%chk=000124646.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124646

0 1
 I   -4.321400      -2.498300       1.043600    
 O   0.6301000     -0.2610000      0.3865000    
 O    2.417700       1.513200       1.727800    
 O    2.201300      -2.060800      -1.174700    
 O   0.5027000       1.252300      -1.344600    
 N    2.003600     -0.2267000      0.2413000    
 C    4.190200      0.4283000      0.4868000    
 C    4.118300     -0.7582000     -0.4769000    
 C    2.769400      0.6650000      0.9227000    
 C    2.660800      -1.128400     -0.5337000    
 C   -1.500700      0.4812000     -0.3077000    
 C  -2.9700000E-02  0.5492000     -0.4993000    
 C   -2.060500     -0.6902000      0.1596000    
 C   -2.262000       1.593800     -0.6018000    
 C   -3.442300     -0.7517000      0.3407000    
 C   -3.643600       1.532500     -0.4208000    
 C   -4.233800      0.3598000      5.0500002E-02
 H    4.578800       1.321600     -1.0900000E-02
 H    4.811200      0.1958000       1.356800    
 H    4.702100      -1.605900     -0.1067000    
 H    4.469400     -0.4812000      -1.475300    
 H   -1.448000      -1.561800      0.3741000    
 H   -1.813900       2.513700     -0.9656000    
 H   -4.259700       2.398200     -0.6459000    
 H   -5.312200      0.3336000      0.1846000    


%chk=000124646-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124646

0 1
I -4.380319 -2.257773 1.691920
O 0.631840 -0.409042 0.316321
O 2.386795 1.122281 2.041547
O 2.215010 -1.652160 -1.767203
O 0.565888 1.529682 -1.038901
N 2.041118 -0.318340 0.187748
C 4.275210 0.270343 0.619814
C 4.219392 -0.651275 -0.629610
C 2.827785 0.454016 1.087840
C 2.739595 -0.970700 -0.866441
C -1.522585 0.518458 -0.247646
C -0.056080 0.663521 -0.408556
C -2.094861 -0.556703 0.484209
C -2.349105 1.497982 -0.857162
C -3.496581 -0.632527 0.594119
C -3.748342 1.402217 -0.732002
C -4.333086 0.337037 -0.005810
H 4.698711 1.264788 0.399902
H 4.863984 -0.160251 1.447485
H 4.768559 -1.598087 -0.490797
H 4.621660 -0.169668 -1.536592
H -1.448195 -1.304856 0.946683
H -1.882900 2.315155 -1.416319
H -4.395078 2.152746 -1.197281
H -5.420616 0.267154 0.087835


