# sp_wB97M-D3(BJ) 

! wB97M-D3BJ def2-QZVP SlowConv SMD(Acetonitrile)
! GuessMix

%scf
maxiter 1000
end

%pal
nprocs 36 
end

* xyz 0 1
Cu    -8.108297   -1.147881  -12.419466
Cl    -8.948738    0.070664  -14.303067
Cl    -9.598134   -2.806413  -12.848956
Cu   -10.847344   -0.897216  -13.479579
Cl    -6.131171   -0.245750  -12.165892
N    -11.263395    0.638372  -12.203187
C    -10.666305    1.222637  -11.399269
C     -9.865291    1.883595  -10.452870
C     -9.946670    3.272065  -10.314376
C     -9.112510    3.922499   -9.424667
C     -8.188470    3.202107   -8.680731
C     -8.090090    1.822706   -8.812530
C     -8.930716    1.166247   -9.688333
H    -10.662237    3.819407  -10.908606
H     -9.180237    4.994968   -9.316610
H     -7.530751    3.711343   -7.991269
H     -7.365915    1.269333   -8.234645
I     -8.817474   -0.926218   -9.820320
Cl   -12.821058   -1.833501  -13.755233
*
