%chk=000113326.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113326

0 1
 O   0.7797000      -2.600100      0.6779000    
 O   -3.051600      0.2224000      0.3037000    
 O    2.876600      0.9503000      -1.726900    
 C  -0.4662000      -2.363300      0.1840000    
 C   -2.394000     -0.9550000     -1.0800000E-02
 C   -1.128600      -1.177600      0.5014000    
 C    1.700100      -1.566700      0.6253000    
 C   -1.080500      -3.306200     -0.6402000    
 C   -3.019500      -1.877600     -0.8296000    
 C    1.818000     -0.8280000     -0.5380000    
 C   -2.357000      -3.063400      -1.147000    
 C    2.745500      0.2125000     -0.5909000    
 C   -2.342100       1.381700      0.2328000    
 C    2.477800      -1.300700       1.737600    
 C    3.539200      0.4963000      0.5205000    
 C    3.405300     -0.2603000       1.684700    
 C   -1.515900       1.627800     -0.8638000    
 C   -2.441000       2.323600       1.256800    
 C  -0.7889000       2.816000     -0.9365000    
 C   -1.713900       3.511700       1.184000    
 C  -0.8878000       3.758100      8.7399997E-02
 C    3.844800       1.998400      -1.712500    
 H  -0.6734000     -0.4632000       1.182100    
 H  -0.5691000      -4.231400     -0.8915000    
 H   -4.013000      -1.689600      -1.225300    
 H    1.224800      -1.048200      -1.421400    
 H   -2.835000      -3.797300      -1.789100    
 H    2.374300      -1.888600       2.644600    
 H    4.278400       1.289500      0.5482000    
 H    4.022700     -3.9900001E-02   2.550800    
 H   -1.435800      0.9225000      -1.686700    
 H   -3.082500       2.137200       2.113700    
 H  -0.1480000       3.009300      -1.791800    
 H   -1.790800       4.245100       1.981400    
 H  -0.3219000       4.683300      3.0600000E-02
 H    4.859100       1.607700      -1.578600    
 H    3.594400       2.766600     -0.9729000    
 H    3.814600       2.479500      -2.695600    


%chk=000113326-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000113326

0 1
O 0.842705 -2.626623 0.611806
O -3.138270 0.276253 0.105254
O 2.987317 1.154128 -1.547176
C -0.471767 -2.353286 0.157144
C -2.418952 -0.927976 -0.087009
C -1.081242 -1.091278 0.337089
C 1.862187 -1.643074 0.550910
C -1.177313 -3.443807 -0.396053
C -3.151509 -1.999761 -0.644934
C 1.929291 -0.678401 -0.472868
C -2.522237 -3.255611 -0.784115
C 3.021483 0.222221 -0.496134
C -2.487494 1.538383 0.102684
C 2.872767 -1.744458 1.535772
C 4.045572 0.147857 0.480887
C 3.956567 -0.846523 1.484180
C -1.396031 1.843180 -0.744145
C -3.060847 2.524397 0.935276
C -0.865184 3.152127 -0.733548
C -2.525538 3.830858 0.927914
C -1.423228 4.149717 0.099674
C 4.110468 2.088260 -1.659317
H -0.536115 -0.269404 0.808240
H -0.671333 -4.406172 -0.509246
H -4.187698 -1.834877 -0.951928
H 1.170789 -0.613763 -1.257090
H -3.081901 -4.093915 -1.212049
H 2.792037 -2.512250 2.309446
H 4.893103 0.838175 0.471271
H 4.745545 -0.912899 2.241234
H -0.972673 1.080874 -1.404906
H -3.911038 2.254667 1.568894
H -0.014801 3.385700 -1.383633
H -2.968149 4.597686 1.573184
H -1.007262 5.162759 0.101466
H 5.067416 1.550926 -1.806329
H 4.183896 2.739536 -0.766595
H 3.888238 2.698773 -2.546849


