%chk=000108207.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108207

0 1
 O   6.8200000E-02  -2.240600      0.4683000    
 O  -0.1952000       2.435700     -0.8903000    
 O   -5.773300       1.715900       1.040700    
 O   -4.629400       3.078400     -0.3964000    
 C   -2.207100      -1.400100      0.1043000    
 C   -1.212800      -2.565900     -0.1122000    
 C   -1.680000     -0.1063000     -0.5684000    
 C   -3.650800      -1.659800     -0.3553000    
 C  -0.2445000      0.1194000     -0.1324000    
 C   -4.571000     -0.5192000      9.8399997E-02
 C   -2.647100       1.037200     -0.3317000    
 C   0.5235000     -0.9550000      0.3439000    
 C  -0.9949000      -2.956800      -1.582500    
 C   -1.671300      -3.821300      0.6513000    
 C   -3.939700      0.8329000     -3.2200001E-02
 C   0.3880000       1.366500     -0.2755000    
 C    1.854100     -0.7648000      0.7371000    
 C    2.449000      0.4880000      0.6243000    
 C    1.718300       1.551900      0.1088000    
 C   -4.793900       2.009200      0.1606000    
 C    3.869100      0.6821000       1.034000    
 C    4.895300      0.4263000     -8.5299999E-02
 C    6.343500      0.5716000      0.3923000    
 C    7.331000      0.2850000     -0.7396000    
 C    8.770800      0.3896000     -0.2622000    
 H   -2.238300      -1.218600       1.192300    
 H   -1.644700     -0.2451000      -1.658000    
 H   -4.041700      -2.598000      5.0400000E-02
 H   -3.688700      -1.744400      -1.448600    
 H   -4.833900     -0.6880000       1.150600    
 H   -5.500800     -0.5668000     -0.4809000    
 H   -2.318500       2.062100     -0.4352000    
 H  -0.5495000      -2.144200      -2.164400    
 H  -0.2879000      -3.792000      -1.655900    
 H   -1.928400      -3.259700      -2.066200    
 H  -0.8881000      -4.589200      0.6423000    
 H   -1.858400      -3.589300       1.706100    
 H   -2.577000      -4.262000      0.2244000    
 H    2.427500      -1.607400       1.118200    
 H    2.197100       2.521100     -1.3400000E-02
 H    4.002600       1.701700       1.419500    
 H    4.091300      2.4300000E-02   1.884900    
 H    4.710900       1.122500     -0.9134000    
 H    4.746900     -0.5839000     -0.4879000    
 H   0.4150000       3.192500     -0.8971000    
 H    6.503600       1.586500      0.7757000    
 H    6.524500     -0.1210000       1.223100    
 H   -6.369000       2.479400       1.197600    
 H    7.170600      0.9923000      -1.561400    
 H    7.158700     -0.7214000      -1.138900    
 H    8.972400     -0.3302000      0.5375000    
 H    9.459600      0.1826000      -1.087200    
 H    8.986200       1.393900      0.1166000    


%chk=000108207-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000108207

0 1
O 0.064021 -2.145266 0.558437
O -0.381838 2.429967 -1.113542
O -6.188090 1.550239 0.828946
O -4.542758 3.156496 0.514195
C -2.225619 -1.412305 0.072788
C -1.202647 -2.551750 -0.160855
C -1.743736 -0.078200 -0.563635
C -3.670505 -1.693117 -0.395879
C -0.280207 0.195192 -0.207982
C -4.634079 -0.617409 0.164887
C -2.718907 1.025137 -0.182445
C 0.526185 -0.833394 0.357832
C -0.855121 -2.800789 -1.643006
C -1.595945 -3.854942 0.549173
C -4.024198 0.776423 0.137639
C 0.367695 1.435837 -0.443921
C 1.861126 -0.602672 0.764069
C 2.458979 0.661336 0.576603
C 1.701451 1.681000 -0.050309
C -4.873747 1.944399 0.491138
C 3.906853 0.901278 0.978849
C 4.924574 0.338293 -0.052274
C 6.392393 0.565986 0.371352
C 7.413085 -0.004679 -0.639852
C 8.878305 0.225377 -0.210237
H -2.249360 -1.262818 1.173374
H -1.810873 -0.178192 -1.672770
H -4.011339 -2.690008 -0.062178
H -3.708357 -1.689416 -1.503610
H -4.914443 -0.862959 1.208665
H -5.584784 -0.618208 -0.399217
H -2.359752 2.058540 -0.194646
H -0.383565 -1.916567 -2.105116
H -0.148001 -3.643991 -1.726447
H -1.764103 -3.052194 -2.219317
H -0.722028 -4.527715 0.588613
H -1.924876 -3.656347 1.584257
H -2.407184 -4.373397 0.009491
H 2.416871 -1.431442 1.214279
H 2.156233 2.663724 -0.234970
H 4.089802 1.986627 1.104235
H 4.106312 0.429023 1.961273
H 4.741666 0.810006 -1.038953
H 4.739927 -0.746421 -0.187305
H 0.150837 3.257553 -1.210090
H 6.575279 1.653569 0.501256
H 6.564543 0.102102 1.365530
H -6.706089 2.367796 1.060609
H 7.239558 0.457676 -1.633024
H 7.229938 -1.091121 -0.767309
H 9.084380 -0.253311 0.765839
H 9.587794 -0.192524 -0.947995
H 9.096145 1.305177 -0.105739


