# sp_wB97M-D3(BJ) 

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

%scf
maxiter 1000
end

%pal
nprocs 36 
end

* xyz 0 3
Cu    -9.781229   -2.109273   -9.534319
Cl    -8.858362   -1.577889   -7.585496
Cl    -8.451265   -3.866389  -10.106612
Cu    -8.062345   -3.810192   -7.843004
Cl    -8.905216   -4.939654   -5.984413
Cl   -11.313321   -1.755628  -11.001135
H     -6.581852   -4.296024   -7.763782
B    -10.322529   -5.971628   -6.888263
N    -11.469563   -4.950698   -7.237130
H    -11.194854   -4.240404   -7.911440
H    -11.838120   -4.462276   -6.425075
H    -12.253531   -5.449806   -7.653707
H     -9.846067   -6.419954   -7.888090
H    -10.703332   -6.756801   -6.070259
*
