%chk=000096762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096762

0 1
 O  -0.4083000      -1.798000      0.5043000    
 O    2.376300       2.069000      0.2183000    
 N   0.3117000      0.2929000     -0.1836000    
 N    1.633500     -8.6400002E-02 -0.1886000    
 C   -4.424600     -0.6358000     -0.1052000    
 C   -4.711200      0.7379000      7.8100003E-02
 C   -2.051300     -0.1614000      0.1437000    
 C   -3.089100      -1.069300     -6.9399998E-02
 C   -3.654100       1.637700      0.2918000    
 C   -2.333300       1.189400      0.3241000    
 C   -5.481700      -1.535500     -0.3186000    
 C   -6.046400       1.171600      4.2500000E-02
 C  -0.6739000     -0.6267000      0.1786000    
 C   -6.802400      -1.087000     -0.3512000    
 C   -7.084300      0.2640000     -0.1710000    
 C    4.007000      0.3976000     -1.5799999E-02
 C    6.616500     -0.4929000     -8.3200000E-02
 C    5.003000       1.281700     -0.3745000    
 C    4.270800     -0.9165000      0.3105000    
 C    6.322700      0.8313000     -0.4087000    
 C    5.590500      -1.366700      0.2764000    
 C    2.601000      0.8773000      2.2500001E-02
 C    8.027700     -0.9740000     -0.1208000    
 H   -2.866400      -2.125200     -0.2148000    
 H   -3.852300       2.697000      0.4412000    
 H   -1.557200       1.923600      0.5203000    
 H   -5.285100      -2.596000     -0.4618000    
 H   -6.290100       2.223000      0.1810000    
 H   -7.610800      -1.793100     -0.5173000    
 H   -8.112800      0.6124000     -0.1964000    
 H    4.790300       2.314200     -0.6349000    
 H    3.505100      -1.617600      0.6257000    
 H    7.113600       1.521700     -0.6898000    
 H    5.808300      -2.398400      0.5404000    
 H   0.1180000       1.230400     -0.5195000    
 H    1.818600      -1.054900     -0.4258000    
 H    8.606200     -0.4418000     -0.8837000    
 H    8.503600     -0.8187000      0.8525000    
 H    8.075500      -2.039900     -0.3687000    


%chk=000096762-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096762

0 1
O -0.413162 -1.823199 -0.043019
O 2.340004 2.058003 -0.056957
N 0.307715 0.353958 -0.048903
N 1.620005 -0.119121 -0.051633
C -4.518168 -0.616835 -0.034414
C -4.846615 0.795307 -0.035743
C -2.114665 -0.059834 -0.041627
C -3.144473 -1.010006 -0.037327
C -3.776037 1.750874 -0.040086
C -2.444890 1.340783 -0.043035
C -5.582479 -1.579327 -0.030282
C -6.223912 1.190070 -0.032769
C -0.713585 -0.577300 -0.044472
C -6.916281 -1.165629 -0.027527
C -7.239255 0.229695 -0.028750
C 4.043509 0.298687 -0.058823
C 6.786797 -0.517886 -0.065100
C 5.085152 1.261207 -0.059179
C 4.386426 -1.079693 -0.064547
C 6.433605 0.857320 -0.063957
C 5.738704 -1.476061 -0.069106
C 2.641860 0.812635 -0.056102
C 8.240293 -0.952582 -0.038262
H -2.869002 -2.070657 -0.036313
H -4.020113 2.819583 -0.041142
H -1.661234 2.106912 -0.046562
H -5.331284 -2.646431 -0.029349
H -6.471355 2.258289 -0.033714
H -7.723051 -1.906427 -0.024444
H -8.289817 0.540391 -0.026501
H 4.805669 2.319763 -0.059368
H 3.617373 -1.861426 -0.070267
H 7.225375 1.615828 -0.068063
H 5.986968 -2.544001 -0.076976
H 0.256108 1.377756 -0.050523
H 1.672095 -1.142845 -0.049218
H 8.890889 -0.223162 -0.551643
H 8.605798 -1.041295 1.003518
H 8.379634 -1.936445 -0.519215


