%chk=000104166.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104166

0 1
 O   0.1023000      -3.409900      0.7885000    
 C    2.997000       1.353200      7.9800002E-02
 C   -3.093800       1.180600      0.1132000    
 C    2.477300      0.4443000      -1.051300    
 C   -2.519500      0.2960000      -1.020700    
 C    1.192900     -0.2738000     -0.7157000    
 C   -1.206700     -0.3371000     -0.7051000    
 C  -1.9700000E-02  0.3265000      -1.015400    
 C    1.249200      -1.520900     -0.1136000    
 C   -1.165800      -1.592800     -9.8899998E-02
 C    1.955000       2.389900      0.5075000    
 C    3.400600      0.5008000       1.285400    
 C   -3.213700      0.4094000       1.430000    
 C   -2.217400       2.418700      0.3193000    
 C   6.2300000E-02  -2.184700      0.1970000    
 H    3.886300       1.878200     -0.2900000    
 H   -4.093500       1.511900     -0.1941000    
 H    3.247400     -0.2886000      -1.326400    
 H    2.323100       1.048400      -1.955700    
 H   -3.249600     -0.4900000      -1.258100    
 H   -2.434500      0.8881000      -1.941800    
 H  -4.9199998E-02   1.299900      -1.497700    
 H    2.206000      -1.985000      0.1102000    
 H   -2.085500      -2.120300      0.1421000    
 H    1.112300       1.939700       1.040100    
 H    1.574800       2.947200     -0.3546000    
 H    2.410800       3.115600       1.190700    
 H    3.921700       1.122500       2.022600    
 H    2.540500      5.7399999E-02   1.796200    
 H    4.087000     -0.3007000      0.9928000    
 H   -2.239700      0.1652000       1.865400    
 H   -3.780900     -0.5170000       1.292000    
 H   -3.751300       1.014200       2.169100    
 H   -2.713600       3.119400       1.000200    
 H   -1.249000       2.173500      0.7630000    
 H   -2.046900       2.945000     -0.6256000    
 H    1.031200      -3.665800      0.9213000    


%chk=000104166-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104166

0 1
O 0.040331 -3.514999 0.782118
C 3.119646 1.369705 0.050837
C -3.173602 1.181172 0.133285
C 2.544431 0.433235 -1.067144
C -2.571793 0.290286 -1.008280
C 1.247966 -0.289156 -0.723845
C -1.230954 -0.361747 -0.696366
C -0.011457 0.295541 -1.010873
C 1.277938 -1.571834 -0.119402
C -1.179161 -1.641463 -0.094139
C 2.167393 2.541601 0.384202
C 3.503323 0.589264 1.329617
C -3.495173 0.363878 1.406204
C -2.276194 2.395214 0.467091
C 0.068781 -2.234931 0.191127
H 4.051055 1.801766 -0.373959
H -4.133026 1.571232 -0.269351
H 3.326303 -0.311714 -1.315814
H 2.387922 1.049326 -1.974432
H -3.315300 -0.494861 -1.248396
H -2.468399 0.924067 -1.911277
H -0.044740 1.276183 -1.501408
H 2.243654 -2.052085 0.091816
H -2.093659 -2.193763 0.144907
H 1.221138 2.171187 0.819230
H 1.917775 3.128856 -0.519922
H 2.633359 3.226894 1.116713
H 3.980806 1.260099 2.067968
H 2.609486 0.144008 1.803538
H 4.214752 -0.228600 1.105016
H -2.573902 -0.050241 1.854731
H -4.172723 -0.481982 1.182185
H -3.986892 1.000879 2.165077
H -2.766001 3.048562 1.213099
H -1.307321 2.067539 0.886551
H -2.067850 3.003524 -0.433641
H 0.959490 -3.847644 0.934639


