%nprocshared=12
%mem=8GB
#p opt freq=noraman wb97xd/genecp scrf=(smd,solvent=dichloroethane)

Title Card Required

1 1
 O                 -0.07658000   -0.54599300    1.87892900
 C                 -0.26210000    0.68647900    2.13676700
 O                 -1.02798100    1.32947400    1.34810600
 Rh                -1.30027400   -0.41235900    0.13135200
 C                 -2.28428200   -1.24903400   -1.62509400
 H                 -1.85743400   -1.17825800   -2.61716300
 C                 -3.12647200   -0.27872500   -1.01800300
 H                 -3.46963200    0.64161800   -1.46951900
 C                 -3.40662900   -0.72384800    0.31863200
 H                 -3.99420600   -0.19463400    1.05696200
 C                 -2.01916100   -2.28615700   -0.67703200
 H                 -1.39208500   -3.15223000   -0.83704600
 C                 -2.73264900   -1.96589600    0.52034700
 H                 -2.70945400   -2.52772500    1.44477000
 C                  0.42427000    1.35874000    3.27496300
 H                  0.64385600    0.63962500    4.06486000
 H                  1.36864000    1.77514700    2.90924400
 H                 -0.18940500    2.17617600    3.65586900
 O                 -0.84196100    2.57966100   -1.74248500
 O                  0.30982300    4.08672100   -0.67921100
 N                  0.11195400    2.94781000   -1.06389600
 C                  1.06131900    1.94434600   -0.69511000
 C                  2.18023800    2.10066700    0.04851600
 C                  2.84947600    0.85315600    0.27694700
 C                  2.20097200   -0.19376100   -0.29171600
 S                  0.77362800    0.29558400   -1.18578200
 H                  2.51946700    3.05491400    0.43104400
 H                  3.76859200    0.76208800    0.84148300
 Br                 2.69845600   -1.99655100   -0.25798800

-C -H -O -Si -N -F -Cl -S
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
****
-I
LANL2DZ
D 1 1.0
0.289 1.0
****

-Br -Rh -Ag -I
LANL2DZ







