%chk=000066657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066657

0 1
 O    1.370700      -2.312700     -0.5547000    
 N   0.8408000     -7.4800000E-02  2.3000000E-02
 N    1.532700       1.090800      0.2686000    
 N   -3.521300       1.976200     -0.4775000    
 C    3.064300     -0.6012000     -0.2334000    
 C    2.791100      0.8201000      0.1297000    
 C    1.672300      -1.161200     -0.2905000    
 C  -0.5406000     -0.1657000      7.9800002E-02
 C   -1.335900      0.9449000     -0.2254000    
 C   -1.155300      -1.369700      0.4433000    
 C    3.885100       1.812600      0.3102000    
 C   -2.726600      0.8529000     -0.1682000    
 C   -2.545900      -1.461700      0.5006000    
 C   -3.331500     -0.3504000      0.1947000    
 H    3.549000     -0.6640000      -1.209300    
 H    3.649500      -1.093000      0.5457000    
 H  -0.8756000       1.887100     -0.5163000    
 H  -0.5881000      -2.247600      0.7357000    
 H    4.550600       1.476700       1.109500    
 H    3.473700       2.791000      0.5709000    
 H    4.454600       1.896800     -0.6189000    
 H   -3.017300      -2.395300      0.7937000    
 H   -4.414100     -0.4343000      0.2453000    
 H   -3.083900       2.849400     -0.7401000    
 H   -4.529500       1.909900     -0.4355000    


%chk=000066657-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066657

0 1
O 1.534800 -2.550704 0.177292
N 0.854715 -0.252329 0.046398
N 1.498463 1.032083 -0.021147
N -3.417780 2.122281 -0.096487
C 3.161772 -0.637062 0.077563
C 2.804098 0.829275 -0.004201
C 1.783105 -1.318174 0.109573
C -0.576805 -0.294645 0.044683
C -1.290084 0.925180 -0.024933
C -1.257707 -1.539358 0.111703
C 3.773632 1.970916 -0.061436
C -2.710557 0.918497 -0.028347
C -2.669232 -1.525645 0.106631
C -3.402458 -0.325766 0.038188
H 3.747757 -0.990502 -0.790237
H 3.740465 -0.892908 0.983680
H -0.734028 1.864873 -0.076040
H -0.698397 -2.473748 0.166125
H 4.425396 1.984495 0.832850
H 3.232501 2.929144 -0.118304
H 4.437258 1.885686 -0.942913
H -3.206693 -2.479452 0.157606
H -4.498949 -0.343681 0.035803
H -2.929559 3.011134 -0.144337
H -4.432913 2.127208 -0.098814


