%chk=000048161.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048161

0 1
 O  -2.1700000E-02   2.407800      0.4494000    
 O  -0.2185000      -2.158800     -0.9731000    
 O    3.619800     -0.3562000      0.7634000    
 N    1.789300       1.014700      0.5595000    
 N    1.693000      -1.220700     -0.1377000    
 C  -0.2543000      0.2251000     -0.5660000    
 C   -1.688300      0.1210000     -3.0200001E-02
 C  -0.2898000      0.6701000      -2.003900    
 C   0.4858000       1.312500      0.2005000    
 C   0.3790000      -1.159200     -0.5698000    
 C   -2.675100       1.008200     -0.7351000    
 C   -1.974300     -0.7126000      0.9875000    
 C    2.449700     -0.1961000      0.4115000    
 C   -3.294700     -0.9557000       1.644000    
 H  -0.6160000       1.706900      -2.147600    
 H   0.7187000      0.6305000      -2.440200    
 H  -0.9055000      1.9099999E-02  -2.637600    
 H   -3.635200       1.050900     -0.2135000    
 H   -2.330100       2.045800     -0.7798000    
 H   -2.891900      0.6493000      -1.745700    
 H    2.312400       1.758900       1.012600    
 H    2.144800      -2.128900     -0.1998000    
 H   -1.167200      -1.280000       1.447600    
 H   -4.133800     -0.4799000       1.133500    
 H   -3.496300      -2.031600       1.668300    
 H   -3.268600     -0.5920000       2.675700    


%chk=000048161-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000048161

0 1
O 0.302953 2.607558 -0.492944
O 0.245418 -2.107956 -1.531304
O 2.936281 -0.411764 1.851728
N 1.514016 1.064062 0.725921
N 1.524697 -1.231170 0.177073
C -0.225987 0.226734 -0.891592
C -1.579614 0.149830 -0.093598
C -0.468918 0.535569 -2.394536
C 0.547617 1.398996 -0.243306
C 0.515150 -1.121935 -0.801384
C -2.575768 1.249713 -0.410657
C -1.791719 -0.838344 0.823326
C 2.045921 -0.208044 0.989991
C -3.028089 -1.066139 1.661536
H -0.950175 1.517526 -2.509029
H 0.488077 0.557343 -2.944923
H -1.101115 -0.251503 -2.834417
H -3.367962 1.307978 0.352283
H -2.079518 2.235681 -0.463187
H -3.065408 1.077164 -1.387772
H 1.934319 1.839320 1.248716
H 1.968349 -2.149734 0.283474
H -1.007853 -1.592419 0.981821
H -3.811550 -0.308318 1.502456
H -3.466650 -2.057492 1.434946
H -2.771272 -1.073556 2.738879


