%chk=000178322.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178322

0 1
 O    2.081900       2.185300      0.1255000    
 O   -2.195200     -0.9317000      -1.573800    
 C    1.037700     -0.3096000      0.5783000    
 C    2.000900      -1.318700     -9.9999997E-05
 C   0.7922000      -1.779800      0.7621000    
 C   0.2634000      0.5808000     -0.3783000    
 C   -1.251700      0.6752000     -8.5299999E-02
 C   0.6913000       2.065000     -0.1626000    
 C  -0.3602000      -2.437600      9.7599998E-02
 C   -2.137100     -0.5888000     -0.1766000    
 C   -1.287300       1.495600       1.207300    
 C   -1.675800      -1.837800      0.5951000    
 C    1.976800      -1.491000      -1.482400    
 C    3.359800      -1.519700      0.5803000    
 C  -0.1443000       2.517600       1.055700    
 C   0.4267000       2.948900      -1.388300    
 C   -3.579100     -0.2535000      0.2458000    
 H    1.321400      0.2003000       1.494300    
 H   0.9398000      -2.168300       1.765600    
 H   0.4033000      0.3315000      -1.429300    
 H   -1.666100       1.338500     -0.8599000    
 H  -0.3364000      -3.493000      0.4009000    
 H  -0.3385000      -2.464800     -0.9910000    
 H   -1.113400      0.8620000       2.084300    
 H   -2.245600       2.005400       1.349300    
 H   -2.438400      -2.617600      0.4607000    
 H   -1.628900      -1.626900       1.670600    
 H    2.606200     -0.7255000      -1.952900    
 H    1.011900      -1.456300      -1.988800    
 H    2.412400      -2.463200      -1.744300    
 H    4.074100     -0.8112000      0.1477000    
 H    3.720500      -2.535200      0.3855000    
 H    3.362000      -1.369000       1.665400    
 H  -0.5536000       3.523700      0.9075000    
 H   0.4539000       2.551900       1.973500    
 H   0.7967000       3.965900      -1.211900    
 H   0.9720000       2.570400      -2.260600    
 H  -0.6319000       3.020000      -1.650400    
 H   -3.652900     -5.1500000E-02   1.319100    
 H   -3.958400      0.6183000     -0.3000000    
 H   -4.257200      -1.080800      5.2000000E-03
 H    2.573200       1.798500     -0.6196000    
 H   -2.613300     -0.1969000      -2.054100    


%chk=000178322-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178322

0 1
O 2.066160 2.252229 0.248326
O -2.237738 -0.978883 -1.580638
C 1.061132 -0.304415 0.483609
C 2.047771 -1.364262 -0.082941
C 0.785150 -1.805120 0.690521
C 0.210374 0.609120 -0.406056
C -1.304480 0.692972 -0.029867
C 0.651520 2.112734 -0.177888
C -0.432722 -2.474606 0.068928
C -2.206774 -0.572070 -0.137480
C -1.263003 1.470005 1.313675
C -1.750891 -1.858344 0.595713
C 2.147703 -1.603492 -1.588788
C 3.389549 -1.507191 0.636213
C -0.211720 2.590173 1.039284
C 0.448106 2.973769 -1.442319
C -3.650025 -0.221052 0.297968
H 1.445845 0.215892 1.368330
H 0.983477 -2.154038 1.715196
H 0.316012 0.330787 -1.471495
H -1.760392 1.396921 -0.767518
H -0.413302 -3.555213 0.312109
H -0.435774 -2.398872 -1.031440
H -0.925880 0.803471 2.129319
H -2.243848 1.885508 1.603751
H -2.572634 -2.591487 0.478519
H -1.663507 -1.640618 1.678589
H 2.842960 -0.877838 -2.056809
H 1.178259 -1.522757 -2.109163
H 2.545687 -2.617021 -1.788991
H 4.137789 -0.792855 0.238556
H 3.801020 -2.528067 0.511790
H 3.288799 -1.313478 1.719989
H -0.709883 3.548614 0.805039
H 0.456016 2.766581 1.899015
H 0.708841 4.025103 -1.226661
H 1.094077 2.619771 -2.269094
H -0.599096 2.943581 -1.796281
H -3.718583 -0.084561 1.392271
H -4.001336 0.713711 -0.181765
H -4.331847 -1.039561 0.007127
H 2.643883 1.800149 -0.419029
H -2.603896 -0.218887 -2.102514


