%nprocshared=24
%mem=120GB
#p opt freq=noraman b3lyp genecp scrf=(smd,solvent=dichloromethane) nosymm empiricaldispersion=gd3

ch3rh_complex_dichloromethane 

1 1
 Rh	-0.682201000	 0.590583000	 0.246246000
 N	-0.436783000	 2.604382000	 0.197743000
 N	 1.306940000	 0.730071000	 0.211423000
 N	-0.852210000	-1.395346000	 0.144445000
 N	-2.696970000	 0.381636000	 0.134357000
 C	-3.109834000	-0.838882000	 0.015857000
 C	-2.036780000	-1.889498000	-0.021776000
 C	 1.827205000	 1.910695000	 0.111011000
 C	 0.793615000	 3.000348000	 0.143566000
 C	-1.636751000	 3.447913000	 0.213961000
 H	-1.893393000	 3.630868000	 1.262726000
 H	-1.432982000	 4.411781000	-0.252834000
 C	-2.829991000	 2.797550000	-0.509999000
 H	-3.594023000	 3.576763000	-0.585386000
 H	-2.547829000	 2.543932000	-1.534993000
 C	-3.523272000	 1.593790000	 0.154333000
 H	-4.471741000	 1.418364000	-0.353717000
 H	-3.741586000	 1.823490000	 1.202525000
 C	 1.253847000	 4.419351000	 0.108816000
 H	 1.676097000	 4.646578000	-0.875355000
 H	 0.453036000	 5.123462000	 0.318105000
 H	 2.050543000	 4.569326000	 0.841218000
 C	-4.534119000	-1.270134000	-0.095790000
 H	-4.735123000	-1.612891000	-1.116148000
 H	-4.722206000	-2.115478000	 0.569620000
 H	-5.230657000	-0.472662000	 0.149431000
 C	-2.304799000	-3.348767000	-0.203102000
 H	-3.211684000	-3.481183000	-0.794431000
 H	-1.480021000	-3.784836000	-0.769822000
 C	-2.444362000	-4.065368000	 1.151872000
 H	-3.269319000	-3.650546000	 1.736078000
 H	-2.640559000	-5.127983000	 0.991344000
 H	-1.527611000	-3.970274000	 1.738335000
 C	 3.298015000	 2.159561000	 0.015624000
 H	 3.476490000	 3.085643000	-0.532255000
 H	 3.751662000	 1.349039000	-0.557634000
 C	 3.940787000	 2.235626000	 1.412334000
 H	 5.013046000	 2.422258000	 1.318473000
 H	 3.504634000	 3.042933000	 2.005597000
 H	 3.801776000	 1.298264000	 1.955941000
 O	 2.082264000	-0.380824000	 0.136555000
 O	 0.248387000	-2.184793000	 0.070049000
 B	 1.485846000	-1.632318000	 0.734958000
 F	 1.212184000	-1.406267000	 2.092267000
 F	 2.454104000	-2.608310000	 0.538927000
 C	-0.558950000	 0.529149000	-1.802122000
 H	-1.533153000	 0.259834000	-2.208707000
 H	-0.249096000	 1.507335000	-2.168229000
 H	 0.182657000	-0.225301000	-2.067057000

-H -C -N -O -P -B -S -Al -Cl -F -He -Si -As -Se 0
6-311+g*
****
-Rh  0
sdd
****
-Br     0
S   2   1.00
1.1590000             -3.0378769
0.7107000              3.3703735
S   1   1.00
0.1905000              1.0000000
P   2   1.00
2.6910000             -0.1189800
0.4446000              1.0424471
P   1   1.00
0.1377000              1.0000000
P   1   1.00
0.0376                 1.0
D   1   1.00
0.4340                 1.0
****

-BR     0
BR-ECP     3     28
f potential
4
1    213.6143969            -28.0000000
2     41.0585380           -134.9268852
2      8.7086530            -41.9271913
2      2.6074661             -5.9336420
s-f potential
4
0     54.1980682              3.0000000
1     32.9053558             27.3430642
2     13.6744890            118.8028847
2      3.0341152             43.4354876
p-f potential
5
0     54.2563340              5.0000000
1     26.0095593             25.0504252
2     28.2012995             92.6157463
2      9.4341061             95.8249016
2      2.5321764             26.2684983
d-f potential
5
0     87.6328721              3.0000000
1     61.7373377             22.5533557
2     32.4385104            178.1241988
2      8.7537199             76.9924162
2      1.6633189              9.4818270
-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd

