%nprocshared=20
%mem=120GB
#p freq=projected b3lyp/genecp scrf=(smd,solvent=n-Hexane) nosymm
empiricaldispersion=gd3

Copper nitrenes -- PROJECT

0 1
   6   -2.70486719    2.52076749   -1.52721632
   7   -2.61265994    1.35846405   -0.87588344
   7   -3.84204234    1.12986716   -0.36556343
   6   -4.69493494    2.13191129   -0.69388690
   6   -4.00099170    3.05930645   -1.45277543
  29   -1.01742690   -0.27498236   -0.23772144
   7   -2.49506386   -1.62417123   -0.70807542
   7   -3.75136584   -1.38936509   -0.26530370
   6   -4.57262997   -2.39714522   -0.63319245
   6   -3.83265954   -3.33192328   -1.34181646
   6   -2.53945331   -2.79503251   -1.35689552
   5   -4.10569975   -0.10432513    0.52389740
   7   -3.19306079   -0.02422260    1.77550372
   6   -3.53940236    0.14043736    3.07192675
   6   -2.38017001    0.22986705    3.82978482
   6   -1.35238608    0.10814764    2.88583699
   7   -1.84832817   -0.04433236    1.65263201
   6    0.12433495    0.14641587    3.09933263
   9    0.71406042    1.17968858    2.43070118
   6   -1.30508973   -3.39691839   -1.94134177
   9   -0.47611721   -3.91718299   -0.99719558
   6   -1.52937726    3.06335792   -2.26193577
   9   -1.32471606    2.44446902   -3.46416033
   7    0.74178498    0.24038326   -0.62489103
   6    1.83542727   -0.54017300   -0.39127050
   8    1.81246455   -1.71591926   -0.07034648
   8    3.00502147    0.16402542   -0.61339674
   6    4.22015195   -0.51558824   -0.37352908
   6    4.96176464    0.11602196    0.81899514
  17    6.49927872   -0.80131342    1.04296066
  17    5.35195579    1.84138396    0.48210211
  17    3.97352504    0.01252209    2.30585893
   9   -1.62252262   -4.40943538   -2.79408254
   9   -0.57097683   -2.48909040   -2.64576596
   9    0.41858194    0.30320311    4.41857161
   9    0.74326010   -0.98844824    2.67777851
   9   -1.68159308    4.38789944   -2.52877433
   9   -0.36200758    2.92294761   -1.56496932
   6    0.90298215    0.15762768   -3.53701888
   1   -4.16476296   -4.25874685   -1.78322253
   1   -5.61943286   -2.37325634   -0.36766198
   1   -2.28403720    0.35902489    4.89697158
   1   -4.57955524    0.18518844    3.36004922
   1   -4.36316382    3.98064846   -1.88304519
   1   -5.72252613    2.11305030   -0.36105169
   1   -5.25552075   -0.13850664    0.85894415
   1    4.03877128   -1.56989298   -0.15249649
   1    4.85486754   -0.41539402   -1.25796624
   1   -0.13187363   -0.15836712   -3.47206662
   1    0.98914501    1.19880752   -0.86429588
   6    1.98865221   -0.84689398   -3.65851486
   1    1.09748197    1.21963899   -3.64340720
   1    2.00979919   -1.29854524   -4.66758727
   1    2.97684963   -0.40671473   -3.48397140
   1    1.84416057   -1.68250156   -2.96027119

-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

































