%chk=000149033.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149033

0 1
 O    4.030600      0.4878000      0.7319000    
 O  -0.7294000       3.088800      -1.076200    
 N  -3.4600001E-02   1.355300     -0.1028000    
 N    2.028600      0.1681000     -0.3990000    
 N  -0.6399000       2.519200      1.8200001E-02
 C  -0.5119000      0.3993000      0.9061000    
 C    1.434200       1.451100     -6.5700002E-02
 C   -1.771000     -0.2991000      0.4658000    
 C   -3.004500      0.2552000      0.7777000    
 C   -1.680400      -1.487000     -0.2461000    
 C    3.291900     -0.2038000      3.6100000E-02
 C    3.665700      -1.590000     -0.4537000    
 C   -4.171100     -0.3915000      0.3696000    
 C   -2.847000      -2.133800     -0.6542000    
 C   -4.092300      -1.585900     -0.3463000    
 C    5.031000      -2.033900      3.8600001E-02
 H  -0.6647000      0.8790000       1.885600    
 H   0.2222000     -0.3893000       1.120100    
 H    1.801500       1.784300      0.9138000    
 H    1.803000       2.155300     -0.8219000    
 H    1.509900     -0.4479000      -1.017900    
 H   -3.079800       1.182500       1.338500    
 H  -0.7158000      -1.921700     -0.4934000    
 H    3.653500      -1.585400      -1.549500    
 H    2.903200      -2.297800     -0.1091000    
 H   -5.140800      3.4400001E-02  0.6102000    
 H   -2.785700      -3.063500      -1.212300    
 H   -5.000600      -2.089500     -0.6640000    
 H    5.065600      -2.057700       1.132800    
 H    5.262800      -3.036700     -0.3329000    
 H    5.814600      -1.351500     -0.3068000    


%chk=000149033-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149033

0 1
O 2.515053 -0.733631 1.048980
O 0.198651 3.264642 -1.328612
N 0.036623 2.011570 0.522644
N 2.005330 0.921109 -0.500386
N -0.598230 2.781083 -0.431138
C -0.861525 1.293289 1.466318
C 1.514503 1.858091 0.504824
C -1.306456 -0.079705 0.966336
C -2.374469 -0.175453 0.037431
C -0.669223 -1.262256 1.415257
C 2.480616 -0.340448 -0.157908
C 2.979880 -1.195348 -1.325573
C -2.803684 -1.436512 -0.430601
C -1.097898 -2.525140 0.945560
C -2.166980 -2.615823 0.025064
C 2.541023 -2.669489 -1.182939
H -1.737802 1.950762 1.604041
H -0.331563 1.208546 2.430333
H 1.830726 1.484284 1.490969
H 1.931177 2.860537 0.306435
H 1.958121 1.215616 -1.477632
H -2.863402 0.739129 -0.319668
H 0.178664 -1.197633 2.106468
H 4.086779 -1.141736 -1.323238
H 2.638797 -0.776509 -2.291416
H -3.632738 -1.501141 -1.144192
H -0.596097 -3.433056 1.297980
H -2.502384 -3.595256 -0.334476
H 1.443105 -2.766222 -1.253583
H 2.998281 -3.289292 -1.974213
H 2.853921 -3.059711 -0.199863


