%nprocshared=20
%mem=8000MB
%chk=CGET_0005_RhCpOAc2.chk
#p opt freq=noraman wB97XD/genecp scrf=(smd,solvent=dichloroethane) 

Title Card Required

0 1
 O                  0.26643500    2.71381400    0.76699200
 C                  1.13895800    2.24192000    0.03477600
 O                  1.13917700    1.04978000   -0.50110900
 Rh                -0.38476400   -0.26996000   -0.07240200
 C                 -2.40370600   -1.16665200   -0.42326900
 H                 -2.53627800   -2.16194400   -0.82688300
 C                 -2.24725400    0.04669000   -1.19726100
 H                 -2.27318300    0.11876800   -2.27636400
 C                 -2.07692800    1.12834300   -0.28479700
 H                 -1.88301900    2.15919700   -0.54275900
 C                 -2.29227800   -0.82866400    0.94460500
 H                 -2.31577600   -1.52258300    1.77494500
 C                 -2.05261500    0.59401700    1.03981600
 H                 -1.89800300    1.15874500    1.94751600
 C                  2.39041200    3.03290700   -0.32775400
 H                  3.25973800    2.57571000    0.15727700
 H                  2.56561300    3.00505000   -1.40717100
 H                  2.29474100    4.06716700    0.00786900
 O                  1.00594300   -1.67967600   -0.99749500
 C                  1.62499700   -1.80221800    0.10871100
 O                  1.13507500   -1.23254100    1.14023200
 C                  2.91688100   -2.55853800    0.19269400
 H                  3.74146200   -1.86162800    0.00379600
 H                  3.04664900   -2.98357200    1.19035800
 H                  2.94859600   -3.34457100   -0.56457300

-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




