%chk=000037791.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037791

0 1
 O   -2.544600      -2.599100     -0.5534000    
 O   -3.640300      -1.718600       1.241100    
 C   0.4631000      0.4242000     -4.1700002E-02
 C   -1.947300     -0.4193000      9.8499998E-02
 C   -1.409300       1.903600      0.8952000    
 C   -1.352300       1.383700      -1.562100    
 C  -0.4586000     -0.8048000      0.2158000    
 C   7.4900001E-02   1.515000       1.004100    
 C   0.1337000       1.001700      -1.450100    
 C   -2.276800      0.6612000       1.141600    
 C   -2.216800      0.1372000      -1.312300    
 C   -1.686100       2.451600     -0.5116000    
 C    1.938800     -3.0000001E-04  2.2700001E-02
 C   -2.811000      -1.623000      0.3486000    
 C    2.792500      0.5828000      0.9595000    
 C    2.425500     -0.9687000     -0.8558000    
 C    4.131800      0.1975000       1.017800    
 C    3.764800      -1.354000     -0.7974000    
 C    4.618100     -0.7709000      0.1395000    
 H   -1.644800       2.670700       1.641600    
 H   -1.555600       1.777900      -2.564200    
 H  -0.2298000      -1.609200     -0.4949000    
 H  -0.2553000      -1.225100       1.211100    
 H   0.6809000       2.419600      0.8601000    
 H   0.2650000       1.155500       2.024300    
 H   0.3656000      0.2758000      -2.239400    
 H   0.7584000       1.882500      -1.650700    
 H   -2.102000      0.2854000       2.158600    
 H   -3.338200      0.9386000       1.091800    
 H   -3.279300      0.3907000      -1.425200    
 H   -1.998800     -0.6149000      -2.081500    
 H   -2.738700       2.747800     -0.5986000    
 H   -1.086500       3.352900     -0.6887000    
 H    2.470000       1.338900       1.666000    
 H    1.784600      -1.438900      -1.595800    
 H   -3.098300      -3.395300     -0.4060000    
 H    4.797000      0.6510000       1.747000    
 H    4.143600      -2.107800      -1.481400    
 H    5.660800      -1.070900      0.1849000    


%chk=000037791-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037791

0 1
O -2.551695 -2.678417 -0.574698
O -3.692798 -1.805166 1.238797
C 0.453554 0.451679 -0.036756
C -1.967752 -0.416956 0.103890
C -1.421942 1.924045 0.893462
C -1.365793 1.397800 -1.574349
C -0.454501 -0.797993 0.215254
C 0.077106 1.541947 1.009223
C 0.133556 1.019732 -1.460260
C -2.304540 0.677472 1.151095
C -2.238901 0.138595 -1.334646
C -1.711000 2.484063 -0.523696
C 1.933757 0.029964 0.044220
C -2.825649 -1.651046 0.348388
C 2.839196 0.585023 0.985376
C 2.438638 -0.954977 -0.850360
C 4.192233 0.175818 1.032590
C 3.786614 -1.366983 -0.808359
C 4.674864 -0.802323 0.136707
H -1.656592 2.694887 1.653420
H -1.567572 1.783418 -2.593309
H -0.225612 -1.595207 -0.513653
H -0.241434 -1.202820 1.224289
H 0.701311 2.444422 0.851839
H 0.284284 1.171478 2.033440
H 0.391283 0.270320 -2.233281
H 0.769203 1.907505 -1.647584
H -2.135458 0.283354 2.171020
H -3.377100 0.940843 1.086573
H -3.311518 0.396204 -1.437351
H -2.008645 -0.642515 -2.082359
H -2.777139 2.774304 -0.608407
H -1.105766 3.394121 -0.706007
H 2.495783 1.345260 1.693352
H 1.772122 -1.410900 -1.592655
H -3.138073 -3.456403 -0.369236
H 4.867407 0.623216 1.771362
H 4.144498 -2.128348 -1.511020
H 5.722769 -1.120417 0.172690


