%chk=000081040.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081040

0 1
 O   0.9674000     -3.6300000E-02  0.1618000    
 O  -0.1023000       1.708100     -0.9104000    
 C   -1.369600      2.8800000E-02  0.2626000    
 C   -2.439200       1.088500      0.5358000    
 C   -1.857300      -1.011400     -0.7483000    
 C   -3.762300      0.4579000      0.9618000    
 C   -3.181900      -1.637000     -0.3197000    
 C   -4.244900     -0.5761000     -5.1100001E-02
 C  -0.1180000      0.6838000     -0.2412000    
 C    2.236200      0.4795000     -0.2531000    
 C    3.334400     -0.4328000      0.2745000    
 C    4.721000      6.8599999E-02 -0.1189000    
 C    5.816300     -0.8214000      0.4463000    
 H   -1.141700     -0.4659000       1.216600    
 H   -2.612900       1.697200     -0.3613000    
 H   -2.093900       1.779100       1.315200    
 H   -1.104000      -1.799400     -0.8701000    
 H   -1.977600     -0.5463000      -1.735800    
 H   -4.521500       1.239000       1.081500    
 H   -3.639300     -2.0400001E-02   1.941300    
 H   -3.025800      -2.234900      0.5867000    
 H   -3.534300      -2.323400      -1.097900    
 H   -5.159000      -1.054900      0.3177000    
 H   -4.504000     -7.2999999E-02 -0.9909000    
 H    2.362100       1.492200      0.1475000    
 H    2.271000      0.5169000      -1.348200    
 H    3.176000      -1.450500     -0.1038000    
 H    3.251700     -0.5033000       1.366400    
 H    4.865900       1.091200      0.2485000    
 H    4.809200      0.1006000      -1.211100    
 H    5.776200     -0.8467000       1.540000    
 H    5.719200      -1.846600      7.4800000E-02
 H    6.800700     -0.4449000      0.1511000    


%chk=000081040-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081040

0 1
O 0.979293 0.073969 0.265170
O -0.059679 1.843749 -0.838674
C -1.424989 0.126350 0.322738
C -2.576710 1.146689 0.493138
C -1.819320 -0.989444 -0.697357
C -3.889124 0.442128 0.909416
C -3.129911 -1.689123 -0.268783
C -4.281060 -0.671083 -0.091593
C -0.144770 0.802013 -0.146083
C 2.303898 0.584809 -0.200553
C 3.364202 -0.401780 0.288962
C 4.789553 0.030694 -0.131069
C 5.869896 -0.959927 0.353395
H -1.210995 -0.366624 1.291581
H -2.719405 1.683378 -0.464366
H -2.296195 1.909779 1.244089
H -0.996656 -1.723971 -0.781209
H -1.957311 -0.526540 -1.695572
H -4.702974 1.188355 0.989617
H -3.764300 -0.004328 1.918120
H -2.962900 -2.223647 0.689261
H -3.405135 -2.454743 -1.019831
H -5.198797 -1.187371 0.250545
H -4.516171 -0.212264 -1.074193
H 2.452665 1.599502 0.214165
H 2.283216 0.666090 -1.303566
H 3.142941 -1.407166 -0.118488
H 3.306762 -0.482107 1.391663
H 5.003684 1.040356 0.274345
H 4.838166 0.120501 -1.235352
H 5.865249 -1.043431 1.456427
H 5.694357 -1.970791 -0.060128
H 6.880321 -0.637824 0.042484


