%chk=000101850.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101850

0 1
 O  -5.5100001E-02  -2.745700      0.4852000    
 O    4.354000      0.5174000      -2.427600    
 O   -4.600300     -0.7508000      -1.390700    
 C    1.768800     -0.4592000      0.8949000    
 C  -0.4903000      0.8128000      0.6585000    
 C   0.4009000     -0.3589000      0.1295000    
 C   -1.768400      0.8656000     -0.1876000    
 C    2.491000      0.9345000      0.8476000    
 C   -2.591500     -0.4337000     -5.6299999E-02
 C   0.2558000       2.150600      0.6270000    
 C    1.595100       2.077600       1.351900    
 C    2.732000      -1.519200      0.2794000    
 C   -1.782300      -1.569200     -0.6626000    
 C  -0.4393000      -1.659400      5.5799998E-02
 C   -2.786300       1.977400      4.3900002E-02
 C    3.042900       1.277500     -0.5529000    
 C    1.548900     -0.8616000       2.376600    
 C    3.246300      -1.167200      -1.111000    
 C   -3.821100      7.8999996E-03 -0.8291000    
 C    3.949300      0.1829000      -1.104100    
 C   -3.988000       1.516800     -0.7929000    
 C   -3.062300     -0.7962000       1.364400    
 H  -0.7703000      0.6201000       1.699900    
 H   0.6290000     -0.1417000     -0.9230000    
 H   -1.448200      0.9746000      -1.238600    
 H    3.360200      0.8901000       1.520000    
 H  -0.3540000       2.928200       1.102600    
 H   0.4089000       2.473200     -0.4095000    
 H    2.116000       3.037000       1.244000    
 H    1.414500       1.957200       2.426700    
 H    2.272200      -2.510500      0.2440000    
 H    3.604300      -1.630400      0.9393000    
 H   -1.593100      -1.415400      -1.731200    
 H   -2.310400      -2.524600     -0.5645000    
 H   -2.426500       2.954600     -0.2926000    
 H   -3.054200       2.067500       1.102100    
 H    2.234800       1.464300      -1.269600    
 H    3.608100       2.217900     -0.5108000    
 H    1.154000      -1.877700       2.468700    
 H    2.495600     -0.8394000       2.929500    
 H   0.8589000     -0.1964000       2.901300    
 H    3.945200      -1.941000      -1.452300    
 H    2.431000      -1.170700      -1.844000    
 H    4.856300      0.1253000     -0.4903000    
 H   -3.927800       1.903300      -1.814400    
 H   -4.934600       1.796200     -0.3256000    
 H   -3.713300      -1.678600       1.334400    
 H   -2.230600      -1.031000       2.035200    
 H   -3.648100      4.1000000E-03   1.828400    
 H    4.936900     -0.1934000      -2.744600    


%chk=000101850-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101850

0 1
O -0.085001 -2.729327 0.636435
O 4.338214 0.544682 -2.489359
O -4.601057 -0.810562 -1.536695
C 1.779941 -0.451130 0.940153
C -0.491850 0.853971 0.690865
C 0.411162 -0.340543 0.176591
C -1.770190 0.906269 -0.167882
C 2.523888 0.935833 0.849729
C -2.577029 -0.424401 -0.126127
C 0.291318 2.188580 0.639650
C 1.646871 2.101319 1.374191
C 2.713737 -1.541175 0.318115
C -1.720295 -1.562057 -0.728003
C -0.415721 -1.646095 0.081697
C -2.842460 2.001678 0.081542
C 3.061869 1.249963 -0.574464
C 1.561237 -0.832421 2.431822
C 3.212372 -1.217530 -1.108741
C -3.852918 -0.034331 -0.898346
C 3.953908 0.131254 -1.123487
C -4.055732 1.490661 -0.748997
C -3.054361 -0.830061 1.305171
H -0.772350 0.661229 1.746317
H 0.628900 -0.081330 -0.885178
H -1.435948 1.035126 -1.224968
H 3.408864 0.850415 1.518058
H -0.324811 2.990526 1.091029
H 0.451231 2.474235 -0.420387
H 2.195694 3.056746 1.257898
H 1.466052 1.973804 2.459178
H 2.203784 -2.518402 0.338007
H 3.597577 -1.632097 0.985303
H -1.490882 -1.332230 -1.787832
H -2.233010 -2.537335 -0.686633
H -2.508040 3.001168 -0.243569
H -3.096372 2.072711 1.155674
H 2.240567 1.406223 -1.299208
H 3.638915 2.194008 -0.548223
H 1.160406 -1.856517 2.510607
H 2.525704 -0.794390 2.973702
H 0.865096 -0.151672 2.952182
H 3.883993 -2.029346 -1.456361
H 2.372865 -1.169457 -1.829922
H 4.866612 0.041334 -0.489812
H -4.070067 1.931038 -1.765022
H -5.042817 1.705862 -0.301889
H -3.706839 -1.718168 1.233103
H -2.200022 -1.095139 1.952015
H -3.624816 -0.026066 1.802545
H 4.886709 -0.174153 -2.895477


