%nprocshared=12
%mem=2GB
%chk=CGMM_0034_TS9opt.chk
# sp b3lyp/genecp scrf=(smd,solvent=dichloroethane) empiricaldispersion=gd3 integral(grid=ultrafine)

Title Card Required

0 1
 Rh                 2.67522500   -0.92207200    1.03595600
 O                  1.56884600   -2.59952700    1.61248100
 O                  3.58503100    0.82617400    0.35374800
 O                  3.34038400   -1.94802700   -0.65230200
 C                  0.73197000    0.73658000    2.39402400
 C                  0.17681200    1.59105500    3.55526100
 F                  0.60739700    1.15002900    4.74260900
 F                  0.58850100    2.86644300    3.39921800
 F                 -1.16737600    1.58527400    3.55912400
 O                  1.83165300    0.16442800    2.60566800
 O                  0.02421400    0.75447700    1.34855200
 Rh                 0.70483900   -0.27177100   -0.32021000
 O                 -0.23827600   -1.97829900    0.36670600
 O                  1.51953100   -1.34710800   -1.88751700
 O                  1.77807300    1.39569400   -0.91468700
 C                  0.40490300   -2.72776300    1.15547300
 C                  2.92845800    1.56565400   -0.42490900
 C                 -0.39196300   -3.97015300    1.61007700
 F                 -0.78104400   -4.68327500    0.53759500
 F                 -1.49575300   -3.57981500    2.27608400
 F                  0.32806200   -4.76373800    2.41018600
 C                  3.59578000    2.91281200   -0.77952000
 F                  3.29077900    3.80910600    0.18549200
 F                  3.15177800    3.39371600   -1.94966500
 F                  4.92850400    2.79941300   -0.84098100
 C                  2.62541800   -1.92423200   -1.68629700
 C                  3.13868800   -2.72100300   -2.90577200
 F                  3.21312700   -1.92011600   -3.98350800
 F                  4.34682100   -3.25124000   -2.68599700
 F                  2.27895400   -3.71997300   -3.18387600
 C                 -2.21824400    1.39646800   -0.64389000
 C                 -3.49257300    1.38265400   -1.26958700
 H                 -3.63292500    1.91012300   -2.20754500
 C                 -1.85053000    2.76733000   -0.69869900
 C                 -1.63003400    3.51211000   -1.98040900
 C                 -1.51652600    3.52540800    0.54862600
 C                 -0.15058100    3.98445400   -2.03757900
 H                 -2.27305700    4.40247200   -2.00941800
 H                 -1.85291400    2.89356600   -2.85272900
 C                 -0.04394400    4.02073600    0.48753200
 H                 -2.16754000    4.40903300    0.60849200
 H                 -1.67998100    2.91921900    1.44133300
 C                  0.22224400    4.80833800   -0.79927700
 H                 -0.01038800    4.56995600   -2.95313600
 H                  0.49947800    3.10746300   -2.10243000
 H                  0.15611400    4.62908500    1.37569100
 H                  0.61818100    3.15255000    0.53278200
 H                  1.27895700    5.09151900   -0.84687900
 H                 -0.36205700    5.73888900   -0.78760400
 C                 -4.62268000    0.72771900   -0.70008300
 H                 -4.46216500    0.18519200    0.22953900
 C                 -5.85047800    0.73704400   -1.29435300
 H                 -5.95300100    1.29653800   -2.22412300
 C                 -7.05480600    0.05125900   -0.84916900
 C                 -8.20119900    0.10231500   -1.67162200
 C                 -7.13920000   -0.66815900    0.36420900
 C                 -9.37980200   -0.54387200   -1.30533000
 H                 -8.15452200    0.65319000   -2.60768700
 C                 -8.31855100   -1.30987300    0.72833500
 H                 -6.28022100   -0.72464200    1.02536900
 C                 -9.44400700   -1.25368800   -0.10333900
 H                -10.24787300   -0.49390100   -1.95649300
 H                 -8.36388500   -1.85753400    1.66547100
 H                -10.36110400   -1.75893500    0.18540600
 H                 -2.16862000    0.92592900    0.33313600
 O                 -0.96648200    0.33447900   -1.49909800
 C                 -1.60422700   -0.74161200   -2.16628400
 H                 -2.41142500   -0.36051200   -2.80700000
 H                 -0.87943000   -1.25178700   -2.81083800
 H                 -2.03559500   -1.47471200   -1.46936300

-C -H -O -Si -N -F -Cl
6-311++G(d,p)
****
-Rh  
S   1   1.00
      2.6460000              1.0000000
S   1   1.00
      1.7510000              1.0000000
S   1   1.00
      0.5713000              1.0000000
S   1   1.00
      0.1438000              1.0000000
S   1   1.00
      0.0428000              1.0000000
P   1   1.00
      5.4400000              1.0000000
P   1   1.00
      1.3290000              1.0000000
P   1   1.00
      0.4845000              1.0000000
P   1   1.00
      0.0869000              1.0000000
P   1   1.00
      0.0257000              1.0000000
D   2   1.00
      3.6690000              0.0760059
      1.4230000              0.5158852
D   1   1.00
      0.5091000              1.0000000
D   1   1.00
      0.1610000              1.0000000
F   1   1.00
      1.3500000              1.0000000
****

-Rh
RH-ECP     3     28
f potential
  5
0    600.3243032             -0.0538958
1    157.6910176            -20.1316282
2     49.8841995           -105.3654121
2     15.5966895            -42.3274370
2      5.5099296             -3.6654043
s-f potential
  5
0     59.3442526              2.9753728
1     83.7426061             25.1230306
2     18.4530248            626.0926145
2     12.4194606           -812.2549385
2      8.8172913            467.3729340
p-f potential
  5
0     53.4309068              4.9537213
1     65.6671843             20.4871116
2     16.8369862            598.0120139
2     11.3042136           -718.4059028
2      8.0312444            382.8173151
d-f potential
  4
0     64.3993653              3.0279532
1     43.4625053             24.7526516
2     19.4020301            142.6844289
2      4.6879328             32.1406857





