%chk=000069481.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069481

0 1
 O   0.9090000     -0.5961000       1.284400    
 O   -1.979100      -1.019600      -1.485800    
 O    2.894000       1.009800      -1.291500    
 O   -2.395100       1.833300      0.6418000    
 O   -4.279400       2.689700     -0.2874000    
 N  -4.0000002E-03  -2.268600     -4.3299999E-02
 N    3.315000     -0.7720000      0.1373000    
 N   -3.159500     -0.6597000      0.4817000    
 N    4.419900       2.638800      0.3168000    
 C   -1.342400      -2.236000      0.5019000    
 C    2.302200      -1.668800     -0.3721000    
 C    1.017300      -1.439500      0.3971000    
 C   -2.167800      -1.244400     -0.2922000    
 C   -4.106100      0.3019000     -3.6499999E-02
 C    3.527600      0.5020000     -0.3690000    
 C    4.671600       1.204900      0.3325000    
 C   -3.623300       1.724300      8.4399998E-02
 H   -1.298600      -1.959700       1.559700    
 H   -1.782700      -3.231700      0.3985000    
 H    2.134800      -1.481100      -1.437100    
 H    2.647100      -2.695600     -0.2205000    
 H   0.1813000      -2.921000     -0.7997000    
 H    3.889800      -1.104500      0.9060000    
 H   -3.233200     -0.9055000       1.464500    
 H   -5.027200      0.1945000      0.5431000    
 H   -4.295500      8.6900003E-02  -1.092300    
 H    5.603200      0.9692000     -0.1912000    
 H    4.754500      0.8647000       1.369400    
 H    4.414600       2.975000     -0.6457000    
 H    5.190500       3.120800      0.7782000    
 H   -2.103300       2.767500      0.7084000    


%chk=000069481-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000069481

0 1
O 0.475660 -1.397847 1.620290
O -3.464497 -1.803176 -0.853879
O 1.931018 1.326876 -1.015817
O -0.576776 0.690415 -0.867520
O -1.501373 2.789736 -0.448997
N -0.325036 -2.625777 -0.189365
N 2.717325 -0.502856 0.198843
N -2.315366 -0.543643 0.754479
N 3.219475 3.076623 0.678056
C -1.647510 -2.876393 0.424897
C 1.847841 -1.491721 -0.435030
C 0.607766 -1.822642 0.429984
C -2.593067 -1.706460 0.061082
C -2.724677 0.762917 0.238990
C 2.703344 0.832357 -0.124548
C 3.727068 1.713251 0.596867
C -1.552342 1.540971 -0.389229
H -1.505869 -2.963967 1.515002
H -2.069287 -3.810587 0.024905
H 1.516912 -1.080599 -1.405210
H 2.421418 -2.417836 -0.628779
H -0.243788 -2.794860 -1.195052
H 3.213111 -0.784465 1.046637
H -1.530035 -0.572977 1.418014
H -3.160978 1.401203 1.025620
H -3.499594 0.589311 -0.530725
H 4.683398 1.602644 0.022811
H 3.918862 1.296098 1.607625
H 2.587175 3.331997 -0.085003
H 3.892113 3.795573 0.942252
H 0.322907 1.125332 -1.095802


