%chk=000036414.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036414

0 1
 O    1.619400       1.668100      3.9500002E-02
 O    3.053900     -0.2648000      6.3000000E-03
 N   -2.749800       1.319000     -0.3517000    
 C  -0.4694000      0.3882000     -7.7000000E-03
 C   -1.009400     -0.9128000     -1.2200000E-02
 C   -2.505000      -1.105600     -4.9199998E-02
 C   -1.365200       1.596100      4.9400002E-02
 C   -3.269000      0.1539000      0.3640000    
 C   0.9115000      0.5041000      7.0000002E-03
 C    1.734600     -0.5995000     -9.1000004E-03
 C  -0.1562000      -2.037100     -3.9600000E-02
 C    1.231500      -1.883100     -3.5599999E-02
 C    2.973100       1.173500      3.8800001E-02
 H   -2.787100      -1.388300      -1.071300    
 H   -2.790900      -1.927800      0.6174000    
 H   -1.350300       1.998200       1.070000    
 H  -0.9748000       2.370800     -0.6200000    
 H   -4.330600      2.3800001E-02  0.1269000    
 H   -3.200300      0.3124000       1.447800    
 H   -3.326100       2.133500     -0.1418000    
 H  -0.5785000      -3.039000     -6.3199997E-02
 H    1.885600      -2.747400     -5.1600002E-02
 H    3.479000       1.533600      0.9420000    
 H    3.492900       1.574500     -0.8390000    


%chk=000036414-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036414

0 1
O 1.655814 1.685742 0.056567
O 3.107532 -0.232846 0.022908
N -2.767799 1.305381 -0.312878
C -0.499987 0.386053 -0.004430
C -1.042349 -0.937628 -0.034954
C -2.555270 -1.125445 -0.073852
C -1.372091 1.630779 0.037304
C -3.294785 0.134584 0.420960
C 0.895120 0.481914 0.020550
C 1.744223 -0.637507 0.004300
C -0.178550 -2.062110 -0.041497
C 1.236978 -1.938482 -0.025411
C 3.080014 1.253047 0.049353
H -2.874054 -1.324863 -1.115597
H -2.845872 -2.003025 0.535391
H -1.270564 2.083215 1.058142
H -0.981545 2.379575 -0.677061
H -4.376372 0.044930 0.215096
H -3.166377 0.228001 1.529057
H -3.383253 2.125219 -0.266685
H -0.619421 -3.065538 -0.060395
H 1.894468 -2.811081 -0.032257
H 3.565645 1.605996 0.975906
H 3.567395 1.638388 -0.863419


