%chk=000129274.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129274

0 1
 O   -4.746500      -1.067100      0.7790000    
 O    1.722300       2.861100     -0.6018000    
 N   0.3878000      0.9543000     -0.2540000    
 N  -0.5167000       3.050400     -0.8832000    
 C  -0.9172000      0.3985000     -2.1800000E-02
 C    1.487200      0.1006000      0.1101000    
 C   -1.340900     -0.8174000     -0.5879000    
 C    1.652000      -1.191500     -0.4259000    
 C  -0.5380000      -1.588600      -1.539400    
 C   0.7862000      -1.754700      -1.465800    
 C   -1.800000       1.090400      0.8331000    
 C    2.440500      0.5720000       1.035100    
 C   -2.638800      -1.289300     -0.3183000    
 C    2.764100      -1.963400     -4.1200001E-02
 C   0.6129000       2.322700     -0.5445000    
 C   -3.498700     -0.5879000      0.5253000    
 C   -3.077800      0.6014000       1.104200    
 C    3.529400     -0.2117000       1.418100    
 C    3.692300      -1.479900      0.8788000    
 H   -1.080200      -2.089400      -2.338000    
 H    1.270000      -2.384300      -2.209000    
 H   -1.490700       2.007100       1.331000    
 H    2.331800       1.551300       1.496200    
 H   -2.988400      -2.217200     -0.7689000    
 H    2.920200      -2.955800     -0.4608000    
 H   -3.729500       1.157700       1.772200    
 H    4.246400      0.1704000       2.138700    
 H    4.541000      -2.091900       1.168700    
 H  -0.4364000       4.036300      -1.110900    
 H   -1.425700       2.635500      -1.049600    
 H   -5.203000     -0.4548000       1.381400    


%chk=000129274-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129274

0 1
O -4.937359 -0.942444 0.573178
O 1.761002 2.689015 -0.794223
N 0.382618 0.918764 -0.070881
N -0.537029 2.845624 -1.112950
C -0.941632 0.388423 0.155666
C 1.524037 0.098009 0.263454
C -1.420982 -0.725879 -0.604212
C 1.731840 -1.137314 -0.423124
C -0.561737 -1.497639 -1.511637
C 0.796768 -1.682101 -1.416502
C -1.788052 1.013195 1.101411
C 2.461408 0.558484 1.213304
C -2.774133 -1.127117 -0.438790
C 2.918943 -1.871956 -0.132523
C 0.605237 2.187978 -0.669665
C -3.616441 -0.472621 0.481623
C -3.125726 0.599549 1.269191
C 3.623106 -0.191163 1.492724
C 3.852595 -1.412838 0.814969
H -1.090751 -2.080246 -2.277796
H 1.242081 -2.399999 -2.119467
H -1.391924 1.846099 1.690992
H 2.289257 1.523125 1.698559
H -3.175917 -1.969358 -1.010862
H 3.095786 -2.816529 -0.660837
H -3.772843 1.104161 1.997589
H 4.352675 0.182636 2.219067
H 4.757337 -1.995214 1.019815
H -0.394051 3.746923 -1.560592
H -1.463702 2.425871 -1.093073
H -5.446811 -0.440636 1.256493


