%chk=000135476.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135476

0 1
 O   -5.883100     -0.4989000     -0.4072000    
 O    4.644800       2.340500     -7.7200003E-02
 O   -1.176300      -2.228100      2.4499999E-02
 O    1.381200      -2.426100      0.9770000    
 C   0.2840000     -0.3492000      0.4250000    
 C   -2.276500     -0.1571000      0.1029000    
 C    2.812600     -0.7896000      9.4200000E-02
 C   -1.089700     -0.9945000      0.1808000    
 C    1.475300      -1.286700      0.5274000    
 C   -3.525700     -0.7368000     -0.1182000    
 C    3.090000      0.5535000      0.2173000    
 C   -2.165200       1.225600      0.2496000    
 C    3.720800      -1.692100     -0.4124000    
 C   -4.664000      6.6399999E-02 -0.1926000    
 C    4.341300       1.018500     -0.1876000    
 C   -3.303100       2.028600      0.1753000    
 C    4.971900      -1.227300     -0.8173000    
 C   -4.552500       1.449100     -4.5699999E-02
 C    5.282300      0.1279000     -0.7049000    
 C   -7.004800      0.3807000     -0.4708000    
 C    3.636600       3.195600      0.4599000    
 H   0.4547000      0.3300000     -0.4183000    
 H   0.2416000      0.2068000       1.368200    
 H   -3.633300      -1.812500     -0.2345000    
 H    2.341300       1.207200      0.6464000    
 H   -1.215400       1.721600      0.4219000    
 H    3.490400      -2.748600     -0.5103000    
 H   -3.215900       3.105400      0.2894000    
 H    5.704200      -1.920300      -1.221300    
 H   -5.394400       2.131300     -9.2200004E-02
 H    6.258700      0.4841000      -1.022100    
 H   -6.925700       1.073100      -1.315800    
 H   -7.161900      0.9019000      0.4797000    
 H   -7.891000     -0.2378000     -0.6464000    
 H    4.046200       4.211100      0.4687000    
 H    3.401500       2.938200       1.498200    
 H    2.745000       3.217400     -0.1762000    


%chk=000135476-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135476

0 1
O -4.813719 1.171899 -1.496637
O 4.196125 1.362128 -1.921232
O -0.086940 2.235082 -0.210035
O 0.775219 -1.240488 2.470535
C 0.472660 1.096504 1.866161
C -1.836012 0.815056 0.657616
C 2.324116 -0.431649 0.803679
C -0.473848 1.433580 0.694367
C 1.176521 -0.278744 1.750193
C -2.723264 1.234507 -0.364022
C 2.695650 0.613830 -0.086516
C -2.249408 -0.173192 1.597569
C 3.035689 -1.660993 0.798032
C -4.019492 0.682246 -0.450644
C 3.768901 0.413915 -0.984470
C -3.542819 -0.720686 1.495858
C 4.116526 -1.837423 -0.091111
C -4.437917 -0.301334 0.484196
C 4.487596 -0.809727 -0.982576
C -6.163698 0.620688 -1.642450
C 3.459298 2.632565 -1.980584
H 1.227885 1.898665 1.905640
H -0.088532 1.083317 2.814060
H -2.399695 1.987523 -1.088569
H 2.128631 1.548190 -0.101402
H -1.565658 -0.532110 2.372386
H 2.724927 -2.449854 1.489397
H -3.864588 -1.486816 2.209333
H 4.674224 -2.779974 -0.095939
H -5.438668 -0.740819 0.432721
H 5.319096 -0.930740 -1.683843
H -6.782848 0.826534 -0.747541
H -6.135136 -0.469775 -1.833351
H -6.589976 1.137962 -2.514095
H 3.925678 3.193320 -2.803348
H 3.563123 3.198146 -1.034628
H 2.386251 2.467564 -2.193349


