%chk=000014611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014611

0 1
 O    2.454100      0.2498000       2.185800    
 O    1.068300      -2.249300      0.3406000    
 C    2.310800     -0.3180000     -0.1398000    
 C   -2.721200     -0.2635000      2.5300000E-02
 C    2.953400      0.2951000      0.9183000    
 C    1.041600      -1.049700      8.8799998E-02
 C    2.814700     -0.2724000      -1.426000    
 C   -1.419500     -0.9032000      0.1356000    
 C  -0.2299000     -0.2830000     -3.1599998E-02
 C    4.145300      0.9801000      0.6820000    
 C   -2.829600       1.122200      0.1430000    
 C   -3.861200      -1.035800     -0.1980000    
 C    4.006600      0.4126000      -1.662400    
 C    4.671800       1.039000     -0.6084000    
 C   -4.078000       1.735400      3.7300002E-02
 C   -5.109400     -0.4224000     -0.3040000    
 C   -5.217900      0.9632000     -0.1864000    
 H    2.302400     -0.7577000      -2.251800    
 H   -1.440900      -1.968100      0.3569000    
 H  -0.1390000      0.7685000     -0.2786000    
 H    4.674200       1.472900       1.493400    
 H   -1.973400       1.761700      0.3370000    
 H   -3.796500      -2.117000     -0.2937000    
 H    4.416700      0.4583000      -2.667000    
 H    5.599700       1.572400     -0.7926000    
 H   -4.163800       2.814000      0.1334000    
 H   -5.997000      -1.023600     -0.4782000    
 H   -6.190000       1.440700     -0.2677000    
 H    3.049200      0.7392000       2.779300    


%chk=000014611-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014611

0 1
O 1.609216 1.776138 0.729031
O 0.917013 -1.873384 -1.493661
C 2.350895 -0.214895 -0.511695
C -2.782896 -0.192955 -0.114265
C 2.650574 0.984096 0.204389
C 0.984516 -0.799097 -0.802208
C 3.458389 -0.956963 -1.015774
C -1.476254 -0.701450 -0.547668
C -0.247085 -0.148867 -0.291042
C 3.992612 1.400196 0.398065
C -2.942028 0.998272 0.655668
C -3.953648 -0.921485 -0.477072
C 4.790885 -0.552933 -0.829260
C 5.060098 0.638709 -0.113784
C -4.221535 1.437242 1.044664
C -5.235588 -0.482048 -0.087269
C -5.375102 0.700185 0.676111
H 3.212461 -1.872219 -1.564539
H -1.479674 -1.627555 -1.141906
H -0.127959 0.768305 0.287510
H 4.196856 2.326113 0.953235
H -2.059601 1.578042 0.947168
H -3.845821 -1.838403 -1.069382
H 5.611737 -1.153724 -1.232964
H 6.090939 0.973575 0.044750
H -4.327173 2.353857 1.635793
H -6.122223 -1.056898 -0.376266
H -6.369110 1.045460 0.981437
H 1.981006 2.574086 1.181434


