%chk=000124844.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124844

0 1
 O   -2.853300       1.632900      4.6000001E-03
 O   -3.874200     -0.4906000     -0.5011000    
 N    3.819500     -0.7556000      0.1678000    
 C    2.494000     -0.2655000     -0.2267000    
 C    1.527100     -0.4335000      0.9636000    
 C    2.597400       1.200500     -0.6892000    
 C   7.1500003E-02 -0.4862000      0.5645000    
 C  -0.6534000      0.6956000      0.4961000    
 C    3.067800       2.147000      0.4094000    
 C  -0.5069000      -1.724500      0.2743000    
 C   -1.979300      0.5969000      0.1272000    
 C   -2.562300     -0.6157000     -0.1615000    
 C   -1.851700      -1.796600     -9.7099997E-02
 C    4.755500     -0.6413000     -0.9375000    
 C   -4.051600      0.9365000     -0.3944000    
 H    2.130800     -0.8719000      -1.067500    
 H    1.676100      0.3189000       1.745400    
 H    1.746500      -1.383400       1.474200    
 H    3.242300       1.305800      -1.568300    
 H    1.613800       1.539900      -1.035400    
 H    3.742500      -1.736100      0.4384000    
 H  -0.2103000       1.657600      0.7263000    
 H    4.012000       1.827900      0.8596000    
 H    2.323400       2.267500       1.200600    
 H    3.231700       3.142600     -1.7800000E-02
 H   7.7100001E-02  -2.639300      0.3299000    
 H   -2.314700      -2.749800     -0.3258000    
 H    5.108300      0.3835000      -1.085000    
 H    4.351800      -1.037200      -1.875400    
 H    5.648700      -1.230500     -0.7010000    
 H   -4.375000       1.323700      -1.367500    
 H   -4.836700       1.138400      0.3433000    


%chk=000124844-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124844

0 1
O -2.990684 1.606983 0.593850
O -3.948434 -0.293323 -0.515253
N 3.942082 -0.604446 0.316446
C 2.567595 -0.382194 -0.193804
C 1.578962 -0.575517 0.996276
C 2.437957 1.008784 -0.872255
C 0.113929 -0.544423 0.587147
C -0.681487 0.612751 0.843047
C 2.829301 2.201046 0.026879
C -0.467742 -1.661626 -0.068687
C -2.010845 0.593440 0.416998
C -2.573639 -0.522246 -0.236496
C -1.825443 -1.673608 -0.490584
C 5.009375 -0.674121 -0.697416
C -4.172101 1.136879 -0.177117
H 2.299542 -1.143866 -0.974117
H 1.792661 0.195267 1.758212
H 1.806179 -1.556121 1.465078
H 3.070561 1.016207 -1.781898
H 1.395021 1.119497 -1.225812
H 3.973150 -1.405617 0.960364
H -0.265238 1.484137 1.356601
H 3.828440 2.037399 0.467134
H 2.116475 2.338595 0.860662
H 2.844816 3.141771 -0.553591
H 0.147738 -2.550350 -0.250537
H -2.267442 -2.542302 -0.985165
H 5.181565 0.321162 -1.146104
H 4.798020 -1.386348 -1.533429
H 5.953621 -0.982304 -0.214137
H -4.246363 1.722086 -1.113771
H -5.069170 1.219906 0.455480


