%chk=000122757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122757

0 1
 O    2.050500      0.7101000     -0.4015000    
 O    1.414100      -1.320500      0.3952000    
 N   -1.224600     -0.7508000      3.1300001E-02
 N   -2.539300     -0.2633000     -0.2290000    
 C  -0.2732000      0.3077000     -0.3013000    
 C  -0.5509000       1.536000      0.5547000    
 C    1.123400     -0.2192000     -4.9300000E-02
 H  -0.3401000      0.5552000      -1.368900    
 H   0.2099000       2.307700      0.3904000    
 H   -1.516600       2.000300      0.3284000    
 H  -0.5271000       1.294000       1.624200    
 H   -1.051600      -1.566900     -0.5553000    
 H   -2.667900     -0.1501000      -1.234200    
 H   -3.215000     -0.9692000      6.0500000E-02
 H    2.965100      0.3888000     -0.2514000    


%chk=000122757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122757

0 1
O 2.107615 0.746633 -0.227106
O 1.357887 -1.440000 -0.043993
N -1.283288 -0.667567 0.002591
N -2.569021 -0.402548 -0.539095
C -0.292404 0.391105 -0.279221
C -0.497242 1.614805 0.642637
C 1.098467 -0.219616 -0.157687
H -0.374838 0.749651 -1.334761
H 0.192202 2.434716 0.380746
H -1.538623 1.956815 0.517830
H -0.343229 1.329530 1.697021
H -0.908462 -1.616557 -0.140253
H -2.761706 -0.765173 -1.481665
H -3.324331 -0.546853 0.133184
H 2.993675 0.294858 -0.176430


