%chk=000085745.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085745

0 1
 O    4.395300      1.5200000E-02   1.782300    
 O   -5.688900      7.5999998E-02 -5.4299999E-02
 C    2.846400     -0.5424000     -4.8700001E-02
 C    4.272900     -0.1003000      0.3658000    
 C    2.149200      0.7955000     -0.2067000    
 C    2.099400      -1.377100       1.000200    
 C    2.911500      -1.275700      -1.405800    
 C   0.6954000      0.8616000     -0.1750000    
 C   0.6113000      -1.520200      0.6502000    
 C    4.454800       1.287700     -0.2613000    
 C  -3.1700000E-02 -0.2237000      0.1894000    
 C    3.044300       1.784100     -0.3532000    
 C   2.5300000E-02   2.153700     -0.5879000    
 C   -1.518200     -0.1683000      0.1179000    
 C   -1.349700       2.345500      5.2499998E-02
 C    3.574700      -2.624400      -1.255400    
 C   -2.162700       1.081200      2.4599999E-02
 C   -2.314000      -1.325800      0.1382000    
 C   -3.562800       1.156900     -2.2100000E-02
 C   -3.707600      -1.243100      7.6399997E-02
 C   -4.331700     -3.1000001E-03 -1.9000000E-03
 C   -6.413200      -1.153300     -2.5200000E-02
 H    5.074900     -0.7668000      4.4000000E-02
 H    2.142600     -0.8781000       1.978500    
 H    2.553000      -2.359700       1.163800    
 H    3.478200     -0.6843000      -2.136800    
 H    1.915000      -1.411200      -1.843100    
 H   9.9200003E-02  -1.894900       1.545500    
 H   0.4946000      -2.280200     -0.1319000    
 H    4.889600       1.231400      -1.264400    
 H    5.061900       1.947000      0.3664000    
 H    2.816700       2.829300     -0.5031000    
 H   0.6242000       3.029400     -0.3165000    
 H  -6.8700001E-02   2.157200      -1.682000    
 H   -1.873500       3.153900     -0.4718000    
 H   -1.233800       2.654800       1.099200    
 H    4.542600      -2.596000     -0.7519000    
 H    2.933300      -3.339600     -0.7317000    
 H    3.750400      -3.049700      -2.250500    
 H    3.785400      0.7066000       2.090900    
 H   -1.869300      -2.316100      0.1945000    
 H   -4.054100       2.125900     -7.2800003E-02
 H   -4.241600      -2.187200      9.5200002E-02
 H   -6.254100      -1.691800      0.9152000    
 H   -6.190100      -1.772300     -0.9008000    
 H   -7.477900     -0.9023000     -7.3799998E-02


%chk=000085745-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085745

0 1
O 4.523964 0.102588 1.849159
O -5.739647 0.085105 -0.122374
C 2.890571 -0.518404 0.002562
C 4.340810 -0.056182 0.395445
C 2.169838 0.828958 -0.191708
C 2.136722 -1.335471 1.075555
C 2.941168 -1.266441 -1.376415
C 0.711819 0.890029 -0.143322
C 0.652174 -1.515679 0.680369
C 4.508967 1.314604 -0.331838
C -0.027659 -0.223210 0.232951
C 3.080690 1.832880 -0.415289
C -0.003326 2.164181 -0.583277
C -1.504538 -0.190229 0.165509
C -1.357373 2.338250 0.135573
C 3.516059 -2.700079 -1.330126
C -2.188531 1.068315 0.066721
C -2.288907 -1.373167 0.185497
C -3.587888 1.108338 -0.026842
C -3.697424 -1.339724 0.091541
C -4.349529 -0.088512 -0.019002
C -6.571214 -1.120571 -0.117977
H 5.113309 -0.791545 0.121105
H 2.192936 -0.803199 2.043236
H 2.611798 -2.320122 1.238299
H 3.538725 -0.652637 -2.079353
H 1.919865 -1.296290 -1.802806
H 0.098593 -1.939020 1.541418
H 0.568043 -2.273331 -0.128738
H 4.956417 1.187634 -1.339957
H 5.192370 1.974233 0.235105
H 2.843119 2.879977 -0.627989
H 0.633058 3.046472 -0.388293
H -0.160166 2.128613 -1.682391
H -1.915018 3.194887 -0.284876
H -1.161613 2.573974 1.203403
H 4.509830 -2.730223 -0.846829
H 2.854778 -3.388773 -0.774000
H 3.628923 -3.103303 -2.353311
H 3.886225 0.796597 2.161187
H -1.796945 -2.348579 0.258709
H -4.119447 2.063171 -0.099666
H -4.262332 -2.276472 0.101683
H -6.453070 -1.687563 0.825990
H -6.331989 -1.777501 -0.976942
H -7.605655 -0.757277 -0.205592


