%chk=000227270.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227270

0 1
 O   -2.319100      0.6104000      0.9397000    
 O  -7.8800000E-02  -1.444700     -0.5323000    
 O    2.468100      -1.327000       1.040100    
 O  -0.3243000      -2.077700       1.668200    
 O   -2.484900       2.063400     -0.8611000    
 N    1.329200      0.6867000       1.301900    
 C    3.718000      0.6872000       1.529000    
 C    4.705200      0.6478000      0.3924000    
 C    2.460000     -0.1186000       1.261900    
 C    4.641200       1.604600     -0.6207000    
 C    5.683200     -0.3460000      0.3523000    
 C   6.2100001E-02  0.2218000       1.095000    
 C    5.555400       1.567700      -1.673500    
 C    6.597600     -0.3827000     -0.7005000    
 C    6.533600      0.5739000      -1.713400    
 C  -0.1377000      -1.225900      0.8105000    
 C   -1.023000       1.007300       1.135800    
 C   -4.354200      0.7385000     -0.2167000    
 C   -5.348600       1.585500     -0.7064000    
 C   -4.674900     -0.5626000      0.1707000    
 C   -2.953100       1.222400     -0.1083000    
 C  -0.2549000      -2.803600     -0.9471000    
 C   -6.663600       1.131500     -0.8085000    
 C   -5.989900      -1.016500      6.8499997E-02
 C   -6.984200     -0.1695000     -0.4211000    
 C  -0.1624000      -2.874200      -2.456500    
 H    3.485400       1.731600       1.770000    
 H    4.177600      0.2791000       2.438500    
 H    3.882300       2.382300     -0.6013000    
 H    5.742400      -1.098100       1.134500    
 H    1.428300       1.680800       1.491800    
 H    5.505400       2.312200      -2.462700    
 H    7.358800      -1.156700     -0.7320000    
 H    7.245100      0.5451000      -2.533300    
 H  -0.9659000       2.069200       1.346700    
 H   -5.115800       2.602900      -1.009600    
 H   -3.918200      -1.248100      0.5430000    
 H   -1.237700      -3.160200     -0.6192000    
 H   0.5271000      -3.426300     -0.4984000    
 H   -7.438000       1.791000      -1.189200    
 H   -6.239400      -2.030500      0.3671000    
 H   -8.007900     -0.5232000     -0.5012000    
 H  -0.2930000      -3.901100      -2.808900    
 H   0.8085000      -2.502800      -2.800600    
 H  -0.9269000      -2.241300      -2.919100    


%chk=000227270-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227270

0 1
O -2.022957 0.540350 -0.086452
O 0.665320 -2.641680 -0.027581
O 2.007390 -1.239002 2.243196
O -1.435240 -2.078782 0.819440
O -2.384334 2.823762 -0.504037
N 1.593786 -0.085366 0.261146
C 3.948900 -0.387505 1.002773
C 4.329814 0.660167 -0.029720
C 2.437238 -0.602151 1.241149
C 4.464200 2.025020 0.339501
C 4.537038 0.302493 -1.388752
C 0.187455 -0.326733 0.250302
C 4.795662 3.005584 -0.622134
C 4.868031 1.281403 -2.353902
C 4.997626 2.637111 -1.973250
C -0.304214 -1.733639 0.401635
C -0.654546 0.733171 0.060788
C -4.279866 1.271494 -0.349608
C -5.252986 2.252835 -0.679355
C -4.677073 -0.056980 -0.033836
C -2.857891 1.679732 -0.334724
C 0.341148 -4.080164 0.205810
C -6.617967 1.906461 -0.700371
C -6.046558 -0.392542 -0.054911
C -7.016304 0.583318 -0.389027
C 1.545803 -4.885359 -0.269374
H 4.377101 -0.153111 1.993006
H 4.347622 -1.379954 0.717056
H 4.312779 2.316682 1.386063
H 4.447650 -0.749218 -1.688321
H 2.015393 0.461553 -0.494641
H 4.899239 4.053341 -0.318773
H 5.029336 0.986137 -3.396672
H 5.257194 3.396764 -2.718683
H -0.299659 1.768519 -0.013208
H -4.921012 3.270161 -0.912271
H -3.915454 -0.797751 0.229205
H -0.581960 -4.325624 -0.350500
H 0.142106 -4.212318 1.284468
H -7.369928 2.660454 -0.955869
H -6.358541 -1.412903 0.191356
H -8.078760 0.315268 -0.404163
H 1.358151 -5.963946 -0.116957
H 2.449488 -4.606573 0.299020
H 1.737879 -4.714882 -1.342823


