%chk=000077459.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077459

0 1
 O  -0.4584000     -0.9293000       2.012600    
 O   0.4574000     -0.9300000      -2.011100    
 O   -3.748700     -0.9894000      -1.225000    
 O    3.750400     -0.9880000       1.223800    
 N   -2.147100      -1.022500      0.4042000    
 N    2.147500      -1.022200     -0.4041000    
 N   -2.775500     -0.3713000     -0.7801000    
 N    2.776700     -0.3705000      0.7794000    
 C  -0.4938000      0.8001000      0.4930000    
 C   0.4936000      0.8000000     -0.4923000    
 C  -0.9877000       2.008200      0.9851000    
 C   0.9869000       2.008000     -0.9854000    
 C   -1.029900     -0.4449000       1.027600    
 C    1.029600     -0.4451000      -1.026900    
 C  -0.4943000       3.216200      0.4921000    
 C   0.4930000       3.216100     -0.4931000    
 C   -2.712100      -2.267800      0.9032000    
 C    2.712300      -2.267600     -0.9031000    
 H   -1.757000       2.021800       1.753100    
 H    1.756000       2.021600      -1.753600    
 H  -0.8789000       4.156800      0.8753000    
 H   0.8771000       4.156700     -0.8770000    
 H   -2.159400      -2.636500       1.771300    
 H   -2.666400      -3.023000      0.1128000    
 H   -3.752100      -2.096500       1.197000    
 H    2.158900      -2.636700      -1.770500    
 H    2.667600      -3.022500     -0.1123000    
 H    3.752000      -2.096200      -1.198000    


%chk=000077459-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077459

0 1
O -0.554920 -1.501925 1.416408
O 0.553060 -1.504278 -1.410712
O -4.487262 -0.435254 -0.638528
O 4.489985 -0.431131 0.632140
N -2.611397 -0.936413 0.492117
N 2.611311 -0.935826 -0.492211
N -3.291753 -0.066629 -0.406387
N 3.293333 -0.064197 0.403258
C -0.651388 0.640312 0.292003
C 0.650708 0.639926 -0.290313
C -1.281976 1.871071 0.589907
C 1.281476 1.870321 -0.589447
C -1.233352 -0.662941 0.765425
C 1.232269 -0.663996 -0.762168
C -0.639761 3.093346 0.298348
C 0.639452 3.092966 -0.299068
C -3.270363 -2.150711 1.009209
C 3.270044 -2.150162 -1.009558
H -2.267562 1.876164 1.062958
H 2.267050 1.874822 -1.062519
H -1.138238 4.039034 0.534090
H 1.138058 4.038351 -0.535748
H -2.540254 -2.684467 1.632952
H -3.593981 -2.786448 0.167545
H -4.162663 -1.873580 1.595488
H 2.538767 -2.685443 -1.630614
H 3.596575 -2.784517 -0.167976
H 4.160480 -1.872896 -1.598599


