%chk=000162690.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162690

0 1
 O   -1.976400     -0.4991000     -0.1193000    
 O  -0.4948000      -2.951100     -0.3556000    
 O   -3.461000      0.5327000       1.947300    
 O   -5.779600     -0.9072000       1.317100    
 C    1.670100      0.8105000     -0.2846000    
 C    2.261400     -0.4730000      0.4008000    
 C   0.1040000      0.7780000     -0.1065000    
 C  -0.6112000     -0.5129000     -0.5965000    
 C    3.835000     -0.5580000      0.4101000    
 C    1.570400      -1.769100     -6.6100001E-02
 C    2.235000       2.066800      0.4598000    
 C   5.0200000E-02  -1.718800      0.1186000    
 C  -0.6568000       2.021400     -0.5970000    
 C    4.475200      0.8538000      0.4643000    
 C    3.583900       1.870900       1.158000    
 C    2.058500      0.9300000      -1.774500    
 C   -2.802600      0.6510000     -0.3558000    
 C   -2.080700       1.974100     -4.8500001E-02
 C  -0.6270000     -0.7613000      -2.117100    
 C    4.276200      -1.334100       1.679000    
 C    4.427300      -1.315300     -0.7962000    
 C   -3.978900      0.4930000      0.6248000    
 C   -3.393600      0.6501000      -1.772500    
 C   -4.684600     -0.8322000      0.4105000    
 H    1.969400     -0.3762000       1.459900    
 H  -4.8000000E-02  0.7862000      0.9871000    
 H    1.813700      -1.995100      -1.109500    
 H    1.950000      -2.627100      0.5023000    
 H    1.533600       2.406000       1.233100    
 H    2.318000       2.906300     -0.2432000    
 H  -0.1768000      -1.679300       1.192100    
 H  -0.6760000       2.085900      -1.688300    
 H  -0.1832000       2.943000     -0.2433000    
 H    4.708300       1.217900     -0.5425000    
 H    5.442700      0.8141000      0.9812000    
 H    4.099700       2.836300       1.221200    
 H    3.410400       1.553500       2.193800    
 H    1.958600     -1.1200000E-02  -2.314300    
 H    1.451400       1.678900      -2.292000    
 H    3.094300       1.250400      -1.909200    
 H   -1.988400       2.137500       1.031100    
 H   -2.657100       2.825200     -0.4316000    
 H   0.2807000      -1.243600      -2.484200    
 H   -1.459600      -1.418100      -2.394700    
 H  -0.7455000      0.1587000      -2.691800    
 H    5.368200      -1.415900       1.733900    
 H    3.874800      -2.352600       1.690400    
 H    3.939100     -0.8325000       2.592700    
 H    5.523400      -1.296000     -0.7667000    
 H    4.123300     -0.8752000      -1.749100    
 H    4.129200      -2.369200     -0.8029000    
 H   -4.700000       1.315100      0.5292000    
 H   -1.458600      -2.906600     -0.2331000    
 H   -2.691800       1.067100      -2.500200    
 H   -3.631700     -0.3596000      -2.121500    
 H   -4.294800       1.270300      -1.836600    
 H   -5.096500     -0.9380000     -0.5955000    
 H   -4.034300      -1.685100      0.6299000    
 H   -3.553600       1.442500       2.277400    
 H   -6.215200      -1.764000       1.169000    


%chk=000162690-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162690

0 1
O -1.979433 -0.505534 -0.229373
O -0.499638 -2.979554 -0.406543
O -3.436476 0.750347 1.963941
O -5.613137 -0.804365 1.719437
C 1.705645 0.834649 -0.342347
C 2.259868 -0.456404 0.376963
C 0.134067 0.798082 -0.205120
C -0.555776 -0.499079 -0.722911
C 3.837065 -0.574246 0.451119
C 1.580283 -1.754971 -0.128205
C 2.226421 2.096531 0.448494
C 0.058871 -1.695841 0.045391
C -0.632915 2.033164 -0.731016
C 4.472261 0.854051 0.544394
C 3.536624 1.855259 1.250529
C 2.152854 0.959346 -1.826577
C -2.834595 0.698459 -0.428357
C -2.064248 2.018828 -0.144147
C -0.550004 -0.752014 -2.250133
C 4.196268 -1.355776 1.749542
C 4.463361 -1.331720 -0.751472
C -3.975982 0.539611 0.618886
C -3.447005 0.706408 -1.854406
C -4.670832 -0.831215 0.574398
H 1.930294 -0.336011 1.434967
H -0.052799 0.778116 0.892558
H 1.818190 -1.950980 -1.189790
H 1.950416 -2.628919 0.438825
H 1.446387 2.443836 1.154606
H 2.384994 2.925223 -0.269199
H -0.195500 -1.539423 1.117142
H -0.656426 2.054768 -1.837863
H -0.129680 2.964545 -0.413084
H 4.716621 1.231981 -0.467629
H 5.436563 0.781943 1.086045
H 4.054659 2.821192 1.407467
H 3.294082 1.470320 2.261159
H 2.005958 0.030115 -2.400347
H 1.581217 1.759913 -2.332224
H 3.218528 1.232332 -1.902027
H -2.004025 2.151216 0.950150
H -2.658819 2.860566 -0.550974
H 0.343770 -1.317707 -2.558370
H -1.424462 -1.366951 -2.517901
H -0.584796 0.180572 -2.836338
H 5.284530 -1.550033 1.797805
H 3.678441 -2.331876 1.794451
H 3.913640 -0.782609 2.653188
H 5.567170 -1.314726 -0.665743
H 4.196318 -0.873215 -1.719453
H 4.150121 -2.391171 -0.776616
H -4.735954 1.324607 0.402625
H -1.486526 -2.885440 -0.361102
H -2.706432 1.025539 -2.605960
H -3.806803 -0.297998 -2.138094
H -4.298556 1.410901 -1.904183
H -5.223185 -0.971195 -0.374432
H -3.915654 -1.628632 0.702885
H -4.119045 0.378412 2.585700
H -5.959085 -1.713427 1.893469


