%chk=000069232.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069232

0 1
 O   2.1600001E-02   1.514800      0.2634000    
 N   -1.155600     -0.4688000     -0.1455000    
 N    1.151800     -0.4801000     -0.1981000    
 C   -2.490600     -7.3399998E-02 -2.9899999E-02
 C    2.509800     -8.7099999E-02 -0.1415000    
 C   -3.526600     -0.9904000     -0.2085000    
 C    3.482700     -0.9926000      0.2515000    
 C   -2.781500       1.258000      0.2680000    
 C    2.836500       1.215500     -0.4863000    
 C   1.2600000E-02  0.3163000      1.1000000E-03
 C   -4.853100     -0.5760000     -8.9000002E-02
 C    4.816000     -0.5858000      0.3009000    
 C   -3.244900      -2.422700     -0.5283000    
 C    3.143700      -2.399200      0.6256000    
 C   -4.108000       1.672300      0.3876000    
 C    4.169800       1.622200     -0.4370000    
 C   -5.143800      0.7554000      0.2091000    
 C    5.159500      0.7216000     -4.3299999E-02
 H  -0.9934000      -1.446300     -0.3680000    
 H   0.9821000      -1.481600     -0.1782000    
 H   -2.044700       2.032300      0.4217000    
 H    2.101500       1.934200     -0.8322000    
 H   -5.672600      -1.276700     -0.2248000    
 H    5.600100      -1.274500      0.6042000    
 H   -2.701400      -2.506400      -1.475300    
 H   -2.660800      -2.888700      0.2723000    
 H   -4.167600      -3.004000     -0.6339000    
 H    2.748900      -2.941300     -0.2400000    
 H    4.023100      -2.947900      0.9807000    
 H    2.407100      -2.417200       1.435800    
 H   -4.336100       2.708700      0.6196000    
 H    4.439100       2.637600     -0.7131000    
 H   -6.176600       1.078200      0.3022000    
 H    6.197900       1.037900     -7.0000002E-03


%chk=000069232-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000069232

0 1
O 0.003331 1.619686 -0.039545
N -1.172504 -0.429534 -0.022128
N 1.156309 -0.441751 0.018193
C -2.527515 0.010479 -0.043751
C 2.516054 -0.016135 0.026988
C -3.540317 -1.003015 -0.042542
C 3.517689 -1.039907 0.066153
C -2.888680 1.383561 -0.065076
C 2.892176 1.352776 -0.001387
C -0.003707 0.355497 -0.016365
C -4.894910 -0.600886 -0.062900
C 4.876600 -0.652031 0.075823
C -3.177564 -2.480023 -0.019220
C 3.138777 -2.512711 0.098032
C -4.251059 1.748272 -0.084790
C 4.258408 1.703141 0.009028
C -5.262853 0.763429 -0.083923
C 5.259387 0.708032 0.047715
H -1.056951 -1.444032 -0.011930
H 1.029714 -1.454631 0.044274
H -2.101543 2.138823 -0.066272
H 2.113549 2.116283 -0.030034
H -5.672644 -1.374178 -0.061919
H 5.645777 -1.433259 0.105883
H -2.582969 -2.782019 -0.906261
H -2.602441 -2.758191 0.888209
H -4.087810 -3.101775 -0.020898
H 2.557630 -2.818031 -0.796755
H 4.042136 -3.144054 0.119819
H 2.543871 -2.775089 0.997396
H -4.517004 2.811102 -0.101205
H 4.536017 2.762876 -0.013244
H -6.319939 1.049032 -0.099455
H 6.319484 0.982564 0.055888


