%nprocshared=32
%mem=120GB
#p opt=(CalcFC) SCRFDef=AsymmetricIEFPCM freq=noraman b3lyp EmpiricalDispersion=GD3 gen pseudo=read scrf=(SMD,solvent=n-hexane) scf=xqc nosymm

B3LYP_aph_sty_180L3

0 1
6        2.285973000      0.925098000      1.336274000
6       -1.071149000      2.506035000      1.754103000
6       -2.696412000     -0.801749000      1.135274000
6        0.636890000     -2.385688000      0.755334000
8       -0.851989000      1.753306000      2.748787000
8       -0.896122000      2.200244000      0.521798000
8       -2.128513000     -0.837958000      2.264849000
8       -2.191195000     -0.362860000      0.043895000
8        0.492224000     -2.076516000      1.974604000
8        0.423895000     -1.628035000     -0.249345000
8        1.781147000      0.506876000      2.417919000
8        1.711019000      0.963950000      0.192182000
45      -0.240687000      0.310208000      0.045940000
45      -0.171999000     -0.180958000      2.441500000
6       -0.220011000      0.625169000     -1.947553000
6       -1.231234000     -0.058913000     -2.803991000
8       -2.340126000      0.333051000     -3.098045000
8       -0.704840000     -1.262147000     -3.111112000
6       -1.641646000     -2.314943000     -3.469179000
1       -2.414987000     -1.894887000     -4.118277000
1       -1.039694000     -3.026940000     -4.035583000
1        0.752833000      0.784765000     -2.428247000
1       -0.715408000      1.995612000     -1.903537000
6       -0.790887000      2.869306000     -2.631554000
1       -1.806076000      3.228101000     -2.447936000
1       -0.018022000      3.562832000     -2.302265000
1       -0.656089000      2.542159000     -3.658745000
6       -2.228816000     -2.933290000     -2.212527000
1       -2.798696000     -2.188991000     -1.654369000
1       -2.891012000     -3.764511000     -2.481788000
1       -1.431394000     -3.303790000     -1.563123000
6        3.695954000      1.464981000      1.384922000
1        4.219607000      1.083520000      2.262502000
1        4.235182000      1.203483000      0.471935000
1        3.648287000      2.557926000      1.450132000
6        1.076696000     -3.796553000      0.449607000
1        1.851587000     -4.106327000      1.155696000
1        0.220388000     -4.466961000      0.580349000
1        1.438755000     -3.879941000     -0.575837000
6       -4.096363000     -1.360129000      1.036753000
1       -4.666320000     -0.828799000      0.273013000
1       -4.030574000     -2.415015000      0.746678000
1       -4.598542000     -1.298967000      2.006078000
6       -1.618633000      3.887168000      2.020173000
1       -2.695601000      3.882505000      1.818602000
1       -1.454755000      4.170709000      3.061127000
1       -1.153044000      4.614607000      1.349374000

C O H 0
6-31G(d,p)
****
Rh 0
LANL2DZ
F 1 1.000
1.350 1.000
****

Rh
LANL2DZ






