%chk=000089038.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089038

0 1
 O   0.3425000      -1.108000       1.813400    
 O    1.483200       2.862700     -0.5929000    
 O   0.2963000       1.712300      0.9675000    
 N  -0.1910000      -1.343900     -0.4309000    
 C   -1.555000      -1.779400     -0.2340000    
 C   -2.505300     -0.6041000     -0.1553000    
 C   -1.948100      -2.780100      -1.318700    
 C   0.6784000      -1.033100      0.6196000    
 C    2.016300     -0.5842000      0.2570000    
 C   -2.252200      0.5216000     -0.9198000    
 C   -3.606500     -0.6805000      0.6795000    
 C    2.298800      0.7675000      6.0899999E-02
 C   -3.127900       1.605100     -0.8470000    
 C   -4.482200      0.4029000      0.7522000    
 C    3.024800      -1.536300      0.1075000    
 C   -4.242700       1.545600     -1.1000000E-02
 C    3.589700       1.167300     -0.2847000    
 C    4.315700      -1.136400     -0.2382000    
 C    4.598200      0.2153000     -0.4343000    
 C    1.267100       1.785800      0.2095000    
 H   -1.580900      -2.305000      0.7297000    
 H   0.1385000      -1.216200      -1.384200    
 H   -1.921200      -2.322100      -2.314300    
 H   -1.260100      -3.632600      -1.329000    
 H   -2.961500      -3.162700      -1.155300    
 H   -1.402000      0.5896000      -1.591500    
 H   -3.802600      -1.566500       1.276200    
 H   -2.943400       2.493600      -1.443800    
 H   -5.350800      0.3565000       1.402700    
 H    2.817500      -2.592700      0.2581000    
 H   -4.925000       2.388800      4.4900000E-02
 H    3.845800       2.213400     -0.4314000    
 H    5.101200      -1.877600     -0.3538000    
 H    5.604100      0.5264000     -0.7004000    
 H   0.7838000       3.542500     -0.4872000    


%chk=000089038-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089038

0 1
O 0.271329 -1.937298 1.277507
O 2.235439 2.692187 -1.492804
O 0.721416 1.082424 -2.103620
N -0.253738 -1.057814 -0.802553
C -1.631072 -1.598866 -0.779057
C -2.622160 -0.613027 -0.141127
C -2.050190 -1.983458 -2.216227
C 0.594176 -1.235490 0.259728
C 2.010626 -0.643799 0.198384
C -2.771219 0.702338 -0.651845
C -3.418839 -1.014119 0.957748
C 2.505546 0.533451 -0.468555
C -3.706252 1.592776 -0.080889
C -4.358040 -0.125596 1.530590
C 2.919884 -1.358502 1.024823
C -4.506487 1.180343 1.011173
C 3.860118 0.936520 -0.263949
C 4.263181 -0.971182 1.185352
C 4.739235 0.191336 0.538857
C 1.722756 1.395830 -1.398478
H -1.596849 -2.505394 -0.148618
H 0.018502 -0.409600 -1.560267
H -2.067101 -1.099994 -2.881431
H -1.350011 -2.725974 -2.638461
H -3.065010 -2.417295 -2.211308
H -2.146668 1.037655 -1.489714
H -3.291122 -2.019853 1.375506
H -3.811381 2.607124 -0.483130
H -4.964621 -0.448778 2.384277
H 2.515299 -2.220292 1.563620
H -5.231579 1.871725 1.455425
H 4.207405 1.847882 -0.756331
H 4.928566 -1.564944 1.821205
H 5.776783 0.517483 0.663917
H 1.695576 3.197700 -2.158749


