%chk=000081391.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081391

0 1
 O    2.267000       1.847300     -1.1000000E-03
 O    3.641600     -0.1321000       0.000000    
 O   -2.495300      0.4542000     -9.9999997E-05
 O   -2.486900      -1.847800     -1.7000000E-03
 C    1.527800      0.7045000      3.9999999E-04
 C    2.312800     -0.4257000      8.9999998E-04
 C  -0.4321000     -0.6384000      9.9999997E-05
 C   0.1499000      0.6315000      1.9999999E-04
 C    1.763300      -1.691300      1.1000000E-03
 C   0.3701000      -1.793200      6.0000003E-04
 C    3.605200       1.309500     -7.9999998E-04
 C   -1.880800     -0.7682000     -1.1000000E-03
 C   -3.926900      0.4584000      1.9999999E-04
 C   -4.415800       1.891100      1.2000001E-03
 H  -0.4253000       1.550800     -6.9999998E-04
 H    2.385500      -2.579000      1.2000001E-03
 H  -7.9099998E-02  -2.783300      5.0000002E-04
 H    4.129700       1.674300      0.8898000    
 H    4.129800       1.673400     -0.8917000    
 H   -4.292100     -5.8400001E-02 -0.8941000    
 H   -4.291700     -5.9500001E-02  0.8940000    
 H   -5.508600       1.931700      1.4000000E-03
 H   -4.041600       2.425100      0.8809000    
 H   -4.042000       2.426200     -0.8780000    


%chk=000081391-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081391

0 1
O 2.427583 1.862718 -0.000765
O 3.738461 -0.150813 -0.000435
O -2.557999 0.491698 0.000338
O -2.524828 -1.839487 0.000239
C 1.585053 0.722264 -0.000400
C 2.361584 -0.461554 -0.000215
C -0.421529 -0.594057 -0.000035
C 0.193589 0.696333 -0.000315
C 1.776378 -1.732214 0.000073
C 0.360272 -1.779206 0.000155
C 3.817929 1.337508 -0.000252
C -1.903109 -0.745021 0.000096
C -4.045405 0.441203 0.000517
C -4.539689 1.885182 0.000722
H -0.411572 1.604346 -0.000434
H 2.384235 -2.640023 0.000223
H -0.163704 -2.739893 0.000358
H 4.329157 1.666813 0.920844
H 4.329905 1.667004 -0.920846
H -4.378625 -0.119306 -0.892705
H -4.378408 -0.119484 0.893710
H -5.645207 1.900069 0.000859
H -4.184676 2.423418 0.896458
H -4.184894 2.423601 -0.894991


