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

Copper nitrenes -- PROJECT

0 3
   7   -1.96256162   -0.97641237    1.46093813
   7   -3.30775931   -1.02548055    1.57937173
   6   -3.65109764   -1.52198634    2.78920446
   6   -2.49064614   -1.81004068    3.49288472
   6   -1.46545982   -1.44586330    2.61060170
   5   -4.22875977   -0.44592470    0.47506315
   7   -3.87975007   -1.12723412   -0.87170641
   7   -2.62753249   -1.07892767   -1.37908928
   6   -2.67192835   -1.72379461   -2.55147104
   6   -3.96195979   -2.20007637   -2.81704409
   6   -4.69912275   -1.79395837   -1.71449739
  29   -1.14222772   -0.17282963   -0.27713770
   7    0.58519763    0.54739024   -0.37921335
   6    1.72786560   -0.18569751   -0.52855112
   8    2.84894686    0.60086068   -0.32648641
   6    4.10908189   -0.02855956   -0.42373883
   6    4.80135187   -0.05162050    0.95073624
  17    3.84785048   -1.00284984    2.12572221
   6   -1.43786111   -1.88764346   -3.37379017
   9   -0.75771080   -0.71433058   -3.52081595
   6    0.01080740   -1.50302980    2.81974444
   9    0.64123481   -2.27286672    1.89326778
   7   -2.73841908    1.53021675    0.04432406
   6   -2.83346530    2.86186613    0.05488176
   6   -4.13495446    3.28784475    0.37136277
   6   -4.82825032    2.10317384    0.55826590
   7   -3.96920703    1.07315170    0.35628717
   6   -1.64676728    3.69207761   -0.28802688
   9   -0.51731109    3.29387069    0.37350638
   9    0.58811207   -0.26807145    2.75300337
   9    0.30434047   -2.01662956    4.04515122
   9   -0.56120704   -2.77730893   -2.83457052
   9   -1.74675314   -2.33718566   -4.61999498
   9   -1.33292201    3.64458862   -1.61976577
   9   -1.85111608    4.99940450    0.01856915
   8    1.78466236   -1.36482526   -0.82522182
  17    6.42244050   -0.81076354    0.72630940
  17    5.01567297    1.62304040    1.57584887
   6    1.19904493    1.74094313   -2.98862383
   6    2.40259680    2.60911543   -2.89728294
   1   -4.29670742   -2.75294167   -3.68124879
   1   -5.74312556   -1.92765197   -1.47211623
   1   -2.39209291   -2.21884325    4.48659543
   1   -4.69090969   -1.63034994    3.06066592
   1   -4.50224886    4.29943680    0.45166795
   1   -5.86024977    1.91952445    0.82023202
   1   -5.37593713   -0.65190394    0.75142021
   1    4.00609151   -1.05533277   -0.78265218
   1    4.73347680    0.55346777   -1.10676521
   1    0.20940742    2.15531526   -2.82719313
   1    0.77934722    1.51066011   -0.11284090
   1    1.26078074    0.72004863   -3.35022095
   1    2.54471188    3.13616528   -3.86165089
   6    2.32909378    3.66329368   -1.78090801
   1    3.30219727    1.99118291   -2.77199675
   1    3.19972524    4.32927325   -1.81491528
   1    1.42762186    4.27942749   -1.87752726
   1    2.31212000    3.18569448   -0.79607029

-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
































































