%chk=000146872.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146872

0 1
 O  -0.8463000       2.457400     -0.5136000    
 O    2.106400      -3.286700      0.1589000    
 N    1.898000       1.760000     -6.6100001E-02
 N   -1.489300      0.6139000      0.7411000    
 N    3.525400      -1.394900      1.5600000E-02
 N   -2.728400      -1.704800      -1.099200    
 N   -4.515500      -1.777800      0.4413000    
 C   0.8515000      0.9255000      1.2800000E-02
 C    1.246900     -0.3597000      5.6000002E-02
 C    2.662000     -0.3243000     -6.9999998E-04
 C   -2.879000      0.9610000      0.8718000    
 C    3.037700      0.9988000     -7.5700000E-02
 C  -0.5542000       1.402500      4.4000000E-02
 C   -3.725700      0.3948000     -0.2603000    
 C    1.875100       3.204900     -0.1277000    
 C   -3.667400      -1.121700     -0.2894000    
 C    3.202600      -2.748900      9.1200002E-02
 H   0.6107000      -1.231400      0.1137000    
 H   -2.975700       2.051600      0.8964000    
 H   -3.216100      0.5686000       1.837200    
 H    4.016600       1.456900     -0.1350000    
 H   -1.176500     -0.2401000       1.192800    
 H   -3.384100      0.7834000      -1.226800    
 H   -4.769200      0.7037000     -0.1301000    
 H    1.249900       3.585000      0.6842000    
 H    2.892000       3.587900     -5.7000001E-03
 H    1.486600       3.504600      -1.104000    
 H    4.513700      -1.158900     -3.3599999E-02
 H    4.129600      -3.347700      8.3099999E-02
 H   -2.644700      -2.713500      -1.163800    
 H   -2.079900      -1.152600      -1.650500    
 H   -4.354700      -2.782700      0.3105000    


%chk=000146872-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146872

0 1
O -0.816936 2.876226 -0.079520
O 1.777144 -3.155449 -0.217138
N 1.958732 1.850478 0.058521
N -1.544800 0.764087 0.616043
N 3.423281 -1.469740 -0.165933
N -2.427286 -1.923696 -0.634830
N -4.545311 -1.871666 0.560306
C 0.796797 1.071156 0.142515
C 1.175929 -0.287506 0.073180
C 2.598969 -0.322351 -0.051991
C -2.980933 1.060350 0.552356
C 3.060299 1.010532 -0.055514
C -0.563233 1.658886 0.217839
C -3.720495 0.174550 -0.492432
C 2.037800 3.323019 0.091048
C -3.602832 -1.311926 -0.167393
C 2.984761 -2.782038 -0.240557
H 0.533483 -1.163942 0.081967
H -3.078619 2.126551 0.286372
H -3.443302 0.900593 1.544094
H 4.070563 1.408993 -0.129907
H -1.270628 -0.182225 0.887924
H -3.323931 0.394248 -1.501697
H -4.791600 0.432122 -0.471869
H 1.547489 3.715786 0.995890
H 3.100620 3.616126 0.090207
H 1.521871 3.756106 -0.779300
H 4.433700 -1.317546 -0.204659
H 3.835089 -3.496270 -0.325443
H -2.258016 -2.917671 -0.480608
H -1.822728 -1.445545 -1.302108
H -4.367876 -2.877436 0.771038


