%chk=000048473.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048473

0 1
 O    1.584400      0.5831000     -0.2139000    
 O   -1.254800      0.5414000       2.202100    
 O   -1.232600     -0.3813000      -2.402000    
 O   0.9111000      -3.155100      0.5589000    
 N  -9.0499997E-02  -1.250800       1.368500    
 N  -7.8900002E-02  -1.711400     -0.9315000    
 C  -0.8190000      0.5047000     -0.1830000    
 C   0.4267000       1.392400     -0.3547000    
 C   -2.081000       1.361500     -0.3608000    
 C  -0.7776000     -5.3300001E-02   1.236100    
 C  -0.7652000     -0.5569000      -1.277100    
 C   0.4545000       2.509200      0.6697000    
 C   -3.328200      0.5493000     -9.3999997E-02
 C   0.3050000      -2.103800      0.3452000    
 C    2.776200       1.344000     -0.3620000    
 C    3.969900      0.4270000     -0.2016000    
 H   0.4243000       1.824200      -1.365100    
 H   -2.131000       1.780200      -1.373600    
 H   -2.135700       2.207100      0.3279000    
 H   0.7622000       2.158800       1.661200    
 H    1.183700       3.275500      0.3796000    
 H  -0.4726000       3.072200      0.7710000    
 H   -3.399500     -0.3295000     -0.7419000    
 H   -3.408700      0.2139000      0.9435000    
 H   -4.213300       1.164000     -0.2940000    
 H   7.2499998E-02  -1.578200       2.316600    
 H   9.2600003E-02  -2.378600      -1.678500    
 H    2.800000       1.818400      -1.349200    
 H    2.871500       2.107800      0.4141000    
 H    4.907200      0.9800000     -0.3102000    
 H    3.956000     -5.6699999E-02  0.7808000    
 H    3.943400     -0.3726000     -0.9494000    


%chk=000048473-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048473

0 1
O 1.642235 0.792664 0.020622
O -0.983556 0.603527 2.403425
O -0.628298 -0.071494 -2.404455
O 0.428328 -3.436777 0.611950
N -0.260202 -1.372890 1.463865
N -0.166087 -1.729713 -0.867935
C -0.741933 0.583733 -0.043151
C 0.437063 1.622549 -0.195094
C -2.123467 1.286328 -0.236234
C -0.677643 -0.036094 1.362320
C -0.515303 -0.413653 -1.197737
C 0.389264 2.839628 0.737989
C -3.320379 0.312785 -0.252819
C 0.040297 -2.258060 0.417167
C 2.893935 1.379116 -0.493189
C 3.981604 0.313155 -0.365359
H 0.410458 1.955848 -1.256712
H -2.085348 1.846746 -1.188374
H -2.249266 2.007899 0.589248
H 0.358297 2.536325 1.796385
H 1.280756 3.469913 0.570005
H -0.496289 3.463928 0.526181
H -3.252066 -0.406368 -1.089113
H -3.397380 -0.253121 0.693802
H -4.262324 0.875551 -0.377435
H -0.156029 -1.753466 2.409988
H 0.026454 -2.368617 -1.646034
H 2.747120 1.679992 -1.553625
H 3.159918 2.282900 0.093532
H 4.949779 0.708754 -0.722452
H 4.097261 0.004514 0.687883
H 3.725403 -0.579103 -0.961941


