%chk=000095399.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095399

0 1
 O   -2.560100      0.5009000     -3.0999999E-02
 O    2.559700     -0.5004000     -3.2499999E-02
 O    1.236400       2.287500     -0.2185000    
 O   -1.237700      -2.288400     -0.2211000    
 O   -1.020700       1.318500      -1.537600    
 O    1.020600      -1.314200      -1.541200    
 C  -0.3328000      0.6982000      0.7248000    
 C   0.3326000     -0.7002000      0.7231000    
 C   0.7667000       1.761300      0.7904000    
 C  -0.7662000      -1.764000      0.7880000    
 C   -1.312300      0.8950000     -0.4272000    
 C    1.311900     -0.8934000     -0.4298000    
 C    1.222200       2.188200       2.163100    
 C   -1.220100      -2.193400       2.160600    
 C   -3.585200      0.6063000      -1.023900    
 C    3.585100     -0.6034000      -1.025100    
 C   -4.896000      0.1349000     -0.4313000    
 C    4.895700     -0.1334000     -0.4309000    
 H  -0.9203000      0.8256000       1.645400    
 H   0.9209000     -0.8292000       1.643000    
 H   0.4004000       2.687100       2.682300    
 H    1.553900       1.316200       2.731500    
 H    2.061300       2.883600       2.072200    
 H   -2.058200      -2.889900       2.069500    
 H   -1.552600      -1.322600       2.730400    
 H  -0.3972000      -2.691800       2.678500    
 H   -3.323200     -1.7400000E-02  -1.885800    
 H   -3.677600       1.650000      -1.344300    
 H    3.323600      2.2399999E-02  -1.885700    
 H    3.677700      -1.646400      -1.348000    
 H   -5.162500      0.7379000      0.4429000    
 H   -4.812600     -0.9019000     -8.8799998E-02
 H   -5.703500      0.2008000      -1.165600    
 H    5.161800     -0.7385000      0.4421000    
 H    4.812100      0.9025000     -8.5800000E-02
 H    5.703600     -0.1975000      -1.165000    


%chk=000095399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095399

0 1
O -2.698194 0.969976 0.320089
O 2.698907 -0.970629 0.315524
O 0.831169 2.147975 2.425368
O -0.831579 -2.163248 2.410504
O -1.384001 -0.703595 -0.614348
O 1.385612 0.709648 -0.608006
C -0.594263 0.494313 1.399565
C 0.594045 -0.502430 1.396672
C -0.056933 1.952778 1.554396
C 0.056620 -1.961906 1.541031
C -1.549446 0.191165 0.248429
C 1.550301 -0.191205 0.248553
C -0.602216 3.066544 0.692323
C 0.601854 -3.069630 0.671141
C -3.749709 0.688121 -0.711777
C 3.751322 -0.681128 -0.713323
C -4.905986 1.642412 -0.436107
C 4.906441 -1.638963 -0.445223
H -1.166823 0.292704 2.329544
H 1.165749 -0.307014 2.328508
H -0.398535 2.829944 -0.368508
H -1.696962 3.149026 0.803949
H -0.112899 4.014231 0.963725
H 0.111671 -4.018966 0.935127
H 1.696440 -3.153749 0.783310
H 0.399536 -2.825214 -0.388153
H -4.040851 -0.373265 -0.616522
H -3.300821 0.835364 -1.710383
H 4.043546 0.379091 -0.608761
H 3.302857 -0.819270 -1.713411
H -4.584976 2.694258 -0.527975
H -5.312242 1.487663 0.577845
H -5.716741 1.463633 -1.165610
H 4.584510 -2.689636 -0.546754
H 5.312028 -1.493650 0.570394
H 5.717968 -1.454447 -1.172436


