975
 C                  6.69888678   -0.93065974   -0.46540475
 C                  5.45923578   -3.29633974    0.38830325
 H                  3.79190278   -2.71142674   -0.84387675
 C                  7.35368078   -1.78925474    0.41189925
 H                  7.17339778   -0.01807174   -0.81051675
 C                  6.74544878   -2.97476574    0.85857125
 H                  4.98283578   -4.21533074    0.71522225
 H                  8.35220978   -1.53739774    0.75744625
 C                  7.43839978   -3.87460674    1.84686525
 H                  7.25590778   -4.93065374    1.62028925
 H                  8.51876278   -3.70127074    1.86016825
 H                  7.05985678   -3.68896674    2.86100025

-Cu 0
LANL2DZ
****
-N -C -H -O -Cl -S 0
6-31g*
****
-I     0
LANL2DZ
D   1   1.00
      0.2940000              1.0000000
****

-Cu -I 0
LANL2DZ







