%chk=000066393.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066393

0 1
 O   -5.194900       1.289000     -0.1651000    
 O    4.417300       2.153700     -0.3930000    
 O    5.439200     -0.3142000     -0.6821000    
 C   -2.821100      0.6350000     -4.4399999E-02
 C   -2.196700     -0.7596000      0.1522000    
 C  -0.6972000     -0.7934000     -0.1568000    
 C   4.4300001E-02  0.2324000      0.7572000    
 C   -4.288600      0.3004000      0.2846000    
 C   -2.145900       1.599700      0.9387000    
 C   -3.136700      -1.680800     -0.6222000    
 C  -0.6227000       1.634400      0.7284000    
 C   -4.527400      -1.053700     -0.4123000    
 C  -0.1189000      -2.219000     -1.4600000E-02
 C   -2.708700       1.196800      -1.484900    
 C    1.537300      0.2116000      0.4178000    
 C    1.229500      -2.275800      0.7051000    
 C    2.132400      -1.126100      0.3458000    
 C    2.274100       1.308900      0.1751000    
 C    3.408000      -1.336200     -1.2200000E-02
 C    3.698900       1.187100     -0.1909000    
 C    4.277900     -0.1903000     -0.3264000    
 H   -2.301800      -1.039100       1.214300    
 H  -0.5413000     -0.4969000      -1.202800    
 H  -5.1500000E-02 -0.1142000       1.798100    
 H   -4.424600      0.1848000       1.367300    
 H   -2.349600       1.290600       1.972000    
 H   -2.556500       2.611000      0.8320000    
 H   -3.106900      -2.710000     -0.2508000    
 H   -2.885200      -1.706200      -1.688300    
 H  -0.4070000       2.136200     -0.2222000    
 H  -0.1834000       2.262500       1.514100    
 H   -5.051800     -0.9402000      -1.367700    
 H   -5.152300      -1.694800      0.2196000    
 H  -1.2700000E-02  -2.650900      -1.018600    
 H  -0.8127000      -2.877800      0.5214000    
 H   -1.674300       1.281200      -1.827700    
 H   -3.234300      0.5767000      -2.218100    
 H   -3.146200       2.200500      -1.541800    
 H    1.703400      -3.242300      0.4927000    
 H    1.058900      -2.258100       1.790000    
 H   -6.093900      0.9591000      3.7000000E-03
 H    1.876500       2.315100      0.2224000    
 H    3.841100      -2.328200     -6.8700001E-02


%chk=000066393-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066393

0 1
O -5.200370 1.392888 -0.092371
O 4.392230 2.269008 -0.475092
O 5.573051 -0.322293 -0.575887
C -2.833055 0.641224 -0.039251
C -2.202105 -0.777846 0.119152
C -0.694751 -0.822023 -0.199578
C 0.039685 0.213462 0.735187
C -4.307235 0.297038 0.303836
C -2.132232 1.600886 0.950100
C -3.171322 -1.711627 -0.657906
C -0.600305 1.624213 0.708867
C -4.579254 -1.053824 -0.439773
C -0.103127 -2.263070 -0.036703
C -2.761519 1.194766 -1.486971
C 1.526367 0.193353 0.406762
C 1.246660 -2.308402 0.738868
C 2.154201 -1.156106 0.372914
C 2.273473 1.315020 0.125832
C 3.479671 -1.323300 0.046655
C 3.702369 1.237500 -0.221317
C 4.351408 -0.181844 -0.272878
H -2.296003 -1.041482 1.199748
H -0.535235 -0.492868 -1.246048
H -0.076152 -0.181592 1.772134
H -4.386113 0.138181 1.404005
H -2.336762 1.264919 1.989042
H -2.540981 2.624446 0.855987
H -3.134464 -2.751206 -0.287073
H -2.909203 -1.740324 -1.732230
H -0.389950 2.106938 -0.265057
H -0.118733 2.257098 1.479853
H -5.068932 -0.834232 -1.406383
H -5.256926 -1.709861 0.136523
H 0.039942 -2.713199 -1.035884
H -0.827775 -2.906523 0.497605
H -1.726136 1.409300 -1.800831
H -3.194096 0.493125 -2.221110
H -3.344323 2.129108 -1.545681
H 1.754650 -3.275196 0.576218
H 1.031807 -2.244896 1.826355
H -6.127795 1.165317 0.167188
H 1.842698 2.320149 0.148391
H 3.940641 -2.317327 0.017702


