%chk=000097890.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097890

0 1
 O   0.4170000       1.531600      -1.167400    
 N   -1.771400     -4.5200001E-02 -0.1932000    
 C  -0.4102000     -0.1958000      0.3239000    
 C   0.3811000       1.116900      0.1985000    
 C   0.2922000      -1.348800     -0.4051000    
 C    1.816500      0.9328000      0.7010000    
 C    1.726400      -1.522700      9.3900003E-02
 C    2.525400     -0.2257000     -3.0000000E-03
 C   -2.459100       1.050100      0.4893000    
 C   -2.517800      -1.293300     -3.7999999E-02
 H  -0.4516000     -0.4539000       1.393000    
 H  -6.4700000E-02   1.925200      0.7869000    
 H   0.3023000      -1.175300      -1.488900    
 H  -0.2041000      -2.309800     -0.2347000    
 H    1.805100      0.7473000       1.782100    
 H    2.394200       1.849000      0.5314000    
 H    2.226400      -2.306300     -0.4867000    
 H    1.710200      -1.861200       1.137500    
 H    3.517400     -0.3714000      0.4396000    
 H    2.683900      2.6100000E-02  -1.058700    
 H   -2.412200      0.9611000       1.580900    
 H   -3.518700       1.073100      0.2058000    
 H   -2.074100       2.028900      0.1876000    
 H   -2.193800      -2.057200     -0.7512000    
 H   -3.578500      -1.136700     -0.2712000    
 H   -2.462200      -1.695100      0.9804000    
 H   0.9224000       2.361200      -1.209000    


%chk=000097890-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097890

0 1
O 0.358690 1.631246 -1.015831
N -1.820588 -0.174538 -0.114152
C -0.395263 -0.290638 0.307862
C 0.372465 1.052621 0.347459
C 0.363900 -1.300479 -0.593170
C 1.824151 0.836217 0.838601
C 1.811856 -1.527180 -0.097956
C 2.586770 -0.191010 -0.029280
C -2.491515 1.111982 0.147984
C -2.629025 -1.315088 0.356225
H -0.344021 -0.665527 1.368704
H -0.139206 1.751689 1.044050
H 0.368467 -0.889713 -1.618956
H -0.179660 -2.262689 -0.624154
H 1.792087 0.484854 1.890247
H 2.355408 1.811216 0.848113
H 2.333481 -2.237518 -0.767718
H 1.792177 -1.992868 0.910362
H 3.603113 -0.348583 0.380456
H 2.703511 0.211549 -1.054407
H -2.601263 1.362913 1.236019
H -3.508202 1.070604 -0.284609
H -1.945081 1.925011 -0.356421
H -2.171302 -2.270263 0.046998
H -3.636502 -1.265661 -0.094987
H -2.751825 -1.340584 1.471580
H 0.949474 2.427334 -1.018320


