%chk=000019012.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019012

0 1
 O   -2.756500      -1.778600     -7.1000000E-03
 O    2.755400      -1.779800     -6.8000001E-03
 N   -5.347300       3.142200      1.1900000E-02
 N    5.339700       3.144300      1.1300000E-02
 C   -1.371600      -1.777800     -6.3000000E-03
 C    1.394400      -1.779500     -6.5000001E-03
 C   -3.389800     -0.5740000     -2.9000000E-03
 C    3.399400     -0.5538000     -1.4000000E-03
 C  -0.6976000     -0.9203000     -0.8567000    
 C   0.6973000     -0.9212000     -0.8569000    
 C  -0.6983000      -2.636200      0.8440000    
 C   0.6966000      -2.637100      0.8439000    
 C   -2.959000      0.4379000      0.8552000    
 C    2.956800      0.4361000      0.8572000    
 C   -4.470800     -0.3516000     -0.8560000    
 C    4.467800     -0.3507000     -0.8561000    
 C   -4.690200       1.894200      7.4999998E-03
 C    4.683800       1.895700      6.8000001E-03
 C   -3.609300       1.671900      0.8605000    
 C    3.604600       1.671400      0.8612000    
 C   -5.121000      0.8825000     -0.8508000    
 C    5.115500      0.8846000     -0.8520000    
 H   -1.217100     -0.2636000      -1.548400    
 H    1.214400     -0.2632000      -1.550200    
 H   -1.240300      -3.304100       1.506600    
 H    1.234000      -3.307600       1.509000    
 H   -2.134800      0.2855000       1.547200    
 H    2.134100      0.2785000       1.548400    
 H   -4.810700      -1.135900      -1.526800    
 H    4.804100      -1.136700      -1.525400    
 H   -3.267400       2.450800       1.537300    
 H    3.262200       2.449600       1.538500    
 H   -5.962000       1.043400      -1.520400    
 H    5.955500       1.047100      -1.522600    
 H   -5.036400       3.875800      0.6347000    
 H   -6.132000       3.303300     -0.6055000    
 H    6.121400       3.307700     -0.6092000    
 H    5.026400       3.878300      0.6323000    


%chk=000019012-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019012

0 1
O -2.821656 -1.623295 0.080663
O 2.819688 -1.620498 0.084176
N -6.357636 2.795876 -0.101327
N 6.353924 2.800055 -0.103508
C -1.409356 -1.503960 0.095637
C 1.407694 -1.502423 0.097180
C -3.636602 -0.456765 0.012998
C 3.634366 -0.453316 0.014917
C -0.707437 -0.396838 -0.435259
C 0.704986 -0.396073 -0.434471
C -0.704528 -2.614153 0.616510
C 0.703276 -2.613343 0.617262
C -3.463342 0.638724 0.889606
C 3.460964 0.642705 0.890786
C -4.719424 -0.475515 -0.890287
C 4.716832 -0.472782 -0.888683
C -5.462420 1.721954 -0.061774
C 5.459223 1.725784 -0.062486
C -4.364179 1.720432 0.848091
C 4.361427 1.724685 0.847931
C -5.628038 0.601244 -0.926321
C 5.624983 0.604341 -0.926077
H -1.253322 0.451409 -0.859319
H 1.250307 0.452750 -0.858087
H -1.270814 -3.461807 1.013326
H 1.270075 -3.460366 1.014729
H -2.633895 0.642237 1.604641
H 2.631841 0.646437 1.606170
H -4.843604 -1.338617 -1.551578
H 4.841026 -1.336495 -1.549144
H -4.223504 2.566932 1.531413
H 4.220817 2.571742 1.530567
H -6.469379 0.576058 -1.629457
H 6.466085 0.578915 -1.629483
H -6.248585 3.588294 0.523745
H -7.143988 2.794182 -0.743355
H 7.140265 2.797867 -0.745552
H 6.245230 3.592721 0.521318


