%chk=000016710.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016710

0 1
 O    1.033900       1.463000      -1.597500    
 O   -3.471400      -2.456600      0.3979000    
 N    3.846100      -1.300500      1.0700000E-02
 C   0.8456000       1.123500     -0.2170000    
 C    2.183700      0.4884000      0.2631000    
 C   0.6069000       2.446800      0.5704000    
 C  -0.3253000      0.1530000     -5.0299998E-02
 C    2.577300     -0.7863000     -0.4961000    
 C  -0.6667000       3.202200      0.2357000    
 C  -0.6465000     -0.2806000       1.215400    
 C   -1.011800     -0.2497000      -1.172600    
 C   -1.909200       2.854000       1.003700    
 C    4.249500      -2.495200     -0.7318000    
 C    3.745400      -1.599300       1.439700    
 C   -1.713600      -1.166100       1.367000    
 C   -2.078900      -1.135100      -1.021000    
 C   -2.429800      -1.593400      0.2488000    
 C  -0.6742000       4.185100     -0.6791000    
 C   -4.160800      -2.853100     -0.7868000    
 H    2.095900      0.3055000       1.338300    
 H    2.989100       1.224300      0.1282000    
 H    1.456200       3.116900      0.3713000    
 H   0.6328000       2.268000       1.653300    
 H    1.791200      -1.546500     -0.4137000    
 H    2.702800     -0.5565000      -1.559500    
 H    1.215800      0.6617000      -2.113300    
 H  -0.1026000      4.0600002E-02   2.097300    
 H  -0.7835000      9.0300001E-02  -2.176300    
 H   -2.376900       1.946600      0.6163000    
 H   -1.683900       2.714800       2.065900    
 H   -2.656500       3.653200      0.9401000    
 H    4.352200      -2.269900      -1.799300    
 H    3.530200      -3.314700     -0.6196000    
 H    5.230100      -2.847500     -0.3927000    
 H    2.863300      -2.203000       1.683200    
 H    3.746400     -0.6908000       2.049300    
 H    4.628400      -2.157300       1.775400    
 H   -1.982800      -1.519200       2.358700    
 H   -2.594400      -1.424300      -1.930500    
 H   0.2243000       4.454400      -1.224300    
 H   -1.579000       4.738600     -0.9070000    
 H   -4.643900      -2.000200      -1.275500    
 H   -4.957200      -3.540400     -0.4827000    
 H   -3.504900      -3.405200      -1.468300    


%chk=000016710-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016710

0 1
O 1.148047 1.367224 -1.681861
O -3.628623 -2.505534 0.349801
N 4.027526 -1.245531 0.316847
C 0.904541 1.055664 -0.246409
C 2.222556 0.509257 0.377430
C 0.608703 2.455888 0.394443
C -0.283138 0.084955 -0.114869
C 2.785376 -0.744244 -0.323708
C -0.736512 3.093281 0.054981
C -0.452519 -0.756903 1.019112
C -1.284153 0.049382 -1.116261
C -1.837917 2.946416 1.090088
C 4.796869 -2.126441 -0.586732
C 3.785269 -1.891981 1.623087
C -1.570398 -1.600362 1.145415
C -2.413257 -0.794666 -1.009354
C -2.556969 -1.625452 0.127991
C -0.922601 3.770488 -1.109556
C -4.677050 -2.562373 -0.671115
H 2.057808 0.308197 1.452227
H 2.985921 1.306283 0.316910
H 1.432765 3.112479 0.058514
H 0.700854 2.340070 1.492032
H 2.001070 -1.543492 -0.373683
H 3.046135 -0.472498 -1.365086
H 1.193185 0.511525 -2.181303
H 0.292051 -0.757331 1.822260
H -1.187330 0.715526 -1.979094
H -2.047944 1.878971 1.295317
H -1.535808 3.404209 2.053456
H -2.775894 3.426690 0.761350
H 5.045530 -1.581179 -1.514686
H 4.251454 -3.063407 -0.870132
H 5.744473 -2.420305 -0.100283
H 3.120685 -2.791689 1.549874
H 3.321639 -1.180102 2.327166
H 4.748530 -2.211419 2.059195
H -1.699831 -2.248899 2.017372
H -3.164960 -0.788342 -1.804617
H -0.117145 3.861635 -1.845715
H -1.887059 4.231041 -1.357116
H -5.174232 -1.580297 -0.793810
H -5.401930 -3.300731 -0.298116
H -4.272422 -2.896503 -1.646564


