%chk=000108042.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108042

0 1
 O    1.803900      -1.283600      0.4872000    
 O   -6.481500     -0.6583000     -0.2872000    
 O   -6.203100       2.044700      0.2976000    
 O   0.6257000      -2.884100     -0.6905000    
 C    4.153200      -1.341000       1.059900    
 C    4.450400     -6.0000003E-04  0.4324000    
 C    3.000100      -2.061300      0.3696000    
 C    5.365200      7.5599998E-02 -0.6060000    
 C    3.802700       1.129800      0.9055000    
 C   -2.841200     -0.3461000     -0.1713000    
 C    5.639700       1.314100      -1.186100    
 C    4.077200       2.368200      0.3253000    
 C    4.995700       2.460300     -0.7205000    
 C   -4.112800     -0.9030000     -0.3081000    
 C   -2.701700       1.010600      0.1217000    
 C   -1.660500      -1.179400     -0.3350000    
 C   -5.244900     -0.1031000     -0.1519000    
 C   0.6971000      -1.822600     -9.1899998E-02
 C   -5.105200       1.253500      0.1412000    
 C   -3.833600       1.810400      0.2779000    
 C  -0.4263000     -0.8843000      0.1302000    
 H    3.912400      -1.190100       2.120100    
 H    5.051800      -1.969600       1.035300    
 H    2.843300      -3.034800      0.8485000    
 H    3.226900      -2.218000     -0.6919000    
 H    5.870100     -0.8118000     -0.9768000    
 H    3.085900       1.069800       1.719400    
 H    6.354300       1.385900      -2.000700    
 H    3.575600       3.260900      0.6877000    
 H    5.209200       3.424600      -1.172400    
 H   -4.234600      -1.960000     -0.5351000    
 H   -1.732700       1.491700      0.2174000    
 H   -1.818600      -2.114000     -0.8692000    
 H   -3.711000       2.866700      0.5019000    
 H  -0.2090000      1.7400000E-02  0.6916000    
 H   -7.146400      3.8100000E-02 -0.1468000    
 H   -5.914100       2.951800      0.4966000    


%chk=000108042-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108042

0 1
O 1.800168 -1.153914 0.559477
O -6.596905 -0.605818 -0.931752
O -6.687926 1.775018 0.343569
O 0.583136 -2.756596 -0.634437
C 4.185891 -1.281691 1.063258
C 4.655680 -0.008761 0.370685
C 3.016962 -1.988747 0.359037
C 5.814657 -0.020535 -0.447149
C 3.939743 1.208471 0.512788
C -2.992824 -0.272022 -0.012561
C 6.248627 1.150326 -1.110576
C 4.370683 2.380780 -0.147304
C 5.527059 2.356707 -0.961974
C -4.209171 -0.790832 -0.544732
C -3.020050 0.982754 0.663197
C -1.768197 -1.059648 -0.187814
C -5.413547 -0.083754 -0.406192
C 0.616956 -1.666229 -0.005827
C -5.417916 1.165586 0.271906
C -4.225576 1.697092 0.804377
C -0.510075 -0.754210 0.258274
H 3.879184 -1.070409 2.105102
H 5.020853 -2.006985 1.112769
H 2.826452 -2.987555 0.793759
H 3.192048 -2.107246 -0.725478
H 6.383747 -0.951895 -0.562902
H 3.038459 1.227340 1.135202
H 7.147830 1.121882 -1.736666
H 3.806387 3.312791 -0.026704
H 5.862237 3.266726 -1.472388
H -4.224034 -1.751097 -1.070448
H -2.099927 1.404442 1.078220
H -1.868755 -2.006095 -0.739339
H -4.237691 2.662597 1.325477
H -0.276799 0.155285 0.820197
H -7.342326 0.022743 -0.741973
H -6.661839 2.641897 0.814522


