%chk=000115601.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115601

0 1
 O   -2.166800     -0.1632000       1.493100    
 N  -0.4437000      0.4285000      7.9400003E-02
 N    2.133900     -0.7823000     -4.3000001E-02
 C   0.5400000      0.7800000       1.087200    
 C   0.2743000      0.4419000      -1.186500    
 C    1.255100       1.971800      0.4356000    
 C    1.080100       1.745600      -1.080600    
 C    1.477900     -0.4398000       1.236300    
 C    1.195500     -0.8001000      -1.185000    
 C   -1.718800     -1.5200000E-02  0.3550000    
 C    2.878900      -2.032500      5.6200001E-02
 C   -2.578000     -0.3132000     -0.8460000    
 C   -3.928500     -0.8215000     -0.4017000    
 H   7.4400000E-02   1.033700       2.044400    
 H  -0.3891000      0.4324000      -2.054500    
 H    2.306000       2.055400      0.7299000    
 H   0.7576000       2.908200      0.7156000    
 H   0.5040000       2.579000      -1.500400    
 H    2.035900       1.703700      -1.612500    
 H   0.8946000      -1.295400       1.602400    
 H    2.244700     -0.2125000       1.986200    
 H    1.766200     -0.8237000      -2.120800    
 H   0.5741000      -1.704700      -1.148900    
 H    2.224200      -2.887300      0.2597000    
 H    3.626300      -1.972800      0.8550000    
 H    3.425000      -2.230000     -0.8728000    
 H   -2.698100      0.6006000      -1.437100    
 H   -2.088700      -1.073900      -1.462900    
 H   -4.553100      -1.044500      -1.272700    
 H   -4.457000     -7.9200000E-02  0.2063000    
 H   -3.837900      -1.739800      0.1886000    


%chk=000115601-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115601

0 1
O -2.200196 -0.073290 1.568076
N -0.483131 0.396543 0.086106
N 2.139429 -0.769663 -0.044588
C 0.533034 0.732146 1.116003
C 0.273390 0.404680 -1.190958
C 1.266324 1.943139 0.468172
C 1.097110 1.723552 -1.075145
C 1.467658 -0.497509 1.252820
C 1.198443 -0.844225 -1.186580
C -1.772124 -0.015652 0.370135
C 3.066648 -1.911476 0.013109
C -2.653261 -0.376976 -0.839881
C -4.096721 -0.713373 -0.425240
H 0.035522 0.949383 2.073479
H -0.394381 0.381258 -2.066418
H 2.329515 1.961521 0.759085
H 0.794166 2.887793 0.789198
H 0.542548 2.559132 -1.537473
H 2.071886 1.624367 -1.580808
H 0.856085 -1.364366 1.608051
H 2.248230 -0.300105 2.012050
H 1.786913 -0.885748 -2.123509
H 0.552270 -1.760552 -1.149349
H 2.556979 -2.888839 0.208199
H 3.807492 -1.749199 0.816916
H 3.613936 -1.997894 -0.943434
H -2.647707 0.465497 -1.560645
H -2.197742 -1.238947 -1.369235
H -4.696869 -0.999472 -1.308176
H -4.576086 0.150818 0.064812
H -4.110360 -1.543342 0.300727


