%nprocshared=20
%mem=8GB
#p opt=(ts,noeigentest,calcfc) freq=noraman wb97xd/genecp scrf=(smd,solvent=dichloroethane)

Title Card Required

1 1
 C                 -2.50476600   -0.37395300    1.27048300
 C                 -2.14693100   -0.14826700   -0.07203300
 C                 -3.76410800   -0.05241400    1.81699300
 C                 -3.13149500    0.34864500   -0.93151100
 C                 -4.69897100    0.44414800    0.91352100
 C                 -4.39772300    0.61800400   -0.43951800
 H                 -2.89497300    0.53390500   -1.97338700
 H                 -5.69285800    0.68620800    1.27529400
 H                 -5.16622300    0.98135000   -1.11413300
 Rh                -0.55681900   -1.33304200   -0.73574600
 C                 -1.04696400   -3.32472600   -1.58417200
 H                 -1.62634100   -4.05868000   -1.04050300
 C                  0.40004600   -3.18212700   -1.52589800
 H                  1.06481800   -3.79814400   -0.93608800
 C                  0.77007600   -2.12692500   -2.37335300
 H                  1.77052000   -1.75941000   -2.54729600
 C                 -1.55021200   -2.35062100   -2.46055400
 H                 -2.59114200   -2.17141400   -2.69055200
 C                 -0.44146800   -1.53706800   -2.88123700
 H                 -0.49665300   -0.68761700   -3.54912100
 O                 -0.65088800   -1.70618000    1.40671300
 O                 -1.47027800   -0.98187900    3.25586500
 C                 -4.14443900   -0.25973400    3.25574600
 H                 -3.95677000   -1.28785900    3.57800600
 H                 -5.20643600   -0.04361400    3.38707500
 H                 -3.56962200    0.39492900    3.91518500
 N                 -1.50939800   -1.03794200    2.04564800
 Si                 2.49680400    0.06663300    0.46207800
 C                  2.86052200    1.42712700    1.73513100
 C                  2.78945300   -1.66998500    1.16972000
 C                  3.37455700    0.27028000   -1.21716100
 H                  2.11409700    1.26481800    2.52707300
 H                  2.14533200   -2.32150500    0.56268400
 H                  3.40936800   -0.74174000   -1.64437200
 C                  2.65989000    2.84399200    1.18216200
 C                  4.25284400    1.29966900    2.37591500
 C                  2.61804400    1.17186800   -2.20238100
 C                  4.83126300    0.73876200   -1.06823900
 C                  2.34793300   -1.81101000    2.63397700
 C                  4.23551600   -2.15644800    0.98728000
 H                  3.16201900    1.24524600   -3.15203000
 H                  1.61593000    0.78937700   -2.42226000
 H                  2.50586800    2.18887500   -1.80983000
 H                  4.88496000    1.76561000   -0.69242600
 H                  5.41048200    0.10441800   -0.39001300
 H                  5.33447200    0.72201300   -2.04250800
 H                  4.37429000    2.05543800    3.16160400
 H                  4.41874600    0.32204500    2.83656200
 H                  5.05011000    1.46227700    1.64393900
 H                  2.78894600    3.58882300    1.97713000
 H                  3.39105300    3.07421200    0.39954700
 H                  1.66221100    2.98677700    0.75797100
 H                  4.94619700   -1.53670500    1.54507500
 H                  4.34168100   -3.18281800    1.35955400
 H                  4.54378400   -2.15486600   -0.06335100
 H                  1.31728800   -1.48313500    2.79117700
 H                  2.40862100   -2.85954000    2.95080300
 H                  2.99321200   -1.23421300    3.30456400
 C                  0.65405700    0.19647000    0.05714000
 C                 -0.43458100    0.81727500   -0.20230300
 I                 -0.90587800    2.75247600   -0.74574200

-C -H -O -Si -N -F -Cl
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







