%chk=000019064.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019064

0 1
 O    1.085500     -0.9767000       1.510700    
 O  -0.9596000      -1.837000      0.5455000    
 N  -0.3401000      0.1771000     -0.4690000    
 N    3.050800     -6.2300000E-02  0.6951000    
 C    1.021700     -0.2059000     -0.7598000    
 C    1.066500      -1.458200      -1.640100    
 C  -0.7336000       1.525800     -0.8840000    
 C    1.716100     -0.4661000      0.5783000    
 C  -0.4806000       2.564300      0.2022000    
 C   0.4136000      -1.237000      -2.997700    
 C   -1.237400     -0.6950000      0.1760000    
 C  -0.9069000       3.965400     -0.2126000    
 C    3.787800      0.5393000     -0.4101000    
 C    3.811600     -0.2117000       1.933600    
 C   -2.599700     -0.1444000      0.4336000    
 C   -3.652000     -0.9711000      0.5087000    
 C   -5.043800     -0.5065000      0.7895000    
 H    1.500900      0.6247000      -1.282800    
 H   0.6126000      -2.330000      -1.159100    
 H    2.113500      -1.740300      -1.807100    
 H  -0.1794000       1.790400      -1.793400    
 H   -1.784600       1.538600      -1.190100    
 H  -0.9993000       2.293100       1.128200    
 H   0.5885000       2.580500      0.4477000    
 H   0.8683000     -0.3885000      -3.518800    
 H  -0.6603000      -1.050000      -2.902400    
 H   0.5419000      -2.125300      -3.624700    
 H  -0.3671000       4.288900      -1.108200    
 H  -0.6958000       4.679600      0.5892000    
 H   -1.980000       3.999100     -0.4259000    
 H    4.864800      0.4757000     -0.2260000    
 H    3.576400      2.7000001E-02  -1.350800    
 H    3.498600       1.591400     -0.4878000    
 H    4.656600     -0.8817000       1.750800    
 H    4.175400      0.7716000       2.245300    
 H    3.188800     -0.6316000       2.727300    
 H   -2.740200      0.9139000      0.6081000    
 H   -3.526300      -2.039400      0.3537000    
 H   -5.419900     -0.9861000       1.698400    
 H   -5.701900     -0.7796000     -4.1099999E-02
 H   -5.100700      0.5778000      0.9273000    


%chk=000019064-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019064

0 1
O 0.999461 -0.055281 1.635012
O -1.040958 -1.854374 0.015535
N -0.436594 0.292311 -0.704749
N 3.080603 -0.050408 0.604998
C 0.996657 -0.065089 -0.838512
C 1.260712 -1.393076 -1.614801
C -0.775778 1.721788 -0.920611
C 1.683350 -0.056359 0.568007
C -0.643638 2.620194 0.334460
C 0.577235 -1.413580 -2.996621
C -1.349236 -0.632068 -0.170986
C -1.013008 4.085609 0.021417
C 3.986419 0.117292 -0.540909
C 3.750274 -0.176252 1.913236
C -2.731896 -0.140164 0.144232
C -3.680146 -1.012601 0.582118
C -5.091018 -0.648474 0.964079
H 1.441164 0.753237 -1.441572
H 0.894911 -2.233013 -1.005630
H 2.353360 -1.509731 -1.740759
H -0.105215 2.108717 -1.713069
H -1.798328 1.798258 -1.332320
H -1.291553 2.220879 1.136738
H 0.388336 2.558574 0.726270
H 0.900453 -0.564985 -3.631591
H -0.519750 -1.362704 -2.889064
H 0.820014 -2.348930 -3.533283
H -0.353750 4.510963 -0.759696
H -0.917767 4.719174 0.921325
H -2.056158 4.169925 -0.339606
H 4.516661 -0.825126 -0.785158
H 3.450943 0.454873 -1.439718
H 4.748935 0.881980 -0.295138
H 4.462622 -1.023300 1.898640
H 4.305203 0.749382 2.163513
H 2.981161 -0.352176 2.679744
H -2.978077 0.923127 0.055751
H -3.377805 -2.066328 0.674099
H -5.292250 -0.922341 2.018508
H -5.823140 -1.210592 0.351333
H -5.291710 0.430471 0.842479


