%chk=000133616.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133616

0 1
 O  -0.6484000      0.2127000      -1.543600    
 O   -2.340400       1.928400      0.7637000    
 O   -3.869000      0.7126000     -0.3996000    
 N   -2.478600      -1.589400     -2.6000001E-02
 C   0.5769000      -1.212900      2.7999999E-03
 C  -0.4730000     -8.0100000E-02 -0.1515000    
 C   -1.852600     -0.3670000      0.4779000    
 C    1.871600     -0.9791000     -0.8075000    
 C   0.8927000      -1.460600       1.487700    
 C    2.626600      0.2699000     -0.4446000    
 C   -2.813900      0.7784000      0.2149000    
 C    3.878900      0.2734000      3.5100002E-02
 C    4.629400       1.513800      0.3906000    
 H   0.1459000      -2.137500     -0.4041000    
 H  -7.8199998E-02  0.8350000      0.3078000    
 H   -1.761900     -0.4664000       1.565100    
 H    1.635900     -0.9369000      -1.877900    
 H    2.520300      -1.857200     -0.6885000    
 H    1.222000     -0.5439000       1.987800    
 H    1.684100      -2.210100       1.595600    
 H   1.6100001E-02  -1.841200       2.020500    
 H    2.122100       1.218900     -0.6059000    
 H   0.1257000      0.7182000      -1.842700    
 H   -2.611200      -1.521800      -1.034100    
 H   -3.403900      -1.703700      0.3856000    
 H    4.397100     -0.6691000      0.1901000    
 H   -2.944700       2.684600      0.6051000    
 H    5.544900       1.578800     -0.2053000    
 H    4.041900       2.420200      0.2133000    
 H    4.908300       1.489900       1.448400    


%chk=000133616-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133616

0 1
O -0.725998 0.184980 -1.579930
O -2.188339 1.971340 0.907808
O -3.907279 0.904762 -0.232545
N -2.443686 -1.582706 -0.234141
C 0.540224 -1.257861 0.055552
C -0.466565 -0.096116 -0.147519
C -1.878877 -0.400149 0.415268
C 1.851283 -1.029709 -0.765965
C 0.853313 -1.458983 1.556353
C 2.599604 0.251390 -0.445690
C -2.775332 0.853658 0.289436
C 3.868469 0.312734 0.036534
C 4.626640 1.584619 0.345395
H 0.057049 -2.175948 -0.331248
H -0.087649 0.817875 0.352316
H -1.771122 -0.586347 1.501258
H 1.600048 -1.062167 -1.847679
H 2.520684 -1.892813 -0.587644
H 1.240945 -0.530956 2.017218
H 1.624569 -2.240249 1.685968
H -0.039859 -1.784422 2.118691
H 2.071416 1.203232 -0.625687
H 0.104604 0.503143 -2.010985
H -2.439043 -1.477440 -1.255965
H -3.378696 -1.826924 0.108100
H 4.405130 -0.631611 0.221877
H -2.801589 2.751215 0.824526
H 5.551316 1.656320 -0.260104
H 4.014135 2.481008 0.141999
H 4.939205 1.616027 1.407505


