%chk=000099426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099426

0 1
 O   -1.938400       1.454600     -0.1098000    
 O    3.977800      -1.507100      0.1767000    
 N  -0.7263000     -0.5377000      0.1434000    
 C   -3.141200     -0.6130000      0.2078000    
 C   -1.877700      0.2406000      6.2399998E-02
 C   -4.268200      0.1770000      0.8701000    
 C   -3.585700      -1.129200      -1.159400    
 C   0.6178000     -0.1037000      5.3700000E-02
 C    1.638400      -1.033900      0.1603000    
 C   0.8838000       1.242100     -0.1369000    
 C    2.963200     -0.6059000      7.3600002E-02
 C    2.208500       1.670000     -0.2236000    
 C    3.248200      0.7461000     -0.1184000    
 H   -2.916400      -1.472000      0.8526000    
 H   -3.946700      0.5696000       1.840800    
 H   -5.144900     -0.4581000       1.034400    
 H   -4.577500       1.029200      0.2547000    
 H   -4.477000      -1.759000      -1.069900    
 H   -2.795000      -1.726100      -1.626500    
 H   -3.816500     -0.3018000      -1.839500    
 H  -0.8449000      -1.539300      0.2787000    
 H    1.420900      -2.088200      0.3103000    
 H   0.1379000       2.017400     -0.2273000    
 H    2.431800       2.722500     -0.3729000    
 H    4.275900       1.092500     -0.1874000    
 H    4.825800      -1.037700      9.4400004E-02


%chk=000099426-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099426

0 1
O -1.981521 1.323385 -0.551013
O 3.984430 -1.471853 0.652912
N -0.705907 -0.534135 0.119402
C -3.171335 -0.737600 0.049064
C -1.908332 0.121537 -0.157068
C -4.085016 -0.060092 1.101635
C -3.907075 -0.893279 -1.306975
C 0.628050 -0.041239 0.026153
C 1.669044 -0.941860 0.368127
C 0.935356 1.284767 -0.386142
C 3.010745 -0.519498 0.298230
C 2.288167 1.679127 -0.446557
C 3.337794 0.796172 -0.110014
H -2.886168 -1.745231 0.417732
H -3.591469 0.008378 2.088125
H -5.022587 -0.632599 1.221156
H -4.335756 0.963056 0.771522
H -4.837821 -1.473751 -1.173308
H -3.279848 -1.410345 -2.055882
H -4.166569 0.102861 -1.705815
H -0.791867 -1.504577 0.430572
H 1.458785 -1.968680 0.688351
H 0.126962 1.968728 -0.646180
H 2.529402 2.699657 -0.763430
H 4.383751 1.123379 -0.163774
H 4.892386 -1.087408 0.575476


