%chk=000131255.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131255

0 1
 O    4.664200      0.5344000      0.2054000    
 O  -0.1180000      0.8370000     -8.2699999E-02
 O   -1.903500      -2.820500     -0.1004000    
 N    1.980900     -0.1314000     -0.2663000    
 C    2.560800       1.063300     -0.8800000    
 C    2.948800      -1.175300      7.1199998E-02
 C    3.704600       1.572000     -1.0600000E-02
 C    4.076100     -0.5692000      0.8986000    
 C   0.6340000     -0.3283000     -0.1802000    
 C   8.3600000E-02  -1.553900     -0.1894000    
 C   -1.483300      0.7430000      8.8000000E-03
 C   -2.160200     -0.4745000      8.6000003E-03
 C   -1.379800      -1.715100     -9.3999997E-02
 C   -2.198700       1.936900      0.1053000    
 C   -3.553300     -0.5102000      0.1042000    
 C   -3.590400       1.906500      0.2011000    
 C   -4.266000      0.6854000      0.2005000    
 H    1.832100       1.868100      -1.024600    
 H    2.943500      0.7885000      -1.870600    
 H    3.348500      -1.598500     -0.8581000    
 H    2.517100      -1.991500      0.6597000    
 H    4.214900       2.401400     -0.5101000    
 H    3.340800       1.937100      0.9574000    
 H    3.718000     -0.2316000       1.878700    
 H    4.859700      -1.314300       1.068200    
 H   0.6534000      -2.470100     -0.2910000    
 H   -1.681000       2.892200      0.1064000    
 H   -4.095600      -1.451300      0.1053000    
 H   -4.149100       2.834900      0.2762000    
 H   -5.349500      0.6660000      0.2751000    


%chk=000131255-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131255

0 1
O 4.786307 0.546908 0.096314
O -0.126487 0.821335 -0.135504
O -1.986432 -2.918776 0.181832
N 1.984465 -0.085000 -0.129837
C 2.515236 1.198190 -0.656365
C 2.983922 -1.171507 -0.043560
C 3.769220 1.611154 0.131297
C 4.237109 -0.672391 0.704993
C 0.630200 -0.360591 -0.099635
C 0.025749 -1.610524 -0.017312
C -1.539034 0.739323 -0.060342
C -2.199880 -0.504920 0.066346
C -1.414149 -1.778192 0.091781
C -2.235729 1.963448 -0.108250
C -3.615130 -0.503870 0.148707
C -3.642402 1.938420 -0.022785
C -4.334462 0.704539 0.106292
H 1.737978 1.972200 -0.577055
H 2.782319 1.072493 -1.727321
H 3.263196 -1.515952 -1.061547
H 2.559107 -2.025452 0.509364
H 4.245417 2.492077 -0.328547
H 3.499409 1.839086 1.184934
H 3.981243 -0.478547 1.769061
H 5.041708 -1.423363 0.649753
H 0.624169 -2.522106 -0.052086
H -1.680995 2.901218 -0.206463
H -4.111143 -1.475726 0.243206
H -4.200963 2.880030 -0.056022
H -5.427348 0.697496 0.171450


