%chk=000021923.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021923

0 1
 O   0.5730000       1.229100      0.8882000    
 O   0.8098000     -0.7588000     -0.3770000    
 O   -2.488700       1.623800     -0.7258000    
 O   -1.214900      0.2526000      -1.888400    
 N   -1.738600      0.6505000     -0.8436000    
 C   -1.414400     -0.1072000      0.3997000    
 C  -0.7327000      0.8779000       1.351100    
 C  -0.4789000      -1.249900     -2.0999999E-03
 C   -2.737800     -0.6224000      0.9555000    
 C    1.364700      6.4900003E-02  0.6492000    
 C    2.736300      0.5238000      0.1846000    
 C   -3.384200      -1.622400      1.4800000E-02
 C    3.662600     -0.6610000     -8.4399998E-02
 C    5.043900     -0.2009000     -0.5219000    
 H   -1.299900       1.805700       1.485500    
 H  -0.6259000      0.4327000       2.348800    
 H  -0.3382000      -1.936200      0.8435000    
 H  -0.8431000      -1.863700     -0.8335000    
 H   -3.441300      0.1964000       1.153300    
 H   -2.567000      -1.115700       1.921000    
 H    1.467000     -0.5113000       1.578900    
 H    3.176300       1.191400      0.9356000    
 H    2.633400       1.117700     -0.7330000    
 H   -3.552800      -1.222400     -0.9889000    
 H   -2.809000      -2.549600     -6.4800002E-02
 H   -4.366400      -1.904100      0.4118000    
 H    3.245600      -1.305600     -0.8666000    
 H    3.758900      -1.270900      0.8214000    
 H    4.988100      0.3853000      -1.444700    
 H    5.514400      0.4166000      0.2499000    
 H    5.690600      -1.064500     -0.7065000    


%chk=000021923-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021923

0 1
O 0.602164 1.214157 0.880073
O 0.855989 -0.794651 -0.420298
O -2.354370 1.830872 -0.730499
O -1.701794 0.120361 -2.077670
N -1.835131 0.670702 -0.927729
C -1.435436 -0.143999 0.346651
C -0.730862 0.816030 1.339331
C -0.474649 -1.287793 -0.046558
C -2.767296 -0.663030 0.963828
C 1.441204 0.034360 0.635937
C 2.809246 0.509660 0.171719
C -3.597362 -1.597747 0.058129
C 3.821310 -0.644622 -0.005993
C 5.197217 -0.138285 -0.488128
H -1.305639 1.746427 1.453506
H -0.659081 0.290269 2.317618
H -0.400773 -1.976539 0.824604
H -0.838154 -1.834917 -0.926653
H -3.373249 0.217471 1.250987
H -2.505106 -1.192332 1.900905
H 1.481459 -0.569854 1.578126
H 3.183179 1.240753 0.913206
H 2.671076 1.049816 -0.783181
H -3.894330 -1.102651 -0.882803
H -3.045899 -2.518436 -0.202184
H -4.520423 -1.899687 0.583491
H 3.410769 -1.373247 -0.729261
H 3.942028 -1.183858 0.956319
H 5.108197 0.379740 -1.461249
H 5.636507 0.576243 0.233508
H 5.910008 -0.973411 -0.614129


