%chk=000102184.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102184

0 1
 O   -3.541100      0.5831000      -1.464000    
 O   -5.170000     -0.8811000       1.075000    
 O    6.762900     -7.5199999E-02 -0.2911000    
 C   -1.942200     -0.4585000      0.2014000    
 C   -3.356700     -0.1475000     -0.2457000    
 C   -3.483500       1.346100     -0.2517000    
 C   -1.165300      0.8137000     -0.2381000    
 C   -2.139300       1.961700      7.2099999E-02
 C   0.2688000      0.8338000      0.2836000    
 C    1.017600     -0.4166000     -0.2720000    
 C   -1.274900      -1.646400     -0.4889000    
 C   0.2163000      -1.742700     -0.1070000    
 C    2.502000     -0.4822000      0.2676000    
 C   -1.988000     -0.6735000       1.734600    
 C   -4.734300       2.047600      9.9600002E-02
 C   -4.500000      -1.021600      5.3100001E-02
 C   0.9926000       2.116700     -0.1468000    
 C    3.170000      0.8988000      0.1911000    
 C    3.299700      -1.485700     -0.6173000    
 C    2.479400       2.035500     -7.7000000E-03
 C    2.544900     -0.9522000       1.741600    
 C   -4.812200      -2.095200     -0.9540000    
 C    4.672900      0.9467000      0.3422000    
 C    4.811300      -1.455900     -0.3962000    
 C    5.369000     -4.9199998E-02 -0.5814000    
 H   -1.084900      0.7980000      -1.339200    
 H   -2.090100       2.256900       1.125400    
 H   -1.940900       2.838700     -0.5515000    
 H   0.2625000      0.8088000       1.378600    
 H    1.084200     -0.2615000      -1.361700    
 H   -1.360300      -1.550100      -1.579100    
 H   -1.779900      -2.584000     -0.2266000    
 H   0.2767000      -2.098300      0.9255000    
 H   0.6723000      -2.525600     -0.7239000    
 H  -0.9974000     -0.7754000       2.184600    
 H   -2.491700      0.1530000       2.248100    
 H   -2.541500      -1.587400       1.981000    
 H   -4.713800       3.073800     -0.2815000    
 H   -5.621100       1.561600     -0.3205000    
 H   -4.855200       2.095100       1.186600    
 H   0.6258000       2.954200      0.4587000    
 H   0.7646000       2.358600      -1.192400    
 H    3.111300      -1.270000      -1.678000    
 H    2.948300      -2.509900     -0.4440000    
 H    3.011800       2.981400     -7.4100003E-02
 H    3.554300     -0.9059000       2.164000    
 H    1.906500     -0.3369000       2.383800    
 H    2.221600      -1.993000       1.844500    
 H   -4.015200      -2.182700      -1.696600    
 H   -4.910500      -3.053800     -0.4380000    
 H   -5.746600      -1.847100      -1.463700    
 H    5.069100       1.950300      0.1396000    
 H    4.945600      0.7425000       1.385300    
 H    5.063900      -1.836100      0.6014000    
 H    5.299500      -2.141700      -1.099800    
 H    5.250300      0.2686000      -1.624500    
 H    7.179600     -0.7023000     -0.9065000    


%chk=000102184-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102184

0 1
O -3.436039 0.411161 -1.541664
O -4.561885 -1.979824 1.077931
O 6.883271 0.106884 -0.274607
C -1.894803 -0.599530 0.281778
C -3.345269 -0.320741 -0.205231
C -3.523611 1.195364 -0.241561
C -1.161532 0.699991 -0.192589
C -2.168377 1.841208 0.096524
C 0.292289 0.795220 0.299232
C 1.077924 -0.454169 -0.221196
C -1.167902 -1.797877 -0.368223
C 0.332451 -1.799278 0.040255
C 2.569214 -0.473070 0.293433
C -1.937954 -0.730597 1.831555
C -4.807644 1.948979 0.010490
C -4.472107 -1.309933 0.009624
C 0.966806 2.085398 -0.222270
C 3.205774 0.924299 0.138082
C 3.384056 -1.481948 -0.589609
C 2.474684 2.045449 -0.107046
C 2.654923 -0.899798 1.792732
C -5.448374 -1.514039 -1.137615
C 4.721297 1.008886 0.285108
C 4.910841 -1.431512 -0.354365
C 5.449377 -0.011384 -0.606268
H -1.110815 0.625526 -1.298800
H -2.162237 2.156285 1.157996
H -1.992263 2.737578 -0.525742
H 0.322862 0.814394 1.407543
H 1.134451 -0.324864 -1.327289
H -1.259176 -1.719304 -1.470576
H -1.628878 -2.757628 -0.062506
H 0.401593 -2.063706 1.111422
H 0.843150 -2.612046 -0.510519
H -0.922190 -0.757737 2.259844
H -2.474575 0.116499 2.296416
H -2.469603 -1.649690 2.123827
H -4.823473 2.883773 -0.579341
H -5.696965 1.357971 -0.262458
H -4.888573 2.221603 1.078798
H 0.576113 2.966511 0.326540
H 0.680865 2.245291 -1.286355
H 3.178233 -1.256479 -1.657056
H 3.022563 -2.510661 -0.403563
H 3.004374 3.002145 -0.230109
H 3.660919 -0.715625 2.206773
H 1.939127 -0.325517 2.407833
H 2.438600 -1.975890 1.922757
H -4.902738 -1.872837 -2.030643
H -6.215403 -2.245645 -0.840326
H -5.916406 -0.562210 -1.444099
H 5.075389 2.027423 0.045867
H 5.034153 0.800010 1.328845
H 5.161370 -1.725231 0.683306
H 5.413593 -2.157331 -1.026597
H 5.286893 0.250425 -1.676807
H 7.390338 -0.552171 -0.813981


