%chk=000167004.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167004

0 1
 O   -2.816700      0.9056000     -0.2176000    
 O    2.821700      0.8928000     -0.2091000    
 O   -4.670200       1.057300      -1.574200    
 O    4.682800       1.033200      -1.556600    
 N   6.5000001E-03   2.245100     -0.5369000    
 N   -3.661100      -2.806900       1.080100    
 N    3.643000      -2.807100       1.069300    
 C   -1.135800       2.572000      0.1005000    
 C    1.154900       2.560200      0.1033000    
 C   -2.413200       2.223300     -0.6053000    
 C    2.426500       2.204000     -0.5920000    
 C   -1.197400       3.191900       1.333600    
 C    1.207700       3.181600       1.340500    
 C   4.6999999E-03   3.500200       1.960800    
 C   -4.272600     -0.9177000     -0.2990000    
 C    4.273000     -0.9451000     -0.2904000    
 C   -3.971800      0.4226000     -0.7710000    
 C    3.973200      0.4284000     -0.7679000    
 C   -5.405300      -1.594700     -0.7371000    
 C    5.397000      -1.595900     -0.7391000    
 C   -3.439800      -1.562000      0.6017000    
 C    3.428700      -1.559200      0.5956000    
 C   -5.667100      -2.877100     -0.2675000    
 C    5.651500      -2.881500     -0.2743000    
 C   -4.771900      -3.433700      0.6318000    
 C    4.751700      -3.437400      0.6208000    
 H   -3.201800       2.944000     -0.3579000    
 H   -2.251300       2.247100      -1.689800    
 H    3.216000       2.923800     -0.3429000    
 H    2.269200       2.234900      -1.677300    
 H   -2.141500       3.433500       1.809400    
 H    2.150500       3.416200       1.823000    
 H   4.0000002E-03   3.986600       2.931600    
 H   -6.095000      -1.140200      -1.443100    
 H    6.087200      -1.138500      -1.441100    
 H   -2.535500      -1.109200      0.9955000    
 H    2.527100      -1.102000      0.9878000    
 H   -6.544000      -3.423700     -0.5951000    
 H    6.526400      -3.431100     -0.6022000    
 H   -4.930700      -4.431400       1.028000    
 H    4.904900      -4.437400       1.013200    


%chk=000167004-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167004

0 1
O -3.605171 0.235245 -0.377336
O 3.604800 0.221585 -0.405979
O -4.934286 1.403357 -1.895844
O 4.938762 1.545882 -1.786893
N -0.000094 0.657314 -0.929491
N -6.871997 -1.334812 1.653849
N 6.864391 -1.515126 1.495244
C -1.172046 0.363394 -0.294416
C 1.174557 0.376869 -0.293731
C -2.405542 0.738879 -1.089630
C 2.405396 0.772134 -1.083430
C -1.217280 -0.224754 0.990631
C 1.225718 -0.210585 0.991644
C 0.005782 -0.513815 1.636077
C -5.984120 0.081488 -0.137429
C 5.981697 0.069626 -0.151641
C -4.834940 0.646192 -0.900341
C 4.835540 0.694459 -0.871145
C -7.298375 0.453763 -0.519380
C 7.295548 0.498624 -0.470238
C -5.824269 -0.816242 0.951336
C 5.819330 -0.940669 0.833285
C -8.389893 -0.075365 0.197215
C 8.384169 -0.087411 0.205280
C -8.130883 -0.959420 1.272132
C 8.122759 -1.083224 1.176916
H -2.483776 1.835184 -1.208930
H -2.367863 0.297559 -2.101631
H 2.498681 1.871542 -1.155447
H 2.351919 0.374914 -2.112596
H -2.180074 -0.444031 1.456358
H 2.190857 -0.419027 1.457748
H 0.007965 -0.970144 2.631503
H -7.433453 1.141911 -1.360111
H 7.432606 1.273171 -1.231766
H -4.825359 -1.132418 1.265530
H 4.820959 -1.304276 1.093404
H -9.419295 0.186675 -0.064541
H 9.413176 0.215322 -0.010012
H -8.951976 -1.390243 1.856226
H 8.941577 -1.561029 1.726678


