%chk=000068911.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068911

0 1
 O  -0.8080000      0.4536000       1.638200    
 O   -1.263500       1.323500      -1.096200    
 O   0.9186000       1.732600     -0.3951000    
 O   -1.308200       1.761600       1.224000    
 O    2.897900      0.6554000      -1.104100    
 C  -0.2516000     -0.2529000      0.4973000    
 C   -1.281600      -1.394800      0.2180000    
 C    1.108700     -0.8231000      0.9869000    
 C  -0.7038000      -2.518300     -0.6827000    
 C  -3.1300001E-02  0.7041000     -0.7019000    
 C    1.634200      -1.941500      7.3500000E-02
 C    2.120200      0.3363000       1.201300    
 C   -2.636100     -0.8929000     -0.3347000    
 C   0.6090000      -3.051300     -0.1023000    
 C   -2.092400       1.583100      4.0800001E-02
 C   -3.125700      0.4541000      0.2057000    
 C    2.210600       1.266100     -1.9400001E-02
 C   -1.675900      -3.689900     -0.8681000    
 C    3.501300     -0.1433000       1.652400    
 C   -2.798000       2.914300     -0.2070000    
 C    2.975500       1.523300      -2.226500    
 H   -1.515300      -1.847300       1.194700    
 H   0.9459000      -1.273300       1.978200    
 H  -0.4962000      -2.103900      -1.678000    
 H   0.3291000      0.1588000      -1.580000    
 H    2.541100      -2.384600      0.4993000    
 H    1.903300      -1.557400     -0.9147000    
 H    1.713800      0.9423000       2.024200    
 H   -3.411200      -1.640200     -0.1226000    
 H   -2.580900     -0.8251000      -1.429500    
 H    1.027300      -3.818200     -0.7658000    
 H   0.4248000      -3.537000      0.8647000    
 H   -4.037000      0.6982000     -0.3555000    
 H   -3.423500      0.3538000       1.256500    
 H    2.786600       2.151200      0.2792000    
 H   -1.992600      -4.099100      9.7199999E-02
 H   -2.569400      -3.386100      -1.421700    
 H   -1.206000      -4.498000      -1.439400    
 H    4.031900     -0.6862000      0.8644000    
 H    4.125200      0.7105000       1.938400    
 H    3.417800     -0.7999000       2.524600    
 H   -2.063700       3.721900     -0.3117000    
 H   -3.384300       2.892200      -1.131900    
 H   -3.453300       3.179200      0.6296000    
 H    3.600200       1.041100      -2.983700    
 H    3.441600       2.475000      -1.952700    
 H    1.988800       1.696600      -2.665300    


%chk=000068911-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068911

0 1
O -0.785258 0.465841 1.682789
O -1.325547 1.375253 -1.081268
O 0.893851 1.758653 -0.486934
O -1.393346 1.823201 1.284480
O 2.913066 0.599497 -1.137491
C -0.260826 -0.279103 0.469405
C -1.296426 -1.422278 0.201070
C 1.122433 -0.818788 0.948188
C -0.723204 -2.566497 -0.694763
C -0.101743 0.693772 -0.731905
C 1.651009 -1.948761 0.026604
C 2.111178 0.362709 1.173545
C -2.653328 -0.903833 -0.350016
C 0.618975 -3.080336 -0.124672
C -2.222119 1.615929 0.093525
C -3.182361 0.409587 0.267482
C 2.210571 1.285816 -0.054497
C -1.726265 -3.733410 -0.849784
C 3.504070 -0.084129 1.661176
C -2.897870 2.962368 -0.142164
C 3.242824 1.495149 -2.257007
H -1.477621 -1.857226 1.208639
H 0.932529 -1.271413 1.946172
H -0.526539 -2.146592 -1.706513
H 0.203578 0.127468 -1.632319
H 2.584170 -2.351415 0.462364
H 1.925374 -1.534932 -0.960229
H 1.646847 0.997069 1.954080
H -3.416242 -1.686282 -0.181855
H -2.570264 -0.765148 -1.444869
H 1.021426 -3.869444 -0.789872
H 0.432984 -3.557699 0.861313
H -4.143935 0.659473 -0.219483
H -3.379063 0.290558 1.348666
H 2.741864 2.227611 0.195599
H -2.033223 -4.119864 0.141795
H -2.637638 -3.436102 -1.396702
H -1.261125 -4.568585 -1.406130
H 4.063986 -0.600951 0.864406
H 4.103390 0.789395 1.979263
H 3.413667 -0.762188 2.530263
H -2.152747 3.771972 -0.083300
H -3.339092 2.963282 -1.153138
H -3.692430 3.135594 0.602790
H 3.747418 0.868223 -3.008482
H 3.927061 2.303160 -1.925272
H 2.329841 1.947895 -2.686347


