# sp_wB97M-D3(BJ) 

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

%scf
maxiter 1000
end

%pal
nprocs 36 
end

* xyz 0 3
Cu    -8.082800   -1.143791  -12.389358
Cl    -8.949625    0.160577  -14.203110
Cl    -9.608591   -2.762988  -12.848386
Cu   -10.865720   -0.856362  -13.490720
Cl    -6.076010   -0.309870  -12.134909
N    -11.319650    0.596099  -12.137644
C    -10.702475    1.189473  -11.354808
C     -9.883058    1.862851  -10.435169
C     -9.963846    3.253356  -10.314396
C     -9.112657    3.916194   -9.451088
C     -8.172633    3.207040   -8.715423
C     -8.073375    1.826615   -8.830168
C     -8.930879    1.156925   -9.679379
H    -10.691756    3.791557  -10.901877
H     -9.179065    4.990037   -9.356653
H     -7.503305    3.727104   -8.045476
H     -7.337227    1.282281   -8.258990
I     -8.811447   -0.934406   -9.792079
Cl   -12.810685   -1.813727  -13.879973
*
