%nprocshared=8
%mem=4000MB
%chk=wB_AcOH.chk
#p opt freq=noraman wb97xd/genecp scrf=(smd,solvent=dichloroethane) nosymm

opt freq

0 1
 C                  0.10975700   -0.84206200   -0.66016900
 H                  0.70543600   -1.65971200   -1.07905700
 H                 -0.17230500   -0.14758700   -1.45198100
 H                 -0.78788600   -1.28191300   -0.21380200
 C                  0.90241100   -0.12113600    0.39082200
 O                  1.21213100    1.04923300    0.36964500
 O                  1.25038100   -0.93789500    1.40009700
 H                  1.75628000   -0.40671900    2.04136800

-C -H -O -Si -N -F
6-31G(d,p)
****
-Br
LANL2DZ
D 1 1.0
0.428 1.0
****
-Rh
LANL2DZ
F 1 1.0
1.35 1.0
****
-Ag
LANL2DZ
F 1 1.0
1.611 1.0
****

-Br -Rh -Ag
LANL2DZ




