%chk=000117753.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117753

0 1
 O    2.297000     -0.9766000     -0.9675000    
 O  -0.3879000     -0.2981000     -0.6648000    
 O   -2.116100       1.191200     -0.1738000    
 O    4.005400       1.215900      -1.784400    
 O    4.802400       1.840600      0.7748000    
 O    4.456700     -0.7069000       2.008000    
 O   -2.113000      -2.461600     -6.2700003E-02
 O   -4.914500      -1.794100     -0.4701000    
 O   -5.575100      0.6779000      0.9133000    
 O   -3.756600       2.782800      0.2986000    
 C    1.861300      0.3834000      -1.094200    
 C    3.003800       1.350800     -0.7694000    
 C    3.641400       1.034200      0.5831000    
 C    4.034600     -0.4408000      0.6724000    
 C    2.841300      -1.333700      0.3061000    
 C   0.5981000      0.6407000     -0.2769000    
 C   -2.600800      -1.169700     -0.4235000    
 C   -1.603600     -0.1182000      6.0600001E-02
 C   -3.975100     -0.9583000      0.2076000    
 C   -4.421200      0.4973000      9.3599997E-02
 C   -3.316600       1.449100      0.5499000    
 C    3.238500      -2.805600      0.2194000    
 H    1.602600      0.4885000      -2.155400    
 H    2.660600       2.390700     -0.8047000    
 H    2.951900       1.280000       1.399600    
 H    4.885700     -0.6429000      1.0300000E-02
 H    2.061400      -1.258900       1.073100    
 H   0.2530000       1.662700     -0.4709000    
 H   0.7851000      0.5385000      0.7969000    
 H   -2.674100      -1.148800      -1.518100    
 H   -1.389300     -0.2551000       1.129300    
 H   -3.967400      -1.288400       1.253900    
 H   -4.727300      0.7131000     -0.9371000    
 H   -3.125900       1.373700       1.626600    
 H    3.994900      -2.961000     -0.5579000    
 H    3.632900      -3.172600       1.171500    
 H    2.373100      -3.417800     -5.7399999E-02
 H    4.732000       1.821200      -1.557300    
 H    4.524900       2.770600      0.7133000    
 H    5.198200     -0.1089000       2.204100    
 H   -2.770700      -3.113700     -0.3595000    
 H   -5.786800      -1.632500     -7.1599998E-02
 H   -5.318400      0.5090000       1.836000    
 H   -4.248800       2.793900     -0.5391000    


%chk=000117753-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117753

0 1
O 2.301679 -0.941459 -0.979211
O -0.500165 -0.224780 -0.473065
O -2.293620 1.240466 -0.117109
O 3.750381 1.609189 -1.761366
O 5.030239 1.785539 0.691572
O 4.962805 -0.933581 1.636178
O -2.142851 -2.454002 0.490639
O -4.903369 -2.057139 -0.206063
O -5.932079 0.551367 0.471354
O -4.033293 2.811464 0.020571
C 1.797025 0.434288 -0.899400
C 2.920699 1.451118 -0.568468
C 3.786812 0.967935 0.616939
C 4.257949 -0.479501 0.433342
C 3.045441 -1.409795 0.211542
C 0.606152 0.589250 0.062662
C -2.651295 -1.241594 -0.145847
C -1.707124 -0.096794 0.256518
C -4.086594 -0.968451 0.338466
C -4.590576 0.406834 -0.100172
C -3.628820 1.488863 0.433067
C 3.446135 -2.854368 -0.073814
H 1.445447 0.642764 -1.924669
H 2.459435 2.431224 -0.302953
H 3.227869 1.047375 1.572080
H 4.914746 -0.528155 -0.460391
H 2.398224 -1.371611 1.115701
H 0.294239 1.651762 0.103088
H 0.845852 0.241709 1.090009
H -2.651547 -1.330900 -1.251610
H -1.541608 -0.098387 1.359411
H -4.105350 -1.003425 1.451045
H -4.617103 0.473569 -1.210019
H -3.634245 1.513549 1.541531
H 4.036944 -2.907455 -1.005277
H 4.052473 -3.248050 0.758778
H 2.545166 -3.478201 -0.197661
H 4.631487 1.952051 -1.448603
H 4.846074 2.637707 1.161533
H 5.708631 -0.298269 1.791832
H -2.783227 -3.182420 0.281404
H -5.846041 -1.886152 0.048939
H -6.247063 1.476268 0.302314
H -3.768330 2.931799 -0.929116


