%chk=000028514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028514

0 1
 O   -1.665400     -0.9374000     -0.9067000    
 O   -1.366100      0.9661000      0.4834000    
 O    4.237800      0.6259000     -0.3356000    
 C   0.5993000     -0.2779000     -0.2671000    
 C  -0.3051000     -0.9103000      -1.341500    
 C   9.7000003E-03   1.091300      0.1206000    
 C    2.021700     -0.1033000     -0.8120000    
 C   0.6405000      -1.190800      0.9738000    
 C   -2.121900      0.3764000     -0.5771000    
 C   -3.563700      0.2635000     -0.1119000    
 C    2.947500      0.4741000      0.2396000    
 C    1.217300      -2.544500      0.6283000    
 C   -3.667800     -0.6260000       1.128400    
 C   -4.153300       1.645600      0.1756000    
 C    5.169500       1.147500      0.6023000    
 H  -0.2598000     -0.3219000      -2.268200    
 H  -1.2600000E-02  -1.922800      -1.627700    
 H   0.5137000       1.524100      0.9896000    
 H   9.1899998E-02   1.813700     -0.7011000    
 H    2.006200      0.5796000      -1.673300    
 H    2.435700      -1.031700      -1.221900    
 H  -0.3745000      -1.346600       1.362000    
 H    1.189300     -0.7419000       1.807800    
 H   -2.071700       1.015900      -1.468800    
 H   -4.154300     -0.2097000     -0.9070000    
 H    2.611300       1.457500      0.5802000    
 H    3.052200     -0.1888000       1.102100    
 H   0.6175000      -3.107900     -8.9199997E-02
 H    2.252100      -2.505200      0.2811000    
 H    1.234100      -3.155600       1.539400    
 H   -3.113600     -0.2123000       1.977600    
 H   -4.714300     -0.7270000       1.436900    
 H   -3.288700      -1.634500      0.9336000    
 H   -3.640900       2.144800       1.004700    
 H   -5.212600       1.562600      0.4417000    
 H   -4.082100       2.290100     -0.7069000    
 H    5.283100      0.4665000       1.451400    
 H    4.853100       2.135500      0.9504000    
 H    6.138100       1.247500      0.1050000    


%chk=000028514-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028514

0 1
O -1.681072 -0.906217 -0.948874
O -1.456063 0.943023 0.585446
O 4.330192 0.677024 -0.482817
C 0.616242 -0.252300 -0.171072
C -0.261862 -0.799158 -1.334522
C -0.028884 1.102382 0.245411
C 2.042130 -0.009079 -0.742117
C 0.593219 -1.224610 1.046813
C -2.202464 0.403272 -0.551845
C -3.677515 0.246112 -0.159682
C 3.085437 0.480290 0.270067
C 1.234427 -2.609598 0.813863
C -3.846711 -0.706871 1.045543
C -4.309897 1.631217 0.109476
C 5.431069 1.110495 0.374253
H -0.169508 -0.125601 -2.217423
H 0.037221 -1.816512 -1.633331
H 0.430672 1.518014 1.157405
H 0.074255 1.840055 -0.583849
H 1.992571 0.737162 -1.560656
H 2.426230 -0.942435 -1.197424
H -0.462164 -1.355898 1.347819
H 1.096823 -0.730484 1.902831
H -2.073178 1.105408 -1.414946
H -4.170059 -0.209065 -1.042539
H 2.779131 1.440043 0.744219
H 3.248853 -0.267102 1.077593
H 0.720109 -3.170700 0.012646
H 2.304396 -2.536936 0.544160
H 1.165063 -3.220330 1.732472
H -3.358331 -0.285430 1.941467
H -4.919214 -0.854732 1.268263
H -3.393596 -1.690220 0.832961
H -3.809581 2.123226 0.961996
H -5.382878 1.523017 0.350492
H -4.225114 2.298297 -0.769638
H 5.656084 0.357919 1.160489
H 5.208894 2.082140 0.866069
H 6.308273 1.226283 -0.281517


