# sp_wB97M-D3(BJ) 

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

%scf
maxiter 1000
end

%pal
nprocs 36 
end

* xyz 0 3
Cu    -8.066428   -1.141840  -12.367383
Cl    -8.931835    0.100239  -14.199455
Cl    -9.550712   -2.833935  -12.720504
Cu   -10.849236   -0.931276  -13.350664
Cl    -6.060775   -0.273331  -12.162337
H    -12.184168   -1.702841  -13.433725
N    -11.343335    0.540151  -12.040859
C    -10.712371    1.144260  -11.276484
C     -9.876317    1.842515  -10.388718
C     -9.975946    3.233783  -10.287387
C     -9.115811    3.924157   -9.454931
C     -8.148544    3.241504   -8.730695
C     -8.031597    1.860833   -8.826065
C     -8.896469    1.163969   -9.645285
H    -10.726631    3.751262  -10.865038
H     -9.197407    4.998247   -9.375351
H     -7.471832    3.782210   -8.084715
H     -7.274060    1.337198   -8.263465
I     -8.746061   -0.928557   -9.734440
*
