%chk=000050332.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050332

0 1
 O   -1.613800       1.870500     -0.3149000    
 O   -2.110200     -0.3902000      -1.670800    
 O  -0.9127000      -1.932700       1.403500    
 C   -2.049000      0.7435000      0.4557000    
 C  -0.7311000       1.431900      0.7280000    
 C   -2.047500     -0.5785000     -0.2570000    
 C   0.5270000      0.7231000      0.3140000    
 C  -0.8034000      -1.421700      7.6600000E-02
 C   0.4989000     -0.6517000     -9.3000000E-03
 C    1.753800       1.401300      0.2355000    
 C    1.680000      -1.314100     -0.3761000    
 C    2.922400      0.7380000     -0.1409000    
 C    2.885600     -0.6194000     -0.4442000    
 H   -2.867300      0.8787000       1.148400    
 H  -0.6842000       2.050500       1.618700    
 H   -2.950800      -1.125500      3.8100000E-02
 H  -0.7630000      -2.278800     -0.6071000    
 H    1.801400       2.461600      0.4738000    
 H    1.664600      -2.375200     -0.6120000    
 H   -2.175100      -1.269000      -2.081900    
 H  -7.5800002E-02  -2.371000       1.633900    
 H    3.861400       1.281400     -0.1937000    
 H    3.795600      -1.137200     -0.7326000    


%chk=000050332-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000050332

0 1
O -1.490999 1.850400 -0.566133
O -2.487403 -0.554653 -1.619409
O -0.909591 -2.034615 1.334197
C -2.019029 0.775722 0.345289
C -0.702423 1.415791 0.672627
C -2.076887 -0.646157 -0.212681
C 0.569755 0.709567 0.354658
C -0.757587 -1.436935 -0.025337
C 0.532256 -0.639433 -0.094072
C 1.807637 1.389519 0.424410
C 1.731693 -1.272634 -0.494454
C 3.004248 0.746098 0.037227
C 2.966026 -0.586398 -0.433721
H -2.907717 1.096985 0.901643
H -0.669287 2.188145 1.451579
H -2.828938 -1.206946 0.380541
H -0.724627 -2.256790 -0.774281
H 1.832632 2.431265 0.765733
H 1.699823 -2.308204 -0.857007
H -2.795851 -1.450264 -1.912206
H -0.012782 -2.293375 1.667792
H 3.957556 1.282860 0.090909
H 3.888295 -1.084447 -0.751603


