%chk=000100159.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100159

0 1
 O   -1.748900      0.2708000      -1.723300    
 O   0.3054000      -1.296300     -0.6664000    
 O    2.317700      -2.395100     -0.8263000    
 O    4.302600     -0.1402000     -0.3056000    
 C   -1.007600      0.7543000     -0.6064000    
 C   -2.465000      0.4040000     -0.4887000    
 C  -0.2093000     -0.2516000      0.1701000    
 C   -2.598100     -0.8154000      0.3997000    
 C   -1.234100     -0.8589000       1.153100    
 C  -0.5967000       2.199100     -0.5833000    
 C    1.010500      0.3091000      0.8020000    
 C  -0.1527000       2.559600      0.8534000    
 C   0.9621000       1.664100       1.436700    
 C   -2.848900      -2.089100     -0.4177000    
 C   -3.743700     -0.6352000       1.403900    
 C   0.4850000       2.498500      -1.620300    
 C    2.085300     -0.4296000      0.5224000    
 C    1.623800      -1.500000     -0.3751000    
 C    3.512600     -0.2481000      0.8718000    
 H   -3.217200       1.171300     -0.3965000    
 H  -0.9753000      -1.878500       1.460400    
 H   -1.292900     -0.2381000       2.057000    
 H   -1.461100       2.829800     -0.8298000    
 H   -1.029000       2.472900       1.510900    
 H   0.1586000       3.610000      0.9039000    
 H   0.8117000       1.563400       2.517600    
 H    1.920700       2.176500       1.293800    
 H   -3.782800      -2.008600     -0.9858000    
 H   -2.051200      -2.284700      -1.140700    
 H   -2.924800      -2.966200      0.2344000    
 H   -4.709000     -0.5621000      0.8899000    
 H   -3.793200      -1.476700       2.103500    
 H   -3.620800      0.2836000       1.989000    
 H    1.388900       1.901000      -1.470700    
 H   0.1179000       2.281400      -2.629400    
 H   0.7698000       3.555200      -1.586700    
 H    3.871900      -1.111100       1.441300    
 H    3.684000      0.6427000       1.483000    
 H    3.998900      0.6453000     -0.7927000    


%chk=000100159-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100159

0 1
O -1.819181 0.217034 -1.748988
O 0.302834 -1.407176 -0.697058
O 2.396848 -2.421063 -0.984557
O 4.218120 0.710373 -0.218781
C -1.047326 0.757149 -0.583351
C -2.500873 0.430652 -0.406219
C -0.229444 -0.327204 0.182929
C -2.681380 -0.832531 0.465742
C -1.274591 -0.956010 1.154938
C -0.465855 2.161843 -0.665421
C 1.003938 0.284089 0.821646
C -0.058575 2.603780 0.775630
C 0.882978 1.597003 1.546523
C -2.999121 -2.076808 -0.401678
C -3.792770 -0.601268 1.517105
C 0.672489 2.272763 -1.708388
C 2.116382 -0.425623 0.462603
C 1.712081 -1.527651 -0.459366
C 3.562777 -0.160567 0.786016
H -3.282020 1.200431 -0.437223
H -0.998760 -1.996071 1.399419
H -1.283148 -0.369800 2.095230
H -1.281759 2.836077 -0.994974
H -0.982961 2.750414 1.365991
H 0.438751 3.589179 0.717238
H 0.466842 1.432358 2.560775
H 1.884999 2.035070 1.699600
H -3.939810 -1.932635 -0.964067
H -2.190552 -2.263543 -1.126429
H -3.114968 -2.969750 0.240299
H -4.784915 -0.532111 1.034106
H -3.825654 -1.441832 2.234227
H -3.624568 0.328685 2.094066
H 1.531713 1.620519 -1.472224
H 0.301947 1.975978 -2.704886
H 1.035652 3.315288 -1.771727
H 4.134324 -1.100404 0.728572
H 3.669081 0.270065 1.802409
H 3.711576 1.560396 -0.287328


