%chk=000117422.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117422

0 1
 I   -4.947600       1.057200     -0.2265000    
 O    3.004200       1.758000      5.3900000E-02
 O    3.611700     -0.3127000     -0.3719000    
 N  -0.7576000     -2.4499999E-02  0.3516000    
 N    1.063000      -1.205400     -0.1210000    
 N    2.717100      0.5367000     -9.7700000E-02
 C   -2.141100      0.2921000      0.6169000    
 C  -0.2362000      -1.257300      7.2999999E-02
 C   0.2749000      0.8704000      0.3344000    
 C    1.388000      0.1181000      4.1099999E-02
 C   -2.900200      0.6380000     -0.6615000    
 C   -1.076100      -2.470600      7.6000001E-03
 H   -2.153300       1.136600       1.317500    
 H   -2.595000     -0.5563000       1.140800    
 H   0.1304000       1.925400      0.5246000    
 H   -2.443700       1.507700      -1.148200    
 H   -2.843300     -0.1888000      -1.378300    
 H   -1.511300      -2.698800      0.9854000    
 H   -1.883400      -2.358800     -0.7220000    
 H  -0.4744000      -3.333500     -0.2961000    


%chk=000117422-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117422

0 1
I -4.985804 1.209652 -0.292979
O 2.918243 1.865405 0.049869
O 3.710863 -0.228442 -0.436734
N -0.760269 -0.044458 0.386716
N 1.081532 -1.265853 -0.138841
N 2.764385 0.586706 -0.134361
C -2.176050 0.302121 0.632584
C -0.245027 -1.328181 0.083808
C 0.299849 0.857317 0.340854
C 1.413547 0.077478 0.019089
C -2.869881 0.714718 -0.679762
C -1.073900 -2.574319 0.047017
H -2.222323 1.122925 1.367938
H -2.681225 -0.571978 1.075786
H 0.202548 1.919991 0.538177
H -2.429056 1.621205 -1.119985
H -2.888577 -0.098471 -1.420318
H -1.508029 -2.815304 1.035570
H -1.904376 -2.509314 -0.680175
H -0.420349 -3.407697 -0.250655


