%chk=000000838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000838

0 1
 O    1.808700     -0.5054000       1.794500    
 O   -2.426400       2.134600      0.3526000    
 O   -3.990700      5.2999998E-03 -0.5111000    
 N    3.820700      2.0199999E-02 -0.1998000    
 C    1.529800     -0.7240000      0.4051000    
 C   7.1199998E-02 -0.5278000      0.1643000    
 C    2.395200      0.2275000     -0.4449000    
 C  -0.5081000      0.7239000      0.3721000    
 C  -0.7138000      -1.596400     -0.2691000    
 C   -1.872300      0.9073000      0.1463000    
 C   -2.078200      -1.412900     -0.4946000    
 C   -2.657400     -0.1611000     -0.2871000    
 C    4.621400      0.9089000      -1.028300    
 H    1.813200      -1.761300      0.1863000    
 H    2.161300       1.269400     -0.1955000    
 H    2.165100      7.5400002E-02  -1.507200    
 H   8.6700000E-02   1.563300      0.7226000    
 H  -0.2778000      -2.577700     -0.4357000    
 H    4.064400     -0.9477000     -0.4079000    
 H   -2.678200      -2.253900     -0.8321000    
 H    2.767300     -0.6145000       1.917400    
 H    4.408100       1.959600     -0.8063000    
 H    4.453000      0.7264000      -2.094700    
 H    5.683000      0.7398000     -0.8227000    
 H   -3.376100       2.079600      0.1482000    
 H   -4.370400     -0.8403000     -0.8057000    


%chk=000000838-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000000838

0 1
O 1.959231 0.077973 1.693797
O -2.639938 1.977351 0.875374
O -4.043260 0.157119 -0.534210
N 3.815001 -0.070152 -0.248116
C 1.550077 -0.679922 0.516043
C 0.060850 -0.511137 0.260197
C 2.400616 -0.164882 -0.688432
C -0.608131 0.651287 0.712636
C -0.649607 -1.492162 -0.473152
C -1.971644 0.832771 0.424914
C -2.022499 -1.313204 -0.768222
C -2.675550 -0.151384 -0.320137
C 4.667416 0.868519 -1.010293
H 1.772661 -1.762782 0.665477
H 2.060529 0.855736 -0.944060
H 2.242119 -0.809889 -1.580938
H -0.069290 1.389342 1.311699
H -0.141840 -2.405010 -0.805832
H 4.249509 -0.999599 -0.162131
H -2.572755 -2.076465 -1.333140
H 2.927097 0.290698 1.502170
H 4.258192 1.889885 -0.915750
H 4.744936 0.631122 -2.095721
H 5.685634 0.872386 -0.583299
H -3.590783 1.921853 0.592240
H -4.508872 -0.561256 -1.024412


