%chk=000000413.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000413

0 1
 O    3.742000       1.116000      0.2667000    
 N    1.513700      0.5251000      0.6806000    
 N   -3.136100     -0.7841000      0.3571000    
 C   0.6464000     -0.5932000      0.3936000    
 C    1.307200      -1.229000     -0.8261000    
 C    2.791300     -0.9365000     -0.6220000    
 C  -0.7937000     -0.2067000      0.1815000    
 C    2.784400      0.3695000      0.1358000    
 C   -1.133100       1.027300     -0.3642000    
 C   -1.824800      -1.068500      0.5222000    
 C   -2.471300       1.356200     -0.5494000    
 C   -3.425900      0.4241000     -0.1758000    
 H   0.7263000      -1.260800       1.261300    
 H   0.9692000     -0.7510000      -1.755000    
 H    1.096700      -2.299700     -0.9112000    
 H    3.320400     -0.8364000      -1.572600    
 H    3.269000      -1.701600     -2.4000001E-03
 H    1.265000       1.296900       1.292000    
 H  -0.3739000       1.744000     -0.6642000    
 H   -1.624300      -2.046000      0.9502000    
 H   -2.758300       2.310700     -0.9755000    
 H   -4.483500      0.6318000     -0.3007000    


%chk=000000413-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000413

0 1
O 3.765636 1.163783 0.456429
N 1.547771 0.432472 0.797806
N -3.197163 -0.685146 0.509043
C 0.635186 -0.667666 0.427789
C 1.321869 -1.222562 -0.874362
C 2.814633 -0.844075 -0.723230
C -0.801333 -0.215510 0.216237
C 2.815017 0.371120 0.223459
C -1.116026 0.972450 -0.491272
C -1.881145 -0.996877 0.698098
C -2.469197 1.316941 -0.691375
C -3.473592 0.460320 -0.181146
H 0.642903 -1.454376 1.212565
H 0.883652 -0.715469 -1.751763
H 1.147362 -2.304788 -0.985157
H 3.311696 -0.588639 -1.672463
H 3.405590 -1.648429 -0.245874
H 1.336411 1.096527 1.544573
H -0.310463 1.615472 -0.864538
H -1.688650 -1.917359 1.265131
H -2.747582 2.228897 -1.228816
H -4.535876 0.691014 -0.319231


