%nprocshared=32
%mem=120GB
#p freq=projected  b3lyp/genecp scrf=(smd,solvent=n-Hexane) nosymm
empiricaldispersion=gd3

Copper nitrenes -- PROJECT

0 1
   7    2.05947490   -0.04063776    1.91402612
   7    3.40941151   -0.02829618    1.84542625
   6    3.93757079   -0.19870765    3.07775672
   6    2.89954089   -0.32360133    3.99000270
   6    1.74601911   -0.21878358    3.20322786
   5    4.14189559    0.08502444    0.47861411
   7    3.66534578    1.38134389   -0.21990847
   7    2.35174491    1.66222503   -0.37702640
   6    2.29249044    2.89983357   -0.88585009
   6    3.57505242    3.42923389   -1.07741365
   6    4.42009873    2.42149606   -0.63878835
  29    0.97448572    0.20813146    0.19517886
   7   -0.72449533   -0.07087397   -0.52940887
   6   -1.81636675    0.69927327   -0.26837382
   8   -2.91659767    0.24588852   -0.98076643
   6   -4.16219463    0.83842272   -0.68725322
   6   -5.05719574   -0.15288235    0.08001214
  17   -4.30331132   -0.60959210    1.63936262
   6    0.98624695    3.59428689   -1.08264046
   9    0.06240304    2.81168287   -1.70314616
   6    0.31770123   -0.24555198    3.63900056
   9   -0.26360695    0.98510846    3.60037475
   7    2.50912549   -1.44692224   -0.67106285
   6    2.54857995   -2.65056012   -1.25031279
   6    3.86132457   -3.14676934   -1.33923410
   6    4.62543408   -2.15260337   -0.75653978
   7    3.79314811   -1.15337649   -0.36774395
   6    1.31629112   -3.33004358   -1.73555378
   9    0.17756191   -2.76445388   -1.25440690
   9   -0.44541094   -1.05836556    2.85584167
   9    0.21456672   -0.69716220    4.91810395
   9    0.43173515    3.99727055    0.09224275
   9    1.14987467    4.71091073   -1.84558353
   9    1.21256166   -3.31067721   -3.10333468
   9    1.29803332   -4.64602169   -1.38301069
   8   -1.85708076    1.65817734    0.48150061
  17   -6.63702998    0.66298093    0.38112677
  17   -5.33937011   -1.63759324   -0.89900615
   6   -1.01205903   -0.09416183   -3.69744402
   6    0.47570606    0.05379244   -3.69915693
   1    3.83439402    4.39980932   -1.47072413
   1    5.49789812    2.36790948   -0.59251420
   1    2.96033115   -0.47073313    5.05720981
   1    5.00833910   -0.22227839    3.21757157
   1    4.18633353   -4.08802787   -1.75603784
   1    5.68976413   -2.08479205   -0.58381369
   1    5.32561421    0.13898884    0.65691919
   1   -4.03562035    1.73756307   -0.07956972
   1   -4.65731109    1.08324336   -1.63072895
   1   -0.91168492   -0.77092436   -1.24478888
   6   -1.84258466    1.13584754   -3.87431998
   6   -1.65337254   -1.42719142   -3.91160096
   1    0.84686531    0.38234599   -4.68870438
   1    0.80363635    0.81738018   -2.98228777
   1    0.98747471   -0.88293911   -3.46248960
   1   -1.88613430   -1.60046233   -4.97981245
   1   -1.01424081   -2.25534325   -3.59153396
   1   -2.61038386   -1.49877861   -3.37657056
   1   -1.79843536    1.49862413   -4.91885107
   1   -2.89736513    0.95210817   -3.64350412
   1   -1.49029953    1.96238754   -3.24710014

-F 0
LANL2DZ
P    1   1.00
      0.2733000              1.0000000
****
-Cu 0
LANL2DZ
****
-Br 0
LANL2DZ
P   1   1.00
      0.0376000              1.0000000
D   1   1.00
      0.4340000              1.0000000
****
-Cl 0
LANL2DZ
P    1   1.00
      0.0467                 1.0
D    1   1.00
      0.6480                 1.0
****
-C -N -H -B -O 0
6-31G(d)
****

-Cu -Br -Cl -F 0
LANL2DZ




