%chk=000018826.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018826

0 1
 O    1.513200       1.919700      9.8600000E-02
 O   -2.949600     -0.2486000     -0.5064000    
 O   -2.592200     -0.7326000       1.725800    
 C    2.752300      -2.516800      0.2327000    
 C    3.085000      -1.052900      0.5416000    
 C    1.474700      -2.747200     -0.5809000    
 C    3.257200     -0.2021000     -0.7179000    
 C   0.1980000      -2.319700      0.1485000    
 C    3.760000       1.217200     -0.4373000    
 C   -1.038700      -2.579600     -0.7182000    
 C    2.875800       2.043100      0.4933000    
 C   -1.170400       2.170700     -0.8753000    
 C   -2.343100      -2.452900      5.9700001E-02
 C  -0.7840000       2.489900      0.5718000    
 C   -2.685200       2.093500      -1.095300    
 C   0.6813000       2.888800      0.7265000    
 C   -3.409200       1.082300     -0.2118000    
 C   -2.625200      -1.052900      0.5447000    
 H    2.678800      -3.066400       1.179200    
 H    3.593700      -2.959300     -0.3153000    
 H    2.308200     -0.6281000       1.186000    
 H    4.016400      -1.028600       1.121000    
 H    1.408600      -3.819900     -0.8042000    
 H    1.542400      -2.240400      -1.549800    
 H    3.971600     -0.6915000      -1.391600    
 H    2.308200     -0.1403000      -1.262400    
 H   0.2407000      -1.254800      0.4016000    
 H   0.1188000      -2.876900       1.089700    
 H    4.778300       1.183400     -3.2900002E-02
 H    3.821400       1.735400      -1.402900    
 H  -0.9876000      -3.595400      -1.128900    
 H   -1.035000      -1.890100      -1.571100    
 H    2.978800       1.695100       1.527200    
 H    3.190900       3.092500      0.4508000    
 H  -0.7078000       1.224300      -1.180800    
 H  -0.7700000       2.946100      -1.539900    
 H   -1.413400       3.294600      0.9689000    
 H  -0.9634000       1.599400       1.185300    
 H   -2.335800      -3.121600      0.9287000    
 H   -3.188600      -2.770500     -0.5623000    
 H   -3.123500       3.085100     -0.9315000    
 H   -2.857200       1.834800      -2.147400    
 H   0.8597000       3.862900      0.2573000    
 H   0.9218000       2.965500       1.793400    
 H   -3.302000       1.339800      0.8468000    
 H   -4.479400       1.106800     -0.4447000    


%chk=000018826-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018826

0 1
O 1.475444 1.898712 0.162906
O -3.135657 -0.260056 -0.531085
O -2.339419 -0.503453 1.655950
C 2.838438 -2.585938 0.172199
C 3.163777 -1.109953 0.517697
C 1.519163 -2.802357 -0.612241
C 3.257194 -0.198492 -0.725926
C 0.244944 -2.352433 0.140845
C 3.750932 1.237901 -0.433453
C -1.035308 -2.654863 -0.670231
C 2.882941 2.009397 0.573073
C -1.189606 2.179052 -0.879499
C -2.360944 -2.438898 0.115795
C -0.845440 2.525703 0.588719
C -2.707263 2.114503 -1.170614
C 0.623245 2.923311 0.783474
C -3.513593 1.164494 -0.274295
C -2.589666 -0.996610 0.530078
H 2.796878 -3.175716 1.111488
H 3.676280 -3.004341 -0.423935
H 2.395208 -0.711152 1.207335
H 4.127271 -1.080596 1.068844
H 1.426163 -3.882430 -0.852191
H 1.572472 -2.276595 -1.586942
H 3.939193 -0.663601 -1.468003
H 2.263103 -0.125370 -1.203251
H 0.298143 -1.270114 0.368383
H 0.195014 -2.874843 1.118796
H 4.787348 1.210978 -0.036859
H 3.780503 1.807368 -1.382866
H -1.015762 -3.714957 -0.994969
H -1.053620 -2.041693 -1.592448
H 2.994553 1.602369 1.602255
H 3.193064 3.078292 0.594476
H -0.709420 1.218805 -1.140711
H -0.739938 2.938255 -1.550689
H -1.471087 3.376135 0.934327
H -1.077893 1.665213 1.242716
H -2.344678 -3.047252 1.037182
H -3.210081 -2.761489 -0.512445
H -3.152417 3.123653 -1.037632
H -2.871359 1.833105 -2.228991
H 0.837591 3.907313 0.305956
H 0.854678 3.009491 1.868863
H -3.367288 1.375640 0.798978
H -4.588599 1.215311 -0.520758


