%chk=000089480.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089480

0 1
 O    2.093200       1.676600     -0.7303000    
 O   0.8074000       1.303100       1.152200    
 C    2.129200     -0.4824000      0.1955000    
 C    1.750100      -1.075400      -1.170600    
 C    1.563900      -1.348800       1.339200    
 C   0.2382000      -1.279400      -1.331400    
 C  -0.4372000      -1.832900     -0.1038000    
 C   0.1764000      -1.870000       1.090900    
 C    3.655000     -0.3791000      0.3245000    
 C    1.584900      0.9241000      0.2868000    
 C   -1.838500      -2.335100     -0.2908000    
 C   -2.777600      -1.220300     -0.7410000    
 C   -2.907400     -0.1663000      0.3228000    
 C   -2.664000       1.153100      0.2091000    
 C    1.657300       3.039200     -0.7644000    
 C   -2.813900       2.157300       1.316400    
 C   -2.216900       1.736300      -1.104900    
 H    2.241100      -2.053000      -1.279000    
 H    2.118500     -0.4642000      -2.004000    
 H    1.568000     -0.7927000       2.285100    
 H    2.208000      -2.223600       1.498000    
 H   7.5099997E-02  -1.955900      -2.179300    
 H  -0.2153000     -0.3213000      -1.600500    
 H  -0.3392000      -2.292300       1.949500    
 H    4.118100      -1.372500      0.3244000    
 H    4.104200      0.1853000     -0.5006000    
 H    3.939600      0.1222000       1.257100    
 H   -1.834700      -3.131900      -1.045100    
 H   -2.220200      -2.794500      0.6304000    
 H   -2.466200     -0.8323000      -1.713100    
 H   -3.773700      -1.652300     -0.9008000    
 H   -3.248300     -0.5306000       1.291300    
 H    1.595600       3.472500      0.2387000    
 H   0.6940000       3.106500      -1.274000    
 H    2.392200       3.611300      -1.337500    
 H   -1.866200       2.676800       1.490300    
 H   -3.110000       1.679300       2.256100    
 H   -3.578900       2.897700       1.061800    
 H   -2.591200       2.761200      -1.210400    
 H   -1.127400       1.774400      -1.149100    
 H   -2.593400       1.197400      -1.977100    


%chk=000089480-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089480

0 1
O 1.790645 1.564730 -0.621990
O 1.441831 1.266621 1.652035
C 2.286505 -0.643433 0.286262
C 1.878079 -1.169229 -1.117855
C 1.707799 -1.588623 1.374645
C 0.346513 -1.243614 -1.297054
C -0.359155 -1.865705 -0.099283
C 0.279451 -2.020357 1.093192
C 3.838808 -0.573796 0.402548
C 1.772802 0.786141 0.544269
C -1.805990 -2.292135 -0.295949
C -2.748245 -1.141627 -0.772996
C -2.790117 0.017660 0.202975
C -2.776907 1.354073 -0.070311
C 1.384599 2.978956 -0.447249
C -2.810649 2.378797 1.053183
C -2.731481 1.948336 -1.468066
H 2.310662 -2.184903 -1.220572
H 2.322808 -0.534637 -1.904583
H 1.753466 -1.079168 2.356148
H 2.364550 -2.480972 1.453367
H 0.107971 -1.826426 -2.210893
H -0.055573 -0.225027 -1.475496
H -0.262376 -2.479320 1.933016
H 4.269024 -1.571106 0.196189
H 4.260982 0.141841 -0.325568
H 4.147823 -0.267002 1.418366
H -1.857262 -3.105354 -1.051727
H -2.200931 -2.709559 0.651214
H -2.440461 -0.804397 -1.780111
H -3.765778 -1.572273 -0.891161
H -2.825531 -0.281164 1.262996
H 2.066994 3.490640 0.252512
H 0.356882 3.032906 -0.049397
H 1.446695 3.416460 -1.453922
H -1.906774 3.021558 1.033866
H -2.856667 1.897428 2.045058
H -3.683268 3.055492 0.954480
H -3.636051 2.559606 -1.660772
H -1.863764 2.630305 -1.577623
H -2.668109 1.185776 -2.261343


