%chk=000011696.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011696

0 1
 O    1.478100       2.043500     -0.4569000    
 O    2.105500      -1.291400      0.3035000    
 O   -1.264700      -1.730100      0.3839000    
 O  -0.7304000     -0.9845000      -1.619300    
 N  -0.6908000     -0.9595000     -0.3877000    
 C   0.1215000      0.1341000      0.2329000    
 C  -0.8808000      0.9495000       1.075600    
 C   0.7543000      0.9132000     -0.9313000    
 C    1.182900     -0.5585000       1.104000    
 C   -2.075700       1.483600      0.2952000    
 H  -0.3602000       1.795100       1.542200    
 H   -1.261400      0.3465000       1.911300    
 H   1.6700000E-02   1.297000      -1.645800    
 H    1.460000      0.3037000      -1.507800    
 H   0.7554000      -1.237700       1.850200    
 H    1.761600      0.1933000       1.651900    
 H   -2.700600      0.6866000     -0.1174000    
 H   -1.766200       2.144100     -0.5195000    
 H   -2.711800       2.074000      0.9640000    
 H   0.8334000       2.686000     -0.1159000    
 H    1.630100      -2.046100     -8.2599998E-02


%chk=000011696-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000011696

0 1
O 1.315320 2.158192 -0.367602
O 2.086036 -1.446643 0.406691
O -0.565296 -2.271155 0.026710
O -1.401314 -0.812134 -1.502405
N -0.673411 -1.085629 -0.478379
C 0.101037 0.075633 0.200723
C -0.918505 0.876930 1.062811
C 0.750237 0.931155 -0.932684
C 1.204195 -0.523684 1.111545
C -2.021539 1.643434 0.303407
H -0.310508 1.581759 1.662803
H -1.386560 0.178949 1.783282
H 0.013985 1.134010 -1.729810
H 1.607485 0.374853 -1.344728
H 0.749909 -0.993501 2.006027
H 1.845044 0.318801 1.422310
H -2.666930 0.963729 -0.277756
H -1.612131 2.389153 -0.403980
H -2.657006 2.187799 1.024467
H 0.613305 2.853825 -0.315104
H 1.583548 -2.293074 0.272170


