%chk=000146680.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146680

0 1
 O   0.9810000       1.558200       1.097400    
 O  -0.9810000      -1.558200       1.097400    
 O    5.419300      -1.595000      -1.415700    
 O   -5.419300       1.594900      -1.415700    
 O    3.377100       2.052700       1.913300    
 O   -3.377100      -2.052700       1.913300    
 C   0.7181000     -0.1004000     -0.5791000    
 C  -0.7181000      0.1004000     -0.5791000    
 C    2.932500      0.4237000      0.2420000    
 C   -2.932500     -0.4238000      0.2419000    
 C    3.480000     -0.5256000     -0.6223000    
 C   -3.480000      0.5256000     -0.6224000    
 C    1.549300      0.6371000      0.2640000    
 C   -1.549300     -0.6371000      0.2640000    
 C    1.263200      -1.048700      -1.442700    
 C   -1.263200       1.048700      -1.442600    
 C    2.641800      -1.263400      -1.466600    
 C   -2.641800       1.263400      -1.466600    
 C    4.937500     -0.7611000     -0.6570000    
 C   -4.937500      0.7611000     -0.6570000    
 C    3.803000       1.207800       1.135300    
 C   -3.803000      -1.207700       1.135300    
 C    5.797000      4.2500000E-02  0.2544000    
 C   -5.797100     -4.2599998E-02  0.2544000    
 C    5.256000      0.9487000       1.076800    
 C   -5.256000     -0.9487000       1.076800    
 C    7.272300     -0.2134000      0.2003000    
 C   -7.272200      0.2134000      0.2003000    
 H   0.6288000      -1.632200      -2.106200    
 H  -0.6289000       1.632200      -2.106300    
 H    3.041700      -2.008600      -2.149100    
 H   -3.041700       2.008600      -2.149100    
 H    5.877500       1.538300       1.743800    
 H   -5.877500      -1.538400       1.743800    
 H    7.825000      0.4209000      0.9016000    
 H    7.659000     -1.1800000E-02 -0.8041000    
 H    7.489200      -1.256000      0.4549000    
 H   -7.489100       1.256100      0.4548000    
 H   -7.825000     -0.4208000      0.9016000    
 H   -7.658900      1.1900000E-02 -0.8042000    
 H    1.650800       2.004000       1.636300    
 H  -1.6200000E-02  -1.587700       1.010600    


%chk=000146680-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146680

0 1
O 1.146330 0.627148 1.792181
O -1.082719 -0.584986 1.837466
O 5.632574 -0.703663 -2.105199
O -5.565075 0.713166 -2.073905
O 3.422938 0.847146 2.675276
O -3.574793 -1.049713 2.719457
C 0.740575 -0.018003 -0.528764
C -0.742510 0.146763 -0.491967
C 3.056237 0.154248 0.399009
C -3.023778 -0.184763 0.483704
C 3.618391 -0.242291 -0.847608
C -3.594040 0.247624 -0.750770
C 1.639503 0.250186 0.556931
C -1.592188 -0.195901 0.631770
C 1.352910 -0.437550 -1.746399
C -1.372690 0.591762 -1.688198
C 2.749182 -0.549645 -1.914022
C -2.765076 0.654239 -1.820994
C 5.095996 -0.345166 -1.007262
C -5.078766 0.323922 -0.962318
C 3.932224 0.473561 1.532083
C -3.946809 -0.596548 1.590074
C 5.962859 -0.011454 0.181023
C -5.977287 -0.060198 0.164047
C 5.381931 0.372271 1.368747
C -5.411194 -0.474940 1.340499
C 7.450482 -0.121254 -0.010201
C -7.463760 0.031409 -0.068968
H 0.702104 -0.711602 -2.582052
H -0.744277 0.921979 -2.521929
H 3.177032 -0.881063 -2.864796
H -3.238651 1.012517 -2.739271
H 5.985089 0.622159 2.248133
H -6.032350 -0.771862 2.194405
H 8.000932 0.129230 0.910300
H 7.784474 0.544646 -0.827303
H 7.723226 -1.142698 -0.333335
H -7.748896 1.060237 -0.355145
H -8.031796 -0.265870 0.827381
H -7.763866 -0.610782 -0.917211
H 1.994614 0.817793 2.429952
H -0.164382 -0.165753 2.003677


