%chk=000050403.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050403

0 1
 O   0.9664000      0.1256000     -0.1542000    
 O   -2.633900      0.3292000      0.2780000    
 O   -3.767900      -1.454000     -0.6350000    
 N   -4.882300      0.2446000      0.4417000    
 C    2.067700      0.9512000      0.2152000    
 C    3.385700      0.2855000     -0.1933000    
 C    3.548000      -1.102600      0.4322000    
 C    1.900700       2.312400     -0.4465000    
 C  -0.2675000      0.6912000      0.2619000    
 C    4.840400      -1.766600     -1.6500000E-02
 C   -1.399200     -0.2274000     -0.1568000    
 C   -3.758100     -0.3891000     -2.6799999E-02
 H    2.072000       1.074800       1.306100    
 H    4.230700      0.9226000      9.4200000E-02
 H    3.411300      0.1785000      -1.285400    
 H    2.707600      -1.748200      0.1531000    
 H    3.544200      -1.019000       1.525200    
 H    1.593200       2.217400      -1.493800    
 H    1.159000       2.931100      6.8700001E-02
 H    2.838700       2.877700     -0.4138000    
 H  -0.2787000      0.8292000       1.349900    
 H  -0.4597000       1.661700     -0.2054000    
 H    4.939200      -2.754200      0.4449000    
 H    5.709900      -1.167900      0.2732000    
 H    4.858500      -1.896100      -1.103300    
 H   -1.257000      -1.219400      0.2889000    
 H   -1.401400     -0.3441000      -1.247400    
 H   -4.822800       1.126100      0.9403000    
 H   -5.807000     -0.1491000      0.3038000    


%chk=000050403-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000050403

0 1
O 0.954270 0.379216 -0.335638
O -2.649548 0.259639 0.314172
O -3.672338 -1.650166 -0.620847
N -4.899383 0.001884 0.513600
C 2.134069 1.131178 0.157194
C 3.358682 0.290838 -0.244325
C 3.419711 -1.086022 0.453204
C 2.173632 2.557095 -0.425599
C -0.324689 0.837808 0.208801
C 4.630434 -1.927970 -0.001942
C -1.338678 -0.240414 -0.170173
C -3.749304 -0.568037 0.010075
H 2.070073 1.185143 1.270197
H 4.275001 0.870612 -0.011422
H 3.334906 0.151017 -1.343763
H 2.478751 -1.627620 0.243695
H 3.462744 -0.937082 1.552262
H 2.213694 2.516346 -1.529003
H 1.287461 3.148018 -0.131833
H 3.069252 3.094792 -0.062949
H -0.267226 0.947864 1.313687
H -0.630034 1.811793 -0.226358
H 4.653638 -2.908583 0.507936
H 5.584358 -1.410696 0.216566
H 4.593245 -2.115845 -1.091650
H -1.106093 -1.206218 0.310484
H -1.374132 -0.389738 -1.263156
H -4.862713 0.886660 1.013204
H -5.782085 -0.480410 0.372683


