%chk=000083338.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083338

0 1
 O  -0.4841000       1.980500      -1.274100    
 C    1.676800     -0.2878000     -0.6585000    
 C   0.9112000      0.6273000      2.7000001E-02
 C    2.928200     -0.6305000     -0.1467000    
 C  -0.4331000       1.015700     -0.4968000    
 C    1.330100       1.218800       1.198200    
 C    3.380500     -4.8700001E-02   1.037600    
 C    1.193800     -0.9148000      -1.928400    
 C   -1.648300      0.3077000     -0.1263000    
 C    2.581500      0.8760000       1.710100    
 C    3.803100      -1.618900     -0.8460000    
 C   -1.585900     -0.7761000      0.7497000    
 C   -2.877100      0.7140000     -0.6465000    
 C   -2.752200      -1.453100       1.105600    
 C   -4.043400      3.6800001E-02 -0.2905000    
 C   -3.981000      -1.046800      0.5855000    
 H   0.7127000       1.939700       1.725600    
 H    4.353300     -0.3037000       1.449700    
 H   0.8055000      -1.918300      -1.725400    
 H   0.4042000     -0.3398000      -2.420500    
 H    1.996800     -0.9880000      -2.669200    
 H    2.933800       1.329300       2.632100    
 H    4.181800      -1.199600      -1.783700    
 H    4.671000      -1.891800     -0.2352000    
 H    3.259700      -2.547000      -1.052000    
 H  -0.6514000      -1.126000       1.177200    
 H   -2.953300       1.554900      -1.330600    
 H   -2.704100      -2.297100       1.787500    
 H   -5.000400      0.3530000     -0.6953000    
 H   -4.889100      -1.574200      0.8626000    


%chk=000083338-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083338

0 1
O -0.581847 0.797701 -2.066076
C 1.893068 -0.467436 -0.903002
C 0.780761 0.091228 -0.195706
C 3.147297 -0.588417 -0.226903
C -0.537369 0.351154 -0.875287
C 0.929562 0.517124 1.154345
C 3.270933 -0.141698 1.112046
C 1.780686 -0.949068 -2.339481
C -1.822269 0.100966 -0.128732
C 2.172293 0.411460 1.804816
C 4.357277 -1.182666 -0.928007
C -1.916926 -0.834791 0.936866
C -2.994580 0.776866 -0.563833
C -3.160665 -1.082755 1.558180
C -4.231655 0.539945 0.066595
C -4.318106 -0.391671 1.130539
H 0.075015 0.960567 1.675885
H 4.242200 -0.228049 1.614150
H 2.342280 -1.889071 -2.485649
H 0.738161 -1.104446 -2.651281
H 2.204852 -0.200169 -3.035896
H 2.287254 0.760235 2.836665
H 4.569621 -0.668845 -1.883997
H 5.256863 -1.105766 -0.294020
H 4.207141 -2.253086 -1.168343
H -1.025446 -1.381801 1.260643
H -2.907821 1.476396 -1.401920
H -3.228362 -1.814799 2.370483
H -5.128197 1.073254 -0.268038
H -5.281423 -0.580862 1.617655


