%chk=000048719.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048719

0 1
 O    2.882000      -1.347300     -7.0000000E-02
 N   -3.587200     -0.7998000      0.6915000    
 C   -1.875100     -4.3600000E-02 -0.2681000    
 C   -2.336300      -1.430000      0.2033000    
 C   -2.853700      0.4860000      0.7897000    
 C  -0.3793000      0.3101000     -0.1036000    
 C   -2.289900      0.2784000      -1.685800    
 C   0.5886000     -0.6927000     -0.1597000    
 C   1.8000000E-03   1.636600      9.8600000E-02
 C    1.937500     -0.3692000     -1.4000000E-02
 C    1.350600       1.960300      0.2444000    
 C    2.318600      0.9573000      0.1881000    
 C    4.242500     -0.9461000      8.5600004E-02
 H   -2.482800      -2.189100     -0.5718000    
 H   -1.754300      -1.880800       1.016900    
 H   -2.424800      0.6557000       1.785400    
 H   -3.443100       1.367400      0.5173000    
 H   -4.332200     -0.7877000     -5.4000001E-03
 H   -2.169900       1.344900      -1.910400    
 H   -1.692300     -0.2834000      -2.413800    
 H   -3.339400      3.3700000E-02  -1.887000    
 H   0.3088000      -1.728900     -0.3295000    
 H  -0.7416000       2.428000      0.1420000    
 H    1.646400       2.993600      0.4010000    
 H    3.347400       1.278700      0.3087000    
 H    4.423900     -0.5142000       1.075700    
 H    4.560300     -0.2792000     -0.7229000    
 H    4.856100      -1.850100      1.4000000E-02


%chk=000048719-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000048719

0 1
O 2.868033 -1.349804 -0.161400
N -3.226637 -0.765813 1.182702
C -1.879200 -0.024396 -0.372400
C -2.369060 -1.436954 0.139195
C -2.946057 0.601851 0.613110
C -0.421502 0.331925 -0.084724
C -2.189505 0.233846 -1.866048
C 0.596766 -0.637180 -0.210860
C -0.056045 1.669776 0.230727
C 1.955551 -0.290100 -0.011236
C 1.296928 2.010505 0.427821
C 2.319195 1.039502 0.312713
C 4.285979 -1.053658 0.047456
H -2.924833 -2.002978 -0.637805
H -1.594052 -2.091120 0.575665
H -2.552195 1.308807 1.364339
H -3.796010 1.076348 0.078402
H -4.211924 -1.056415 1.233208
H -2.016593 1.294737 -2.126167
H -1.537474 -0.381330 -2.513532
H -3.242356 -0.012613 -2.099024
H 0.366049 -1.677772 -0.461747
H -0.829006 2.440699 0.324038
H 1.567430 3.043261 0.676361
H 3.363197 1.323805 0.473618
H 4.475814 -0.693423 1.077651
H 4.653936 -0.303231 -0.679712
H 4.806170 -2.009676 -0.112154


