%chk=000117000.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117000

0 1
 O    2.563800       1.004100      8.3400004E-02
 O  -0.8892000      -1.552000       2.173700    
 O    1.141700      0.5285000       1.829900    
 C   0.2941000      -1.760700      0.1670000    
 C   -1.850400     -0.3413000      0.4183000    
 C  -0.8375000      -1.221200      0.9798000    
 C    1.476700      -1.062000      8.5600004E-02
 C   -3.795800       1.343400     -0.6585000    
 C   -1.786900      2.7899999E-02 -0.9252000    
 C   -2.886500      0.1318000       1.223600    
 C   9.4499998E-02  -2.962100     -0.4767000    
 C   -2.759600      0.8703000      -1.463600    
 C   -3.859200      0.9741000      0.6850000    
 C    2.515600      -1.591200     -0.6800000    
 C    1.133600      -3.491400      -1.242300    
 C    2.344100      -2.806000      -1.344000    
 C    1.686600      0.2088000      0.7669000    
 C   -4.834900       2.245000      -1.234600    
 C    2.853800       2.284100      0.6554000    
 C    3.822200       2.996700     -0.2291000    
 C    3.573300       4.173300     -0.8145000    
 H  -0.9983000     -0.3168000      -1.587100    
 H   -2.959000     -0.1412000       2.273000    
 H  -0.8453000      -3.500600     -0.4006000    
 H   -2.700600       1.150000      -2.512200    
 H   -4.662600       1.334900       1.321800    
 H    3.476300      -1.090700     -0.7688000    
 H    1.000300      -4.437700      -1.758500    
 H    3.153900      -3.220000      -1.937500    
 H   -5.232800       2.926200     -0.4748000    
 H   -4.418600       2.866300      -2.034900    
 H   -5.660700       1.653800      -1.642400    
 H    1.921300       2.849800      0.7666000    
 H    3.306000       2.143900       1.643700    
 H    4.786200       2.524000     -0.3978000    
 H    4.320600       4.641400      -1.445900    
 H    2.628400       4.687200     -0.6772000    


%chk=000117000-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000117000

0 1
O 2.194630 1.324806 -0.904548
O -0.795115 -1.834235 2.183769
O 0.818649 1.026465 0.956398
C 0.396899 -1.762135 0.098301
C -1.784333 -0.401606 0.509716
C -0.724002 -1.321628 1.026452
C 1.369330 -0.883202 -0.464825
C -3.889743 1.306960 -0.398700
C -1.934227 -0.114323 -0.871398
C -2.701318 0.169428 1.433140
C 0.466677 -3.143709 -0.205431
C -2.976718 0.726808 -1.315667
C -3.730845 1.013451 0.985043
C 2.362998 -1.394134 -1.340320
C 1.455820 -3.646289 -1.078473
C 2.402108 -2.767310 -1.655097
C 1.404891 0.550093 -0.047246
C -5.016276 2.206326 -0.873200
C 2.330506 2.776982 -0.532843
C 3.433842 2.975617 0.473935
C 4.563840 3.680027 0.218201
H -1.247620 -0.557530 -1.601321
H -2.576406 -0.061625 2.496053
H -0.263445 -3.819315 0.251674
H -3.085866 0.935370 -2.386642
H -4.424490 1.457247 1.709840
H 3.105246 -0.703723 -1.749730
H 1.489216 -4.717630 -1.304292
H 3.173576 -3.152317 -2.330298
H -5.039480 3.154628 -0.305208
H -4.917467 2.451951 -1.944270
H -6.000291 1.720033 -0.729431
H 2.548686 3.273383 -1.490975
H 1.357014 3.110244 -0.129021
H 3.266037 2.527966 1.462231
H 5.333201 3.826865 0.984059
H 4.749575 4.136659 -0.762377


