%chk=000165376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165376

0 1
 O  -0.7299000     -3.6400001E-02 -7.8999996E-03
 O    2.396700       2.763600     -0.4542000    
 O   0.9076000       2.222000       1.226900    
 O   -1.525500      -1.711400       1.356200    
 N    2.941200      -1.265100      -1.156800    
 C    3.021900      2.0000000E-02 -0.4334000    
 C    2.377400      -2.175500     -0.1418000    
 C    1.576600      0.5710000     -0.3970000    
 C    3.554800     -0.3683000      0.9548000    
 C    3.121600      -1.822000       1.148300    
 C   0.8759000      -1.844700     -4.2700000E-02
 C   0.6115000     -0.3770000      0.3345000    
 C    4.235500      -1.713500      -1.663800    
 C    1.567900       1.931600      0.2385000    
 C   -1.700900     -0.7874000      0.5772000    
 C    2.483500       4.101500      4.6300001E-02
 C   -3.045800     -0.3352000      0.1396000    
 C   -4.071000      -1.256400      7.5499997E-02
 C   -3.228300      0.9922000     -0.1896000    
 C   -5.334400     -0.8315000     -0.3359000    
 C   -4.491600       1.417100     -0.6008000    
 C   -5.544700      0.5053000     -0.6740000    
 H    3.692600      0.7273000     -0.9344000    
 H    2.493500      -3.232100     -0.4082000    
 H    1.206900      0.7161000      -1.423000    
 H    3.180200      0.2753000       1.756700    
 H    4.649700     -0.3087000      0.9757000    
 H    4.008800      -2.454600       1.270000    
 H    2.503000      -1.947200       2.043100    
 H   0.3855000      -2.079600     -0.9976000    
 H   0.4497000      -2.532400      0.6938000    
 H   0.7237000     -0.2614000       1.421200    
 H    4.615400      -1.001200      -2.404500    
 H    4.123200      -2.672900      -2.180800    
 H    4.999200      -1.835000     -0.8889000    
 H    2.875900       4.098600       1.067600    
 H    1.502000       4.583700      1.0200000E-02
 H    3.172600       4.659600     -0.5930000    
 H   -3.918700      -2.300300      0.3329000    
 H   -2.429000       1.724700     -0.1280000    
 H   -6.154200      -1.541600     -0.3937000    
 H   -4.656500       2.458700     -0.8612000    
 H   -6.528400      0.8363000     -0.9937000    


%chk=000165376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165376

0 1
O -0.636585 -0.190535 -0.210953
O 1.727506 2.862957 -0.408871
O 1.328056 1.859526 1.652918
O -1.514196 -1.466815 1.536511
N 3.232829 -1.245306 -1.216622
C 3.171057 -0.058116 -0.310980
C 2.572557 -2.296325 -0.373155
C 1.689794 0.462987 -0.364328
C 3.567413 -0.591100 1.113417
C 3.177810 -2.107749 1.066378
C 1.048813 -2.018526 -0.405938
C 0.742895 -0.624281 0.177895
C 4.606031 -1.591638 -1.652453
C 1.542606 1.755345 0.422030
C -1.688039 -0.680225 0.571687
C 1.650568 4.185362 0.260012
C -3.010928 -0.158757 0.118035
C -4.168239 -0.571977 0.828059
C -3.135234 0.725005 -0.985637
C -5.439895 -0.105252 0.437856
C -4.410278 1.188894 -1.372724
C -5.563371 0.775886 -0.663258
H 3.840125 0.738662 -0.677680
H 2.774297 -3.297370 -0.791610
H 1.465133 0.663790 -1.424882
H 3.045681 -0.044545 1.917681
H 4.651765 -0.463872 1.278261
H 4.065308 -2.750695 1.201461
H 2.451691 -2.379176 1.852641
H 0.711839 -2.052689 -1.457662
H 0.497776 -2.784066 0.168423
H 0.773283 -0.647776 1.282355
H 5.018098 -0.757056 -2.246860
H 4.561094 -2.480500 -2.306184
H 5.319145 -1.809957 -0.821956
H 2.422818 4.264057 1.043760
H 0.656979 4.320495 0.719003
H 1.821251 4.915960 -0.542802
H -4.046019 -1.252682 1.677096
H -2.235590 1.036374 -1.523502
H -6.331809 -0.424536 0.987709
H -4.506853 1.870767 -2.224656
H -6.552083 1.138657 -0.966379


