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

Copper nitrenes -- PROJECT

0 1
   7   -2.68647102    2.54205731   -1.52339505
   7   -2.59331111    1.36595845   -0.86442783
   6   -3.78766159    1.03842234   -0.32128897
   6   -4.70109081    2.03427727   -0.63371966
   6   -3.95433800    2.94834953   -1.38875707
   5   -1.28148251    0.53981905   -0.88773921
   7   -0.12577587    1.42531134   -0.35956015
   7    0.17798847    2.60751477   -0.94136992
   6    1.20652937    3.11282289   -0.24815172
   6    1.58259627    2.25659423    0.79404392
   6    0.70245078    1.19066997    0.68211995
  29   -0.98012910    3.26979067   -2.51334560
   7   -1.11919667    4.50969364   -3.92046271
   6   -1.21482561    5.85717010   -3.70582036
   8   -1.42794156    6.53684002   -4.88929157
   6   -1.60789667    7.93690462   -4.80402868
   6   -3.05797310    8.31253381   -5.15981489
  17   -4.20345669    7.56397914   -4.00972955
   6    1.76703072    4.45527269   -0.58115179
   9    1.95914277    4.61843109   -1.92104915
   6   -4.41045757    4.22348505   -2.01543743
   9   -3.71919312    5.30395542   -1.56597242
   7   -0.79270661    1.05550205   -3.30097217
   6   -0.61309437    0.37473954   -4.43648973
   6   -0.68018299   -1.01331257   -4.22816503
   6   -0.91961631   -1.12690713   -2.86886274
   7   -0.98095493    0.12184333   -2.34389532
   6   -0.33175883    1.09501358   -5.70854739
   9   -1.12285442    2.19737570   -5.87625619
   9   -4.27226276    4.21304319   -3.37342763
   9   -5.72684832    4.44655420   -1.75121531
   9    0.96125588    5.47435480   -0.17867225
   9    2.97153280    4.63712481    0.02657506
   9    0.95730568    1.54469314   -5.79327619
   9   -0.53247808    0.28928114   -6.78504451
   8   -1.08717484    6.40819237   -2.62799065
  17   -3.18578090   10.11002170   -5.06728815
  17   -3.45914743    7.77737118   -6.83186012
   6    1.38121482    4.55851098   -4.95654345
   1    1.51483565    5.60063344   -4.69468805
   1    2.37519681    2.40003977    1.51198433
   1    0.60697869    0.28554689    1.26378587
   1   -5.74335221    2.09798220   -0.36182954
   1   -3.90047725    0.12478137    0.24424550
   1   -0.57493293   -1.79977122   -4.95961746
   1   -1.05342783   -1.99686835   -2.24241331
   1   -1.39906014   -0.43045909   -0.19468727
   1   -1.39184911    8.29699752   -3.79545370
   1   -0.94567423    8.41610829   -5.53001654
   1    1.74944446    3.79196681   -4.28889929
   1   -1.35431281    4.24698895   -4.87521125
   1    1.03701020    4.29134307   -5.94796767

-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

































