%chk=000105225.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105225

0 1
 O    1.644300      -2.480700      0.2654000    
 O    4.261600       1.172600     -0.8600000    
 N    2.947600     -0.6539000     -0.2946000    
 N   -3.557800       1.058100      0.1988000    
 N   -3.301200     -0.8697000      -1.224100    
 N   -1.998600       1.477200       1.935800    
 N   -5.087300      0.6217000      -1.526300    
 C  -0.4866000     -0.8699000       1.263000    
 C   0.7723000     -0.3065000      0.7013000    
 C   -1.738500     -0.4431000      0.5215000    
 C    1.788800      -1.118200      0.2241000    
 C   0.9568000       1.070300      0.6418000    
 C   -2.443300      0.6752000      0.8559000    
 C   -2.194600      -1.193400     -0.5234000    
 C    2.135700       1.586000      0.1146000    
 C    3.091300      0.6897000     -0.3360000    
 C   -3.924800      0.2517000     -0.8155000    
 C    2.725500      -3.254100     -0.2405000    
 C    4.408900       2.586900     -0.9019000    
 H  -0.4657000      -1.967900       1.262800    
 H  -0.5455000     -0.6302000       2.331000    
 H   0.2243000       1.776400       1.006900    
 H   -1.691900      -2.095800     -0.8544000    
 H    2.232500       2.664200      9.3999997E-02
 H   -2.546200       2.310200       2.118500    
 H   -1.578900       1.030800       2.740200    
 H    2.459500      -4.310400     -0.1385000    
 H    2.891500      -3.050400      -1.303800    
 H    3.638800      -3.080000      0.3384000    
 H   -5.403200      4.7600001E-02  -2.295700    
 H   -5.590600       1.455500      -1.256400    
 H    3.661800       3.053500      -1.553400    
 H    5.388300       2.796500      -1.344800    
 H    4.417100       3.023900      0.1026000    


%chk=000105225-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105225

0 1
O 1.873941 -2.372091 0.838141
O 4.398645 1.408945 -0.141826
N 3.090535 -0.421121 0.315214
N -3.517612 0.859144 0.835589
N -3.988081 -0.056331 -1.389894
N -1.545071 0.371773 1.978647
N -5.511190 1.347593 -0.291303
C -0.585622 -1.406745 -0.211875
C 0.689945 -0.563797 -0.209732
C -1.883172 -0.623383 -0.247515
C 1.916891 -1.084649 0.307129
C 0.768358 0.738673 -0.743104
C -2.316781 0.204436 0.847281
C -2.781611 -0.695648 -1.329745
C 1.985759 1.462070 -0.756106
C 3.129165 0.830096 -0.208602
C -4.297822 0.694830 -0.279037
C 3.143293 -2.910664 1.371353
C 4.546801 2.763062 -0.687213
H -0.557297 -2.083995 -1.089503
H -0.557445 -2.080347 0.667799
H -0.138878 1.196416 -1.152408
H -2.528826 -1.307502 -2.205644
H 2.024073 2.469567 -1.174584
H -1.907461 0.969361 2.718777
H -0.591885 0.021916 2.024229
H 2.880888 -3.915656 1.733395
H 3.906977 -2.957254 0.577003
H 3.523199 -2.275421 2.189268
H -6.115174 1.239611 -1.100917
H -5.785093 1.907367 0.510564
H 4.310640 2.790092 -1.768538
H 5.605346 3.016149 -0.532151
H 3.906464 3.487300 -0.147393


