%nprocshared=20
%mem=8GB
%chk=CGMM_00015_retroscanRh2TFA4_whelandintermCCtBu.chk
#p freq=noraman opt=(ts,noeigentest,calcfc) b3lyp/genecp empiricaldispersion=gd3 integral(grid=ultrafine) scrf=(smd,solvent=dichloroethane)

Title Card Required

0 1
 Rh                 0.44665800   -0.02265900   -0.21970500
 O                  2.28071700    0.12015200   -1.16879300
 O                 -1.31532700   -0.00496400    0.90233600
 O                  1.26151900   -1.07265000    1.36119400
 C                 -0.40089700    2.45998900   -1.44481600
 C                 -1.18389500    3.25982800   -2.50941200
 F                 -0.58570600    3.13361300   -3.70542600
 F                 -2.43461100    2.75525100   -2.61115500
 F                 -1.27292800    4.55406800   -2.20367200
 O                 -0.36616100    1.21706400   -1.67192000
 O                  0.09586800    3.10694900   -0.48855800
 Rh                 1.05090300    2.02852100    1.00951800
 O                  2.83978800    2.02765300   -0.05774200
 O                  1.93737900    0.81831000    2.43650000
 O                 -0.73830100    1.89703500    2.01368100
 C                  3.04532400    1.07889200   -0.85492100
 C                 -1.48965600    0.91925500    1.74001200
 C                  4.43377400    1.00634000   -1.52684300
 F                  5.14956000    2.11304900   -1.32006400
 F                  4.30252200    0.81515800   -2.84977900
 F                  5.10169600   -0.04557000   -1.01090000
 C                 -2.81509400    0.89211700    2.53645400
 F                 -3.60109500    1.89994400    2.11490400
 F                 -2.56840000    1.06523600    3.84528100
 F                 -3.46790000   -0.26160100    2.37456800
 C                  1.83560100   -0.42774900    2.28093000
 C                  2.57748500   -1.29916300    3.31872000
 F                  2.64342300   -0.69905800    4.50997200
 F                  1.97785200   -2.49088400    3.46667100
 F                  3.83220900   -1.51400500    2.87144500
 C                 -0.13799600   -3.09125400   -2.65831300
 C                 -0.80888500   -4.33369700   -2.17105500
 C                 -0.76196400   -1.80514100   -2.13673000
 C                  0.95311400   -2.59535000   -1.75124300
 C                 -0.48936200   -4.93345000   -1.00195500
 C                  0.64486100   -4.45152400   -0.22954300
 C                  1.38385300   -3.37092200   -0.60872500
 H                 -0.52167000   -0.93431400   -2.73753000
 C                 -1.99155100   -1.78090300   -1.38278800
 H                 -2.23660700   -2.66155100   -0.79893500
 C                 -2.83167500   -0.71876500   -1.42748000
 H                 -2.50708500    0.15928100   -1.97991500
 C                 -4.11060500   -0.58326900   -0.74287500
 C                 -4.68440000    0.69980500   -0.65171200
 C                 -4.78308700   -1.65979100   -0.13101300
 C                 -5.86880200    0.90665400    0.05150600
 H                 -4.17727900    1.53889300   -1.12110300
 C                 -5.96855500   -1.45207200    0.56457600
 H                 -4.37516200   -2.66326500   -0.20543300
 C                 -6.51527500   -0.16770800    0.66427100
 H                 -6.28391600    1.90748600    0.12513800
 H                 -6.47221100   -2.29309400    1.03276500
 H                 -7.43927500   -0.00957200    1.21253900
 C                  0.14949400   -3.09252000   -4.16040700
 H                  0.80927000   -3.92612700   -4.42124300
 H                 -0.78288500   -3.19478700   -4.72579500
 H                  0.63432900   -2.16022800   -4.46731500
 H                 -1.60306500   -4.73428600   -2.79691000
 H                  0.96644200   -5.04290300    0.62475500
 H                  1.65482300   -1.89113200   -2.18258000
 C                 -1.21916200   -6.15202000   -0.49633200
 C                  2.73952300   -3.08603400   -0.00555600
 H                 -1.68794600   -5.94632400    0.47358600
 H                 -1.99961000   -6.47568800   -1.18990100
 H                 -0.52736900   -6.98886300   -0.34295300
 H                  2.75626900   -3.31557700    1.06123500
 H                  3.49193600   -3.71572800   -0.49784000
 H                  3.04429300   -2.04851200   -0.14287600

-Rh -Au
LanL2DZ
****
-P -C -H -O -Cl -F -N
6-31G(d,p)
****

-Rh -Au
LanL2DZ




