%chk=000040399.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040399

0 1
 O   -1.579500      0.7407000      -2.040200    
 O   1.3000000E-03   2.610800      0.2942000    
 O   -4.018500     -0.5257000      -1.848500    
 O    4.773100       1.308700     -7.9300001E-02
 O    2.350800      -2.821800     -1.6200000E-02
 O    4.757800      -1.459900     -0.1517000    
 O   -5.030600      -1.202700      0.6378000    
 C   -1.355300      0.7062000      0.3421000    
 C    1.220400      0.6195000      0.1548000    
 C  -6.3100003E-02   1.373900      0.2668000    
 C   -2.076500      0.4078000     -0.8141000    
 C    1.175800     -0.7553000      0.1218000    
 C    2.397900       1.328600      8.9199997E-02
 C   -1.869500      0.3634000       1.592700    
 C   -3.311700     -0.2335000     -0.7195000    
 C    3.597100      0.6238000     -1.5100000E-02
 C    2.375000      -1.460100      1.7700000E-02
 C    3.585700     -0.7706000     -5.0900001E-02
 C   -3.104500     -0.2776000       1.687300    
 C   -3.825600     -0.5762000      0.5312000    
 H   0.2469000      -1.313400      0.1732000    
 H    2.417400       2.414100      0.1168000    
 H   -1.316900      0.5907000       2.500800    
 H   -3.492900     -0.5391000       2.668000    
 H   -2.215800      0.4543000      -2.718200    
 H   -4.845200     -0.9675000      -1.587600    
 H    4.587800       2.262700     -4.0800001E-02
 H    1.428600      -3.125500      4.1999999E-02
 H    5.488900     -0.8188000     -0.1870000    
 H   -5.223500      -1.360900       1.577900    


%chk=000040399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040399

0 1
O -1.067806 -0.117457 -1.639577
O 0.070693 2.336080 1.481229
O -3.589351 -1.067262 -1.770745
O 4.839749 1.363703 -0.298610
O 2.584928 -2.817194 -0.618700
O 4.850388 -1.259284 -0.840755
O -5.340704 -0.896908 0.334044
C -1.374052 0.597444 0.698814
C 1.221606 0.551024 0.365989
C -0.013877 1.225538 0.858793
C -1.854776 -0.017310 -0.489997
C 1.269858 -0.835846 0.074651
C 2.405869 1.330011 0.266413
C -2.279246 0.735265 1.788334
C -3.185131 -0.495957 -0.548968
C 3.593125 0.713385 -0.140688
C 2.474790 -1.450721 -0.324155
C 3.655395 -0.674579 -0.441186
C -3.599319 0.249446 1.739844
C -4.049493 -0.372539 0.553881
H 0.359347 -1.438728 0.161856
H 2.353228 2.393953 0.524141
H -1.914542 1.249837 2.681945
H -4.264758 0.357239 2.603893
H -1.620290 -0.508730 -2.369238
H -4.543666 -1.329295 -1.718117
H 4.778985 2.327166 -0.096133
H 1.700571 -3.254198 -0.540902
H 5.550724 -0.552097 -0.856620
H -5.936843 -0.745384 1.105764


