%chk=000157044.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157044

0 1
 O    4.218100     -0.2579000      0.1171000    
 O   -3.940900      0.2689000      0.3183000    
 N   -1.927100      0.3007000     -0.1830000    
 N   -3.016100     -0.4116000     -0.1374000    
 C   0.5199000      0.4269000     -0.1167000    
 C    1.812100     -0.3735000      3.7200000E-02
 C  -0.7057000     -0.4803000     -2.5300000E-02
 C    3.039800      0.5268000     -1.0200000E-02
 H   0.4718000       1.195200      0.6655000    
 H   0.5265000      0.9489000      -1.082000    
 H    1.886400      -1.131900     -0.7522000    
 H    1.804700     -0.9265000      0.9848000    
 H  -0.7035000     -0.9944000      0.9451000    
 H  -0.6417000      -1.247400     -0.8084000    
 H    3.093300       1.062900     -0.9629000    
 H    3.025200       1.264500      0.7985000    
 H   -1.976500       1.056700      0.4976000    
 H    4.172200     -0.7185000      0.9723000    


%chk=000157044-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157044

0 1
O 4.317064 -0.202710 -0.152706
O -3.960523 0.600817 -0.682792
N -2.002681 0.137854 0.277120
N -2.880541 -0.091788 -0.758960
C 0.492319 0.380096 0.055274
C 1.831902 -0.390226 0.097795
C -0.712035 -0.561391 0.287689
C 3.043790 0.532081 -0.134632
H 0.494993 1.178294 0.826147
H 0.372755 0.881206 -0.924548
H 1.841109 -1.183395 -0.674655
H 1.938225 -0.896935 1.080984
H -0.590890 -1.097390 1.249662
H -0.768820 -1.319156 -0.514140
H 2.987173 0.999930 -1.132114
H 3.062346 1.342091 0.627621
H -2.263410 0.830376 1.000476
H 4.455725 -0.630255 0.730079


