%chk=000028671.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028671

0 1
 I   -5.050500      0.9443000      -1.524600    
 O    3.432500     -0.4859000      0.1400000    
 O   -2.983000      -1.570600     -8.0100000E-02
 N   -2.014900      0.5162000      0.4202000    
 C  -0.6445000      0.2641000      0.3491000    
 C    2.095700     -0.2397000      0.2075000    
 C   0.2669000       1.292800      0.5870000    
 C  -0.1859000      -1.016600      4.0500000E-02
 C    1.637000       1.040900      0.5161000    
 C    1.184200      -1.268400     -3.0200001E-02
 C    4.272500      0.5955000     -0.2605000    
 C   -3.072800     -0.3814000      0.2148000    
 C    5.493400      3.8400002E-02 -0.9610000    
 C   -4.430700      0.2705000      0.3811000    
 H  -7.6800004E-02   2.294000      0.8346000    
 H  -0.8279000      -1.863700     -0.1554000    
 H    2.312400       1.862500      0.7355000    
 H    1.537000      -2.267800     -0.2707000    
 H   -2.266100       1.476000      0.6472000    
 H    3.766300       1.266100     -0.9663000    
 H    4.579700       1.160300      0.6265000    
 H    6.166700      0.8417000      -1.273300    
 H    6.039700     -0.6427000     -0.3001000    
 H    5.201300     -0.5410000      -1.843200    
 H   -4.375400       1.093800       1.100500    
 H   -5.123300     -0.4721000      0.7911000    


%chk=000028671-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028671

0 1
I -4.928193 2.323708 0.519195
O 3.436871 -0.491421 -0.292918
O -3.037502 -1.682211 0.404671
N -2.112036 0.483224 0.293030
C -0.716345 0.211967 0.146779
C 2.077415 -0.179515 -0.149179
C 0.159375 1.320199 0.046709
C -0.183247 -1.106225 0.098035
C 1.549690 1.135630 -0.100693
C 1.201778 -1.289590 -0.048970
C 4.393544 0.627611 -0.404802
C -3.144806 -0.413846 0.406333
C 5.780358 0.008369 -0.555189
C -4.575669 0.116181 0.556962
H -0.242815 2.340795 0.083049
H -0.854310 -1.963527 0.174344
H 2.198064 2.012898 -0.175622
H 1.629297 -2.296062 -0.088630
H -2.377772 1.474788 0.312059
H 4.132127 1.249664 -1.285944
H 4.331147 1.258837 0.505916
H 6.544054 0.802558 -0.641640
H 6.023439 -0.617891 0.319976
H 5.828341 -0.623973 -1.457984
H -4.985345 -0.215107 1.523211
H -5.193962 -0.279863 -0.262400


