%chk=000119451.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119451

0 1
 O   -3.028900      0.3011000     -4.1099999E-02
 O    1.396500      -2.664300      0.4875000    
 N  -0.1956000      0.1458000      3.9000001E-02
 N   0.9461000     -0.6312000      0.1879000    
 N   0.6964000      -1.873900     -0.1570000    
 N    2.441400       2.451700      0.2302000    
 C  -0.9529000     -0.3495000      -1.116400    
 C  -0.9992000      2.5000000E-02   1.261100    
 C   -2.259300      0.4309000      -1.238100    
 C   -2.305300      0.7960000       1.087400    
 C    2.011000      6.9999998E-04 -0.6035000    
 C    2.249800       1.367800     -0.1372000    
 H   -1.285400      -1.396000      -1.043300    
 H  -0.4037000     -0.2211000      -2.057800    
 H  -0.4553000      0.4390000       2.119200    
 H   -1.243800      -1.021300       1.491800    
 H   -2.078100       1.493300      -1.442500    
 H   -2.859300      3.4600001E-02  -2.063900    
 H   -2.937100      0.6644000       1.971700    
 H   -2.127200       1.871300      0.9643000    
 H    1.800600      6.0999999E-03  -1.681700    
 H    2.944400     -0.5650000     -0.4770000    


%chk=000119451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000119451

0 1
O -3.170101 0.470897 0.033864
O 2.089526 -2.572052 0.039755
N -0.349046 -0.001369 -0.245666
N 0.906735 -0.663169 -0.217343
N 0.926004 -2.036415 0.054629
N 2.533616 2.051126 1.303028
C -1.316626 -0.610266 -1.212556
C -0.955748 0.158355 1.116660
C -2.545778 0.313620 -1.288336
C -2.201054 1.051388 0.977763
C 2.139499 0.119567 -0.491878
C 2.361805 1.183300 0.502648
H -1.625716 -1.625788 -0.888992
H -0.830595 -0.681596 -2.202095
H -0.216812 0.641934 1.778665
H -1.236272 -0.829688 1.540634
H -2.245617 1.306814 -1.685677
H -3.322136 -0.125866 -1.935333
H -2.732019 1.130217 1.939875
H -1.898290 2.063148 0.634252
H 2.069576 0.570250 -1.497735
H 2.974150 -0.609009 -0.475562


