%chk=000079889.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079889

0 1
 O   -3.136300       1.425600      0.2563000    
 O    1.889800       1.542000     -0.4997000    
 N    2.548500     -0.5322000      0.3044000    
 N    3.886700     -0.1887000      0.3118000    
 C   0.2028000     -3.1199999E-02 -8.0100000E-02
 C  -0.8126000      0.9132000      7.1099997E-02
 C  -0.1150000      -1.384700     -0.1935000    
 C   -2.145500      0.5042000      0.1089000    
 C   -1.448000      -1.793700     -0.1555000    
 C   -2.463200     -0.8492000     -4.4999998E-03
 C    1.592700      0.3948000     -0.1193000    
 H  -0.5796000       1.971300      0.1652000    
 H   0.6419000      -2.149200     -0.3415000    
 H   -1.696300      -2.846900     -0.2505000    
 H   -3.497700      -1.180700      2.1900000E-02
 H    2.309700      -1.447900      0.6704000    
 H   -3.994400      0.9675000      0.2616000    
 H    4.214600     -0.2988000       1.270500    
 H    4.375700     -0.8956000     -0.2358000    


%chk=000079889-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079889

0 1
O -3.039926 1.549135 0.237904
O 2.036693 1.431962 -0.280809
N 2.584663 -0.726262 0.372161
N 3.978866 -0.458900 0.455754
C 0.218545 -0.180552 -0.017705
C -0.757163 0.833416 0.107269
C -0.179442 -1.536546 -0.176540
C -2.126166 0.492634 0.099230
C -1.551974 -1.862889 -0.188320
C -2.532975 -0.857328 -0.043566
C 1.662670 0.251412 0.000357
H -0.446583 1.877712 0.201687
H 0.562038 -2.326733 -0.336580
H -1.865215 -2.903961 -0.320663
H -3.598736 -1.120275 -0.052320
H 2.290280 -1.621117 0.763330
H -3.972637 1.219724 0.213034
H 4.139309 0.392024 1.016053
H 4.371552 -0.333655 -0.488575


