%chk=000017314.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017314

0 1
 O    2.307100      0.8635000       1.204300    
 O    2.458600      0.9295000      -1.062700    
 C  -0.6405000      0.8059000     -1.9300001E-02
 C   0.5066000      1.2400000E-02 -2.7000001E-02
 C   -1.901100      0.2093000     -3.0000001E-04
 C   0.3931000      -1.377800     -1.5900001E-02
 C   -2.014700      -1.181000      1.1100000E-02
 C  -0.8676000      -1.974400      3.1999999E-03
 C  -0.5256000       2.298100     -3.1199999E-02
 C   -3.145600       1.035300      8.2999999E-03
 C    1.603000      -2.254600     -2.3900000E-02
 C    1.827000      0.6339000     -4.6599999E-02
 H   -2.989100      -1.662100      2.7200000E-02
 H  -0.9746000      -3.056000      1.2600000E-02
 H   0.4758000       2.667200      0.2053000    
 H  -0.7945000       2.685100      -1.019800    
 H   -1.185400       2.747300      0.7189000    
 H   -3.245000       1.569400      0.9588000    
 H   -3.144300       1.754300     -0.8174000    
 H   -4.041700      0.4165000     -0.1139000    
 H    2.208400      -2.066300     -0.9168000    
 H    2.210200      -2.079300      0.8702000    
 H    1.336300      -3.317100     -3.2299999E-02
 H    3.194100       1.281800       1.183900    


%chk=000017314-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017314

0 1
O 2.038278 1.553726 1.078725
O 2.916041 0.169722 -0.548658
C -0.622191 0.815953 0.030213
C 0.532055 -0.030546 0.028659
C -1.918599 0.219332 -0.021639
C 0.418164 -1.456530 -0.061761
C -2.024452 -1.189532 -0.082492
C -0.880119 -2.011300 -0.107510
C -0.516931 2.333411 0.058670
C -3.182143 1.064020 -0.014140
C 1.622046 -2.382953 -0.087795
C 1.911747 0.538147 0.109041
H -3.019903 -1.648415 -0.116319
H -0.992131 -3.100156 -0.159222
H 0.431036 2.697227 -0.364674
H -1.345040 2.795230 -0.505178
H -0.565652 2.712337 1.097017
H -3.202986 1.768342 0.837985
H -3.277256 1.671326 -0.935342
H -4.078137 0.423931 0.054657
H 2.214740 -2.241140 -1.007655
H 2.312018 -2.193238 0.754628
H 1.295339 -3.435192 -0.033648
H 2.984578 1.867199 1.073139


