%chk=000088711.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088711

0 1
 O    1.085400     -0.5778000      0.1108000    
 O  -1.3100000E-02   1.476100      0.2472000    
 O    4.701900       1.150100       1.006700    
 O    4.621800      -1.486700     -0.1752000    
 O    2.476500       2.799000      1.9000000E-03
 O   0.7825000      -3.179400     -0.7234000    
 O   -5.473300     -0.8274000      0.5128000    
 O   -4.149500     -0.4485000       2.222500    
 N   -4.386200     -0.4220000      0.9906000    
 C    3.657700      0.6994000      0.1424000    
 C    3.486600     -0.8052000      0.3521000    
 C    2.368000       1.453500      0.4660000    
 C    2.222800      -1.310800     -0.3476000    
 C    1.160800      0.8082000     -0.2145000    
 C    1.967400      -2.786100     -5.5500001E-02
 C   -1.206900       1.030500     -0.2504000    
 C   -2.176400      0.5381000      0.6177000    
 C   -1.441600       1.071300      -1.621200    
 C   -3.392800      8.1900001E-02  0.1097000    
 C   -2.658000      0.6152000      -2.129100    
 C   -3.633600      0.1206000      -1.263700    
 H    3.986500      0.9189000     -0.8809000    
 H    3.444700      -1.020800       1.426900    
 H    2.219300       1.503600       1.551200    
 H    2.299500      -1.189400      -1.436800    
 H    1.243700      0.9316000      -1.302300    
 H    1.821600      -2.963200       1.015200    
 H    2.787900      -3.417100     -0.4089000    
 H    5.502000      0.6434000      0.7853000    
 H    4.663000      -1.307200      -1.130000    
 H    2.611000       2.776200     -0.9609000    
 H   6.2399998E-02  -2.607200     -0.4071000    
 H   -1.957900      0.5202000       1.682600    
 H  -0.7015000       1.469500      -2.309000    
 H   -2.846700      0.6492000      -3.198200    
 H   -4.569500     -0.2253000      -1.694900    


%chk=000088711-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088711

0 1
O 1.434179 -1.241306 0.486679
O -0.232962 0.319099 0.658706
O 4.342972 1.730605 -0.040441
O 5.129298 -1.087834 -0.379231
O 1.579121 2.316565 -0.566797
O 1.888581 -4.034522 0.211093
O -6.189144 0.193995 -0.190897
O -5.018052 -0.842353 1.468530
N -5.086718 -0.105576 0.410958
C 3.397761 0.670444 -0.391167
C 3.820528 -0.693357 0.180387
C 2.032996 1.124158 0.150198
C 2.712918 -1.732171 -0.093362
C 0.973581 0.031000 -0.081298
C 2.942206 -3.091638 0.575028
C -1.415365 0.621107 -0.049851
C -2.609624 0.106779 0.493919
C -1.429001 1.456176 -1.194776
C -3.819365 0.431438 -0.151118
C -2.662513 1.744832 -1.821110
C -3.874478 1.236937 -1.310288
H 3.323786 0.578732 -1.501795
H 4.009887 -0.610214 1.264664
H 2.118256 1.312911 1.239209
H 2.581208 -1.876796 -1.192061
H 0.758742 -0.081609 -1.168073
H 3.000151 -2.946293 1.674346
H 3.886191 -3.534984 0.220659
H 5.261094 1.394238 -0.209862
H 5.018700 -1.316886 -1.339583
H 2.278077 3.012686 -0.465632
H 1.022654 -3.632834 0.482576
H -2.597578 -0.525479 1.384236
H -0.495687 1.908381 -1.544600
H -2.676627 2.390875 -2.704709
H -4.839774 1.455294 -1.772538


