%chk=000076288.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076288

0 1
 O    3.445100     -7.6000001E-03  0.1398000    
 N  -0.2016000      0.2346000     -0.2842000    
 C   -1.216700       1.203700      0.1275000    
 C  -0.6512000      -1.043500      0.2670000    
 C   -2.518800      0.4508000     -0.1022000    
 C   -2.147700      -1.025900     -6.8999999E-03
 C    1.131500      0.5985000      0.1724000    
 C    2.159500     -0.4107000     -0.3135000    
 H   -1.173700       2.123800     -0.4636000    
 H   -1.122500       1.465100       1.189300    
 H  -0.4732000      -1.108700       1.348100    
 H  -0.1876000      -1.906700     -0.2200000    
 H   -2.923700      0.6676000      -1.097700    
 H   -3.278200      0.7268000      0.6365000    
 H   -2.706500      -1.533600      0.7858000    
 H   -2.377600      -1.527400     -0.9544000    
 H    1.183400      0.6830000       1.266300    
 H    1.403300       1.587700     -0.2182000    
 H    2.178100     -0.4605000      -1.407400    
 H    1.978900      -1.412800      8.5500002E-02
 H    4.083200     -0.6623000     -0.1916000    


%chk=000076288-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000076288

0 1
O 3.533490 0.123540 0.091939
N -0.188266 0.177071 -0.197957
C -1.219970 1.190599 0.143089
C -0.726999 -1.119621 0.299610
C -2.535160 0.484144 -0.247208
C -2.269786 -1.018647 0.095187
C 1.170891 0.513484 0.266395
C 2.232914 -0.382057 -0.382705
H -1.043534 2.126851 -0.416119
H -1.220807 1.436923 1.237107
H -0.489960 -1.261886 1.385600
H -0.282953 -1.967533 -0.251917
H -2.711931 0.603433 -1.330033
H -3.405924 0.896504 0.291791
H -2.801955 -1.324059 1.013289
H -2.615802 -1.675327 -0.720986
H 1.269615 0.440835 1.379694
H 1.393066 1.558983 -0.016261
H 2.143550 -0.309748 -1.486325
H 2.092225 -1.441906 -0.081113
H 4.261294 -0.409684 -0.314581


