%chk=000133251.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133251

0 1
 O   -3.175800      0.8241000       1.133900    
 O   -3.144200      -1.365100     -0.5710000    
 O    3.343500      -1.409800       1.909300    
 N    4.575800      2.0099999E-02  7.9700001E-02
 N    2.501200     -0.7399000       1.017100    
 C    2.444200      0.7134000     -0.8775000    
 C    1.521700       1.737700     -0.1906000    
 C    1.551100     -0.2222000      -1.712800    
 C   0.2160000       1.005300     -0.1560000    
 C   0.2322000     -9.8300003E-02  -1.014300    
 C    3.206200     -6.5600000E-02  0.1587000    
 C  -0.9199000       1.330800      0.5669000    
 C  -0.8872000     -0.8995000      -1.168500    
 C   -2.049700      0.5222000      0.4265000    
 C   -2.033600     -0.5853000     -0.4355000    
 C   -4.111600       1.704000      0.5153000    
 C   -3.269900      -2.471800      0.3189000    
 H    3.163600       1.227700      -1.526300    
 H    1.415700       2.636900     -0.8074000    
 H    1.859600       2.018500      0.8119000    
 H    1.909500      -1.256300      -1.728200    
 H    1.454000      0.1492000      -2.738800    
 H  -0.9303000       2.193400       1.225400    
 H  -0.8729000      -1.749100      -1.843600    
 H    5.045300      0.5731000     -0.6294000    
 H    5.165200     -0.4760000      0.7395000    
 H   -4.956300       1.839500       1.196200    
 H   -4.482800       1.276200     -0.4214000    
 H   -3.653700       2.680200      0.3272000    
 H   -2.439800      -3.171700      0.1801000    
 H   -4.205600      -2.989800      9.1700003E-02
 H   -3.303100      -2.129400       1.358000    
 H    2.700800      -1.862500       2.481200    


%chk=000133251-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133251

0 1
O -3.186288 1.047357 1.103143
O -3.230119 -1.334613 -0.575816
O 4.186807 -1.927264 1.314784
N 4.308144 0.575746 0.845541
N 3.242738 -1.471365 0.242199
C 2.578770 0.583740 -0.945687
C 1.649827 1.673179 -0.282159
C 1.605400 -0.349048 -1.738500
C 0.284491 1.003793 -0.230064
C 0.259334 -0.141656 -1.063298
C 3.406063 -0.160357 0.099293
C -0.865774 1.401739 0.477948
C -0.911566 -0.915721 -1.172453
C -2.049899 0.639638 0.358687
C -2.063497 -0.537865 -0.446625
C -4.355407 1.425455 0.276217
C -3.646687 -2.009129 0.675462
H 3.300582 1.068656 -1.632488
H 1.614208 2.580096 -0.919323
H 2.009953 1.987123 0.714572
H 1.941989 -1.398458 -1.705016
H 1.563167 -0.037972 -2.801308
H -0.882453 2.289443 1.119168
H -0.957442 -1.821335 -1.786183
H 4.430863 1.572988 0.702380
H 4.861435 0.080736 1.542954
H -5.154973 1.670805 0.992227
H -4.662246 0.590034 -0.378601
H -4.115159 2.314523 -0.338036
H -2.862286 -2.717202 1.004341
H -4.565776 -2.559329 0.421109
H -3.843958 -1.271716 1.474606
H 3.978959 -2.892019 1.367124


