%chk=000021290.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021290

0 1
 O  -0.6020000      -2.235700     -0.7292000    
 N    1.438100       1.084500      2.3399999E-02
 N    3.381800     -0.1058000      0.3218000    
 N    1.402400      -1.257500     -0.2113000    
 C   -2.109900      9.9399999E-02 -0.8539000    
 C   -2.975700     -2.8000001E-02  0.3960000    
 C  -0.6494000      0.1304000     -0.5128000    
 C   9.5500000E-02   1.224600     -0.2482000    
 C   -4.461500     -2.6100000E-02  3.4899998E-02
 C   4.7899999E-02  -1.218700     -0.4961000    
 C    2.042800     -0.1464000      3.2800000E-02
 C  -0.4260000       2.633200     -0.2001000    
 C   -5.336500     -0.1152000       1.275100    
 C    4.177500       1.047400     -3.6200002E-02
 C    3.974900      -1.086300       1.203900    
 H   -2.385700       1.007500      -1.403700    
 H   -2.329100     -0.7190000      -1.550500    
 H   -2.731000     -0.9547000      0.9302000    
 H   -2.767700      0.8014000       1.083600    
 H   -4.711200      0.8898000     -0.5133000    
 H   -4.685300     -0.8716000     -0.6260000    
 H    1.939200       1.931700      0.2650000    
 H   1.6100001E-02   3.226400      -1.007600    
 H  -0.1622000       3.102000      0.7545000    
 H   -1.512800       2.695200     -0.2951000    
 H   -6.394100     -0.1139000      0.9937000    
 H   -5.161000      0.7357000       1.941000    
 H   -5.134300      -1.035400       1.832400    
 H    3.853500       1.487100     -0.9864000    
 H    5.229700      0.7712000     -0.1677000    
 H    4.129400       1.811200      0.7472000    
 H    5.068500      -1.077300       1.143200    
 H    3.647900      -2.100300      0.9507000    
 H    3.691600     -0.8805000       2.241300    


%chk=000021290-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021290

0 1
O -0.639396 -2.289774 -0.323264
N 1.457791 1.187919 -0.049607
N 3.418878 -0.051402 0.466802
N 1.394310 -1.200191 0.058813
C -2.126189 0.076113 -0.844701
C -3.023011 0.046777 0.424261
C -0.649714 0.117589 -0.511764
C 0.086955 1.276658 -0.384670
C -4.524621 -0.090696 0.087301
C 0.015936 -1.201424 -0.257360
C 2.065164 -0.055359 0.154078
C -0.416102 2.691267 -0.561600
C -5.418571 -0.109719 1.346127
C 4.185936 1.194981 0.571515
C 4.109422 -1.331077 0.704404
H -2.423852 0.924518 -1.491055
H -2.311021 -0.856157 -1.410083
H -2.706423 -0.805288 1.055882
H -2.857868 0.969282 1.019596
H -4.833078 0.744484 -0.575729
H -4.677993 -1.023120 -0.492232
H 1.989857 2.053035 0.045277
H 0.120696 3.210720 -1.379528
H -0.275331 3.283398 0.363766
H -1.488085 2.699982 -0.801879
H -6.487691 -0.213198 1.083350
H -5.301822 0.823080 1.930094
H -5.148954 -0.954852 2.006749
H 4.185326 1.772223 -0.376966
H 5.233853 0.944403 0.796256
H 3.823153 1.850285 1.391672
H 4.924537 -1.479365 -0.029498
H 3.366247 -2.134814 0.590240
H 4.533061 -1.363981 1.726354


