%chk=000065527.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065527

0 1
 O   0.8794000     -0.4607000      -1.275400    
 O   -1.566700      8.5699998E-02  -2.183100    
 O   0.5177000       1.551000     -0.2218000    
 N    4.166500      0.2408000      0.2844000    
 C    2.741800     -4.5800000E-02  0.1874000    
 C    2.284200     -0.2083000      -1.264100    
 C   -1.381500      0.1015000     -0.7529000    
 C    4.510700       1.425400     -0.5050000    
 C    4.561600      0.4313000       1.681700    
 C   9.2600003E-02  0.5128000     -0.7145000    
 C    2.966300      -1.367200      -1.980000    
 C   -1.618100      -1.300900     -0.1880000    
 C   -2.327900       1.116700     -0.1076000    
 C    6.005200       1.695400     -0.4667000    
 C    4.214100     -0.7863000       2.521300    
 C   -2.536000      -2.115200     -0.8103000    
 C   -2.270700       1.296300       1.255200    
 C  -0.9035000      -1.694000      0.9202000    
 C   -3.199000       1.810700     -0.9153000    
 C   -2.751700      -3.393700     -0.2957000    
 C   -3.133100       2.221500       1.843400    
 C   -1.119100      -2.972500       1.434700    
 C   -4.061300       2.736100     -0.3270000    
 C   -2.043200      -3.822200      0.8267000    
 C   -4.028200       2.941400       1.052300    
 H    2.197500      0.7078000      0.7570000    
 H    2.504100     -0.9978000      0.6788000    
 H    2.422100      0.6997000      -1.859400    
 H    4.293300       1.276100      -1.565600    
 H    3.960400       2.314900     -0.1736000    
 H    5.647500      0.5448000       1.762500    
 H    4.101600       1.325500       2.121200    
 H    2.547100      -1.491100      -2.984700    
 H    2.788800      -2.310900      -1.452200    
 H    4.045300      -1.216600      -2.075500    
 H    6.329800       2.119800      0.4883000    
 H    6.587300      0.7901000     -0.6709000    
 H    6.265600       2.430400      -1.237100    
 H    3.142200     -0.8589000       2.730700    
 H    4.549800      -1.715700       2.048600    
 H    4.716200     -0.7161000       3.493000    
 H   -3.108700      -1.796700      -1.675400    
 H   -1.569600      0.7703000       1.892000    
 H  -0.1779000      -1.053500       1.410600    
 H   -3.254800       1.677100      -1.990000    
 H   -1.107100     -0.6901000      -2.548900    
 H   -3.473800      -4.054300     -0.7667000    
 H   -3.103700       2.385900       2.916600    
 H  -0.5672000      -3.306600       2.308500    
 H   -4.758700       3.297000     -0.9424000    
 H   -2.211600      -4.817400       1.227800    
 H   -4.698700       3.662900       1.510100    


%chk=000065527-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065527

0 1
O 0.812136 -0.259281 -1.225173
O -1.614815 -0.952867 -1.687095
O 0.319553 1.369229 0.369672
N 4.295203 -0.049980 0.222558
C 2.954737 -0.622539 -0.039764
C 2.272736 0.132692 -1.206432
C -1.481472 -0.164181 -0.459829
C 4.239284 1.123602 1.142301
C 5.310845 -1.061965 0.620879
C -0.046109 0.433194 -0.373261
C 2.832585 -0.212116 -2.581726
C -1.716608 -1.077828 0.777305
C -2.520182 0.977821 -0.532565
C 5.399527 2.112496 0.924490
C 5.790506 -1.932269 -0.555941
C -2.603703 -2.172553 0.622890
C -2.806787 1.772388 0.604241
C -1.120464 -0.843345 2.041287
C -3.183277 1.246127 -1.753744
C -2.891704 -3.017990 1.715289
C -3.744431 2.824114 0.518367
C -1.407381 -1.695687 3.132735
C -4.126555 2.295589 -1.835042
C -2.293856 -2.784050 2.975983
C -4.409788 3.089742 -0.701135
H 2.295322 -0.577904 0.858544
H 3.051841 -1.687158 -0.318478
H 2.305209 1.220457 -1.013856
H 3.282309 1.648142 0.963933
H 4.217372 0.792612 2.210805
H 6.180018 -0.515323 1.029176
H 4.932808 -1.716359 1.446451
H 2.365641 0.400752 -3.371187
H 2.669514 -1.278881 -2.819505
H 3.918769 -0.016281 -2.570464
H 6.383329 1.645009 1.112057
H 5.393688 2.485535 -0.114546
H 5.302707 2.974614 1.610311
H 4.963440 -2.510245 -1.007078
H 6.232183 -1.297822 -1.344325
H 6.554608 -2.654962 -0.213960
H -3.051093 -2.350320 -0.359439
H -2.303906 1.573375 1.555027
H -0.435339 -0.000019 2.181831
H -2.959284 0.620832 -2.621388
H -0.719902 -1.332140 -1.893459
H -3.581862 -3.859107 1.583431
H -3.957259 3.433576 1.403854
H -0.937931 -1.505675 4.104699
H -4.638647 2.491273 -2.784172
H -2.516180 -3.442114 3.823558
H -5.140434 3.904190 -0.764910


