%chk=000101040.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101040

0 1
 O   -5.283500      -1.908500      0.2038000    
 N    5.024600     -0.1488000     -0.1696000    
 N  -0.5108000      0.2045000      0.5885000    
 N   -4.602200     -0.8451000      3.8800001E-02
 N   -1.098000      0.1561000     -0.5180000    
 C    3.630500     -5.9999999E-02  2.3000000E-02
 C    3.005800       1.187100      3.0900000E-02
 C    2.876000      -1.219100      0.2039000    
 C   0.8720000      0.1160000      0.4006000    
 C    1.626500       1.275100      0.2198000    
 C    1.496700      -1.131200      0.3926000    
 C    5.896000      0.9232000      0.2692000    
 C    5.606000      -1.319300     -0.7966000    
 C   -2.487800      0.2449000     -0.3287000    
 C   -3.234900     -0.9097000     -0.1490000    
 C   -3.111000       1.483400     -0.3214000    
 C   -4.486600       1.560000     -0.1332000    
 C   -5.219200      0.3912000      4.5299999E-02
 H    3.561900       2.108000     -0.1192000    
 H    3.332300      -2.204900      0.2152000    
 H    1.148200       2.251200      0.2223000    
 H   0.9174000      -2.039700      0.5358000    
 H    5.885000       1.750500     -0.4481000    
 H    6.932600      0.5789000      0.3581000    
 H    5.603700       1.299300       1.256100    
 H    6.613100      -1.106600      -1.172500    
 H    5.013100      -1.650400      -1.656700    
 H    5.689500      -2.142700     -7.9400003E-02
 H   -2.824500      -1.909400     -0.1423000    
 H   -2.537300       2.395500     -0.4617000    
 H   -4.986100       2.523600     -0.1257000    
 H   -6.288400      0.3672000      0.1970000    


%chk=000101040-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101040

0 1
O -5.000408 1.233557 2.323045
N 5.146251 -0.188489 -0.166790
N -0.463713 0.334626 0.453360
N -4.522876 0.779908 1.163481
N -1.251420 -0.016545 -0.543537
C 3.766153 -0.069284 -0.038187
C 3.172886 0.445345 1.163799
C 2.886038 -0.460075 -1.109460
C 0.918515 0.171554 0.215364
C 1.782773 0.558340 1.278776
C 1.500723 -0.341509 -0.984635
C 6.029108 0.216309 0.938611
C 5.736132 -0.713908 -1.408593
C -2.645795 0.157328 -0.265875
C -3.156281 0.637777 0.961667
C -3.537414 -0.189250 -1.315674
C -4.924006 -0.037961 -1.093958
C -5.405628 0.439895 0.129974
H 3.800904 0.755627 2.002494
H 3.300522 -0.858612 -2.039521
H 1.325887 0.949999 2.193842
H 0.834444 -0.638890 -1.800462
H 5.916557 1.292430 1.177721
H 7.077425 0.038992 0.653888
H 5.822204 -0.364507 1.859097
H 6.832930 -0.722792 -1.316259
H 5.472793 -0.087292 -2.283416
H 5.402567 -1.750420 -1.613250
H -2.518043 0.917163 1.799125
H -3.131748 -0.560287 -2.259856
H -5.648856 -0.291372 -1.872956
H -6.458026 0.582643 0.376985


