%chk=000122000.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122000

0 1
 O   -4.244700      -2.030600      0.2970000    
 N    1.187400       2.149900     -0.1911000    
 N   0.3274000      0.1559000      5.2600000E-02
 N  -0.1341000       2.378600     -0.2291000    
 C    3.084700     -0.9965000     -0.3839000    
 C    2.790700      0.2978000      5.3399999E-02
 C    2.024600      -1.886600     -0.9492000    
 C    1.453300      0.8267000     -2.3300000E-02
 C    4.388400      -1.485700     -0.2995000    
 C    3.809300       1.099100      0.5756000    
 C  -0.6090000       1.140800     -7.7200003E-02
 C   -2.014800      0.8494000     -5.0900001E-02
 C    1.344800      -2.728500      0.1254000    
 C    5.402300     -0.6826000      0.2226000    
 C    5.112800      0.6097000      0.6600000    
 C   -2.451900     -0.4654000      0.1117000    
 C   -2.943500       1.881200     -0.1873000    
 C   -3.817600     -0.7481000      0.1378000    
 C   -4.309100       1.598500     -0.1613000    
 C   -4.746200      0.2839000      1.4000000E-03
 C   -5.654600      -2.247900      0.3153000    
 H    1.293100      -1.336700      -1.550100    
 H    2.484500      -2.572000      -1.674800    
 H    4.629900      -2.491400     -0.6336000    
 H    3.617800       2.106500      0.9375000    
 H    2.060700      -3.415500      0.5904000    
 H   0.5462000      -3.330900     -0.3192000    
 H   0.9098000      -2.124300      0.9263000    
 H    1.822200       2.933100     -0.2940000    
 H    6.417000      -1.064000      0.2898000    
 H    5.902000       1.233600       1.069200    
 H   -1.748100      -1.287400      0.2200000    
 H   -2.640600       2.917300     -0.3157000    
 H   -5.031700       2.402500     -0.2676000    
 H   -5.820500      0.1354000      1.2700000E-02
 H   -6.116600      -1.973500     -0.6392000    
 H   -6.128300      -1.745400       1.165600    
 H   -5.814300      -3.322700      0.4501000    


%chk=000122000-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122000

0 1
O -4.348231 -1.995545 0.258103
N 1.218010 2.177970 -0.187415
N 0.278429 0.174341 0.022942
N -0.145480 2.443618 -0.216000
C 3.161712 -1.054932 -0.408812
C 2.836663 0.265204 0.040604
C 2.138253 -2.037093 -0.959647
C 1.474231 0.818388 -0.043778
C 4.515392 -1.471721 -0.314592
C 3.862318 1.099784 0.575105
C -0.679861 1.185861 -0.081702
C -2.128819 0.935325 -0.051500
C 1.526511 -2.930708 0.154120
C 5.526968 -0.637474 0.204353
C 5.196712 0.660719 0.656653
C -2.601079 -0.388934 0.087665
C -3.053233 2.012403 -0.160940
C -3.992274 -0.642966 0.116585
C -4.433331 1.744605 -0.129813
C -4.920782 0.422006 0.008436
C -5.775820 -2.316453 0.300325
H 1.312384 -1.504521 -1.460230
H 2.632996 -2.681640 -1.711436
H 4.772921 -2.478475 -0.665417
H 3.604402 2.090467 0.969133
H 2.311072 -3.481093 0.705232
H 0.830388 -3.668202 -0.285719
H 0.960304 -2.307395 0.866156
H 1.875221 2.943411 -0.321177
H 6.560852 -0.995495 0.259584
H 5.966338 1.316091 1.077886
H -1.894855 -1.219170 0.173982
H -2.677048 3.033835 -0.267785
H -5.148763 2.570359 -0.213432
H -5.999305 0.240508 0.029997
H -6.285439 -2.018349 -0.637025
H -6.273988 -1.831017 1.162535
H -5.820469 -3.409510 0.414422


