%chk=000162150.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162150

0 1
 O    4.315600      -2.556500      0.5203000    
 O    3.002900      -1.920700      -1.240100    
 O   -1.321400       2.301100       1.455800    
 C    3.418300     -0.3644000      0.5206000    
 C    2.720000     -0.5070000       1.885300    
 C    1.217800     -0.2714000       1.650200    
 C    1.239800      0.6163000      0.4469000    
 C    2.480000      0.5556000     -0.1993000    
 C   0.2060000       1.385400     -6.0600001E-02
 C    2.712900       1.272100      -1.362500    
 C    3.544200      -1.683300     -0.1708000    
 C   0.4350000       2.115500      -1.228600    
 C    1.679900       2.059600      -1.874800    
 C   -1.092900       1.442800      0.5904000    
 C   -2.197600      0.4925000      0.2592000    
 C   -1.972600     -0.4698000     -0.6970000    
 C   -3.394700      0.6186000      0.9245000    
 C   -4.230500      -1.256400     -0.3494000    
 C   -3.003800      -1.356900      -1.005900    
 C   -4.425900     -0.2685000      0.6159000    
 C   -5.333300      -2.204500     -0.6803000    
 H    4.410300      8.8200003E-02  0.6240000    
 H    3.095300      0.2799000       2.555100    
 H    2.900300      -1.462900       2.388000    
 H   0.7543000      0.2034000       2.519600    
 H   0.7049000      -1.210300       1.417100    
 H    3.671600       1.225200      -1.867900    
 H  -0.3519000       2.733600      -1.654600    
 H    1.838500       2.631800      -2.784900    
 H    4.393800      -3.419600      6.0899999E-02
 H   -1.033300     -0.5793000      -1.227800    
 H   -3.570300       1.379000       1.678800    
 H   -2.840300      -2.121300      -1.761000    
 H   -5.377800     -0.1789000       1.132800    
 H   -5.944200      -1.800900      -1.493700    
 H   -4.937700      -3.178400     -0.9882000    
 H   -5.977100      -2.380600      0.1881000    


%chk=000162150-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162150

0 1
O 4.533226 -1.741498 -0.842020
O 2.514021 -2.771674 -0.333004
O -1.604669 3.017153 0.150679
C 3.115432 -0.613427 0.752041
C 2.082998 -0.883051 1.885421
C 0.702113 -0.446758 1.309032
C 1.069171 0.600274 0.261534
C 2.452744 0.518992 -0.048176
C 0.275853 1.606429 -0.348791
C 3.061137 1.392663 -0.967340
C 3.308605 -1.822554 -0.158262
C 0.904831 2.523226 -1.238298
C 2.272892 2.410919 -1.559056
C -1.184746 1.832046 -0.044129
C -2.137696 0.676415 -0.014097
C -1.883006 -0.532850 -0.713385
C -3.373632 0.823075 0.672713
C -4.068441 -1.434771 -0.020963
C -2.839921 -1.568547 -0.719196
C -4.315616 -0.220844 0.678515
C -5.104467 -2.542958 -0.042181
H 4.109883 -0.316496 1.126304
H 2.344539 -0.248160 2.751254
H 2.082842 -1.935766 2.212606
H 0.020130 -0.059041 2.085448
H 0.196469 -1.308337 0.836699
H 4.125412 1.295307 -1.207888
H 0.296810 3.326081 -1.668132
H 2.727895 3.118555 -2.260223
H 4.614407 -2.514522 -1.464831
H -0.948382 -0.652257 -1.272550
H -3.570700 1.767723 1.190771
H -2.632645 -2.492883 -1.271270
H -5.258408 -0.099737 1.225767
H -5.884811 -2.337656 -0.800882
H -4.651791 -3.518360 -0.290033
H -5.616383 -2.637711 0.932022


