%chk=000082112.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082112

0 1
 O    1.557800      0.3019000     -0.6609000    
 N   -3.870300     -0.2278000      0.4257000    
 C    2.468000     -0.1227000      0.3526000    
 C   0.2295000      0.1718000     -0.3945000    
 C    3.331700      -1.250700     -0.1908000    
 C    3.304700       1.064900      0.8037000    
 C  -0.5934000       1.298000     -0.3875000    
 C  -0.3090000      -1.087100     -0.1285000    
 C   -2.493600     -9.3699999E-02  0.1509000    
 C   -1.954900       1.165300     -0.1149000    
 C   -1.670600      -1.219800      0.1441000    
 H    1.932700     -0.4964000       1.236100    
 H    3.887400     -0.9235000      -1.076600    
 H    4.046900      -1.600900      0.5598000    
 H    2.714900      -2.098800     -0.5045000    
 H    4.018000      0.7782000       1.582400    
 H    2.660600       1.859500       1.195400    
 H    3.858200       1.495300     -3.8199998E-02
 H  -0.1792000       2.281300     -0.5932000    
 H   0.3146000      -1.976200     -0.1392000    
 H   -2.585700       2.050600     -0.1125000    
 H   -2.078800      -2.206600      0.3475000    
 H   -4.467300      0.5885000      0.4317000    
 H   -4.261300      -1.140200      0.6195000    


%chk=000082112-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082112

0 1
O 1.551645 0.879935 0.138395
N -3.947385 -0.495343 -0.063693
C 2.608347 -0.064585 0.582096
C 0.208759 0.440794 0.108921
C 2.921225 -1.086330 -0.527251
C 3.810358 0.821582 0.927604
C -0.721891 1.375389 -0.407835
C -0.260750 -0.814902 0.566958
C -2.579905 -0.190581 -0.005491
C -2.092719 1.068814 -0.464640
C -1.638928 -1.122228 0.510046
H 2.257156 -0.583679 1.499403
H 3.294301 -0.561650 -1.424741
H 3.699015 -1.795665 -0.188046
H 2.026242 -1.664078 -0.814868
H 4.655559 0.204098 1.282320
H 3.544079 1.545529 1.716437
H 4.135495 1.385210 0.035303
H -0.349058 2.343546 -0.757693
H 0.425341 -1.564130 0.974105
H -2.795028 1.809742 -0.866633
H -1.983640 -2.099973 0.869391
H -4.612205 0.171374 -0.442408
H -4.295112 -1.391970 0.260420


