%chk=000146473.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146473

0 1
 O   -2.778200      -2.593100      0.2512000    
 N  -0.4121000      -1.021600     -0.7483000    
 N  -0.3917000       1.212800     -0.8269000    
 N   -2.632600       1.484100      6.4900003E-02
 N   -3.812200     -0.5596000      0.6041000    
 N   -4.766700       1.557800      0.9213000    
 C   0.2939000      0.1126000      -1.067700    
 C    1.661900      3.1199999E-02  -1.614500    
 C   -1.625900     -0.6140000     -0.2735000    
 C   -1.577300      0.7552000     -0.3363000    
 C    2.762600      3.6699999E-02 -0.5634000    
 C   -2.752300      -1.368900      0.2030000    
 C    3.196300      -1.166400     -4.5299999E-02
 C    3.293600       1.244900     -0.1599000    
 C   -3.725000      0.7525000      0.5275000    
 C    4.205000      -1.161200      0.9182000    
 C    4.302400       1.250000      0.8033000    
 C    4.758100      4.6999998E-02   1.342400    
 H    1.824400      0.8716000      -2.302900    
 H    1.768900     -0.8646000      -2.241400    
 H  -9.2200004E-02  -1.976500     -0.8453000    
 H   -2.658400       2.498100      4.3600000E-02
 H    2.770200      -2.111100     -0.3695000    
 H    2.942800       2.185700     -0.5734000    
 H    4.559600      -2.097800       1.338300    
 H    4.732700       2.190800       1.134200    
 H    5.543400      5.0999999E-02   2.092600    
 H   -4.705100       2.568500      0.8655000    
 H   -5.628200       1.161700       1.281000    


%chk=000146473-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146473

0 1
O -2.017298 -1.610177 2.082415
N -0.038577 -0.322406 0.049054
N -0.698498 1.274887 -1.429227
N -3.084632 1.306073 -0.698987
N -3.661249 -0.208024 1.108593
N -5.290387 1.170421 0.160279
C 0.351726 0.528901 -0.974418
C 1.744304 0.568486 -1.550712
C -1.404834 -0.126507 0.279531
C -1.767071 0.857602 -0.650611
C 2.826938 0.116093 -0.575551
C -2.338508 -0.724294 1.232258
C 3.464287 -1.140061 -0.733716
C 3.203247 0.939345 0.518274
C -3.982090 0.725356 0.213330
C 4.459066 -1.566498 0.177282
C 4.197043 0.517736 1.428280
C 4.828175 -0.737968 1.260805
H 1.921110 1.603975 -1.893584
H 1.770442 -0.065078 -2.459238
H 0.560235 -0.961876 0.573295
H -3.353727 2.023058 -1.374144
H 3.186509 -1.784713 -1.576932
H 2.716486 1.913230 0.653157
H 4.943179 -2.539755 0.040460
H 4.479397 1.165105 2.265938
H 5.598534 -1.065410 1.967554
H -5.621544 1.873758 -0.493844
H -5.934361 0.746140 0.823260


