%chk=000148936.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148936

0 1
 O   0.6534000       2.240600      0.5700000    
 O    5.415300      -2.224500     -0.3062000    
 O   -4.677400     -0.8387000     -0.6130000    
 O   -3.386300      -2.523400     -3.6300000E-02
 N    1.994700     -0.8904000     -8.3200000E-02
 N   -3.573300      -1.299600     -0.2374000    
 C  -0.1930000     -2.2000000E-03  0.5919000    
 C    1.126800     -0.5371000       1.040800    
 C  -0.3715000       1.364200      0.3753000    
 C   -1.253600     -0.8850000      0.3880000    
 C    3.264200      -1.416300      0.3929000    
 C   -2.492600     -0.4015000     -3.2400001E-02
 C   -1.610600       1.847600     -4.5299999E-02
 C   -2.671200      0.9648000     -0.2490000    
 C    4.165200      -1.745200     -0.7854000    
 C    1.068700       3.012300     -0.5551000    
 C    2.541200       3.334500     -0.4157000    
 H    1.622100      0.1937000       1.693300    
 H   0.9558000      -1.421700       1.668900    
 H    2.163900     -6.2199999E-02 -0.6542000    
 H   -1.091700      -1.946700      0.5608000    
 H    3.109400      -2.322500      0.9915000    
 H    3.772800     -0.6927000       1.042400    
 H   -1.767200       2.910200     -0.2097000    
 H   -3.622500       1.377800     -0.5745000    
 H    4.360900     -0.8567000      -1.394700    
 H    3.723900      -2.512500      -1.430400    
 H   0.9076000       2.461900      -1.490400    
 H   0.4863000       3.939500     -0.5855000    
 H    2.891500       3.936700      -1.258500    
 H    2.729900       3.882800      0.5132000    
 H    3.133800       2.414900     -0.3679000    
 H    5.241400      -3.027500      0.2139000    


%chk=000148936-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148936

0 1
O 0.980545 1.833360 -0.050497
O 5.601995 -2.388072 -0.295344
O -4.903143 -0.651196 -0.379090
O -3.752116 -2.355571 0.611139
N 2.132249 -0.909163 0.004155
N -3.816030 -1.170861 0.094287
C -0.190099 -0.169013 0.514478
C 1.111565 -0.728292 1.066445
C -0.236533 1.146858 -0.045832
C -1.378913 -0.914644 0.549309
C 3.367429 -1.575723 0.469609
C -2.581848 -0.367479 0.042561
C -1.445553 1.689234 -0.553808
C -2.627254 0.928631 -0.509854
C 4.318172 -1.809812 -0.720217
C 1.014463 3.225437 -0.564983
C 2.449394 3.718761 -0.410822
H 1.471874 -0.061660 1.889672
H 0.910826 -1.717894 1.517181
H 2.336813 -0.001702 -0.438844
H -1.392264 -1.926846 0.962706
H 3.084540 -2.554208 0.911073
H 3.919330 -1.010052 1.260248
H -1.474267 2.694186 -0.981999
H -3.574222 1.316894 -0.893333
H 4.596149 -0.848803 -1.188022
H 3.813406 -2.436870 -1.482834
H 0.696203 3.225097 -1.626453
H 0.307176 3.842461 0.023983
H 2.528120 4.760265 -0.771181
H 2.761489 3.691859 0.646794
H 3.146197 3.096371 -0.997769
H 5.442208 -3.296451 0.065345


