%chk=000054735.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054735

0 1
 O  -0.1113000      0.7599000     -0.1290000    
 O    1.302200       1.780000      -1.627600    
 C    2.601500      -1.538600      7.7399999E-02
 C    2.286600     -0.3641000       1.057600    
 C    2.149100       1.108700      0.5663000    
 C    2.548400      -2.847900      0.9025000    
 C    4.022500      -1.437300     -0.5074000    
 C    1.587800      -1.666400      -1.066900    
 C    3.480500       1.704900      8.8500001E-02
 C    1.664500       1.968300       1.757700    
 C    1.092600       1.259500     -0.5380000    
 C   -1.182700      0.8712000      -1.071300    
 C   -2.425100      0.2802000     -0.4724000    
 C   -2.703100      -1.069600     -0.6563000    
 C   -3.287000       1.087600      0.2616000    
 C   -3.857800      -1.619200     -9.9299997E-02
 C   -4.441700      0.5380000      0.8186000    
 C   -4.727000     -0.8155000      0.6381000    
 H    3.044500     -0.3781000       1.854800    
 H    1.344400     -0.6261000       1.562700    
 H    1.554000      -3.000500       1.337500    
 H    2.773800      -3.723000      0.2822000    
 H    3.274100      -2.828100       1.723700    
 H    4.088300     -0.6810000      -1.292500    
 H    4.325200      -2.384100     -0.9706000    
 H    4.758700      -1.200800      0.2683000    
 H    1.752000      -2.596800      -1.624600    
 H    1.680000     -0.8595000      -1.797300    
 H   0.5618000      -1.701600     -0.6894000    
 H    3.410600       2.795300     -1.0400000E-02
 H    4.289900       1.490500      0.7945000    
 H    3.773200       1.335300     -0.8967000    
 H   0.7304000       1.585000       2.184300    
 H    1.475200       3.003500       1.450000    
 H    2.411300       1.985900       2.559500    
 H  -0.9197000      0.3433000      -1.996500    
 H   -1.347600       1.926800      -1.320900    
 H   -2.032700      -1.705400      -1.228000    
 H   -3.073100       2.142400      0.4104000    
 H   -4.079900      -2.673000     -0.2394000    
 H   -5.118300       1.163500       1.393400    
 H   -5.626000      -1.243400       1.072000    


%chk=000054735-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054735

0 1
O -0.173094 0.955409 -0.048359
O 1.152634 1.912874 -1.700450
C 2.595370 -1.548933 0.083921
C 2.211567 -0.321226 0.982605
C 2.203699 1.150094 0.433940
C 2.115396 -2.814949 0.853255
C 4.131645 -1.674144 -0.117592
C 1.890797 -1.517658 -1.297854
C 3.531737 1.594932 -0.223082
C 1.912148 2.085077 1.654430
C 1.057365 1.377744 -0.570609
C -1.365585 1.160987 -0.941368
C -2.513624 0.374207 -0.359550
C -2.564952 -1.035864 -0.508050
C -3.558121 1.029267 0.338329
C -3.636089 -1.776490 0.036158
C -4.635011 0.291595 0.880817
C -4.675370 -1.113570 0.731856
H 2.898562 -0.324695 1.855256
H 1.195983 -0.505430 1.383408
H 1.014945 -2.816231 0.968442
H 2.405994 -3.736068 0.313484
H 2.562432 -2.859031 1.865032
H 4.546198 -0.849724 -0.720463
H 4.371562 -2.621545 -0.637316
H 4.657236 -1.682752 0.856633
H 2.111719 -2.445678 -1.858934
H 2.225614 -0.666698 -1.917540
H 0.793008 -1.446463 -1.180175
H 3.517453 2.681348 -0.420336
H 4.377814 1.370710 0.450933
H 3.704706 1.095797 -1.189979
H 0.986644 1.783504 2.173389
H 1.807464 3.137482 1.332181
H 2.754640 2.029166 2.368040
H -1.084036 0.826837 -1.956372
H -1.576428 2.244413 -0.979879
H -1.762167 -1.551037 -1.049694
H -3.526723 2.119060 0.459125
H -3.665675 -2.865153 -0.084291
H -5.437877 0.809976 1.416641
H -5.509483 -1.687338 1.151124


