%chk=000094867.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094867

0 1
 O    3.466400      0.3023000      0.7371000    
 O    2.947100       1.684600      -1.645500    
 N  -0.2311000      4.9000001E-03  0.7001000    
 C  -0.6101000       1.323300       1.193900    
 C   -1.117200      -1.024500       1.246400    
 C    1.161700     -0.2919000       1.039700    
 C   -2.044200       1.652100      0.7828000    
 C  -0.7143000      -2.402800      0.7249000    
 C    2.135600      0.6897000      0.3836000    
 C   -2.192000       1.672100     -0.7391000    
 C  -0.8188000      -2.469100     -0.7992000    
 C    2.027100      0.7224000      -1.139400    
 C   -3.624700       1.963700      -1.156200    
 C  -0.3856000      -3.826700      -1.329100    
 H   1.8800000E-02   2.114900      0.7755000    
 H  -0.5226000       1.383600       2.286500    
 H   -1.094100      -1.032100       2.343700    
 H   -2.157300     -0.8805000      0.9402000    
 H    1.484100      -1.274400      0.6836000    
 H    1.317400     -0.3000000       2.127200    
 H   -2.787900       1.001800       1.253200    
 H   -2.275200       2.657200       1.161300    
 H   0.2592000      -2.745000       1.087500    
 H   -1.426200      -3.129100       1.141600    
 H    2.029500       1.704300      0.7796000    
 H   -1.530100       2.433600      -1.168200    
 H   -1.903500      0.7102000      -1.176600    
 H   -1.851600      -2.273900      -1.111400    
 H  -0.1899000      -1.707700      -1.272800    
 H    2.293800     -0.2487000      -1.569500    
 H    1.025100       1.005200      -1.473500    
 H   -3.706000       1.981500      -2.247600    
 H   -4.307200       1.196100     -0.7773000    
 H   -3.954100       2.935600     -0.7752000    
 H  -0.4765000      -3.855000      -2.419500    
 H   0.6577000      -4.033900      -1.069900    
 H   -1.008500      -4.626200     -0.9155000    
 H    3.530800      0.3237000       1.707300    
 H    2.861100       1.678700      -2.614200    


%chk=000094867-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094867

0 1
O 3.478530 0.982446 0.714345
O 2.218507 1.336471 -2.055700
N -0.154638 -0.060799 1.097536
C -0.886080 1.152976 1.557874
C -0.769470 -1.325092 1.589220
C 1.302534 0.010288 1.350634
C -2.155233 1.455080 0.729911
C -0.516895 -2.535572 0.662081
C 2.061702 0.869636 0.307573
C -1.853968 1.862072 -0.729278
C -1.236118 -2.424728 -0.700237
C 2.055905 0.243086 -1.081246
C -3.132546 2.091031 -1.562465
C -0.898021 -3.589489 -1.655021
H -0.201970 2.019331 1.474355
H -1.155745 1.067193 2.640792
H -0.416575 -1.564123 2.624274
H -1.861879 -1.163929 1.660984
H 1.727707 -1.010042 1.321539
H 1.529754 0.414687 2.370769
H -2.824113 0.569971 0.732691
H -2.716353 2.268942 1.235364
H 0.572613 -2.660394 0.493722
H -0.854367 -3.454113 1.185951
H 1.599866 1.875497 0.225006
H -1.239002 2.785386 -0.731902
H -1.230968 1.075036 -1.194424
H -2.332080 -2.390747 -0.529214
H -0.964180 -1.457727 -1.165745
H 2.892465 -0.483814 -1.140370
H 1.087096 -0.273159 -1.233636
H -2.889343 2.394173 -2.597478
H -3.742834 1.168992 -1.615422
H -3.763957 2.884438 -1.118238
H -1.435943 -3.494208 -2.616280
H 0.186113 -3.618766 -1.876380
H -1.173273 -4.564667 -1.209626
H 3.549747 1.608028 1.478501
H 2.429712 0.956608 -2.944459


