%chk=000070557.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070557

0 1
 O  -0.5510000      -2.002500     -0.6212000    
 O    3.877200     -0.9203000      0.4903000    
 N   -1.066000      0.9422000     -0.5151000    
 N    2.345900      0.8174000      0.2678000    
 N    1.672700      -1.485300     -6.4999998E-02
 N   0.5169000       2.436300     -3.3000000E-02
 C   -2.370300      0.4271000     -0.8567000    
 C   7.9899997E-02  0.2303000     -0.3042000    
 C   -3.207900      0.1161000      0.3828000    
 C    1.032000       1.168000     -1.1000000E-02
 C   0.3174000      -1.175800     -0.3563000    
 C   -4.578800     -0.4380000     -2.0000001E-03
 C  -0.7524000       2.265300     -0.3405000    
 C    2.722700     -0.5490000      0.2501000    
 C    3.324800       1.852900      0.5745000    
 C   -5.403400     -0.7874000       1.226500    
 C    2.040300      -2.897200     -8.6999997E-02
 H   -2.870400       1.188000      -1.468600    
 H   -2.245700     -0.4534000      -1.494000    
 H   -3.331800       1.023600      0.9871000    
 H   -2.680700     -0.6108000       1.013500    
 H   -5.122400      0.2990000     -0.6044000    
 H   -4.457700      -1.336100     -0.6190000    
 H   -1.484800       3.054000     -0.4480000    
 H    4.311700       1.426800      0.7717000    
 H    2.994500       2.403200       1.460900    
 H    3.399000       2.535700     -0.2775000    
 H   -6.380200      -1.180600      0.9281000    
 H   -4.901600      -1.548600       1.832500    
 H   -5.569100      9.5700003E-02   1.851800    
 H    1.200000      -3.550900     -0.3311000    
 H    2.436200      -3.170100      0.8965000    
 H    2.835100      -3.039400     -0.8262000    


%chk=000070557-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070557

0 1
O -0.618892 -2.013943 -0.575913
O 3.837853 -0.972437 0.566596
N -1.087733 1.080200 -0.598258
N 2.362768 0.827103 0.259057
N 1.613546 -1.456933 0.003661
N 0.616663 2.539257 -0.130536
C -2.446087 0.574394 -0.899313
C 0.050069 0.304087 -0.320604
C -3.187357 0.060644 0.353976
C 1.071724 1.230470 -0.045624
C 0.252733 -1.122193 -0.324670
C -4.600307 -0.455480 0.000234
C -0.695720 2.401125 -0.464536
C 2.677744 -0.551320 0.294446
C 3.411815 1.826148 0.541421
C -5.361596 -0.977496 1.237354
C 1.979068 -2.891699 0.046022
H -3.007356 1.401602 -1.372317
H -2.349441 -0.247048 -1.630148
H -3.258474 0.872966 1.104663
H -2.597817 -0.760812 0.802052
H -5.185493 0.356293 -0.479616
H -4.512209 -1.267857 -0.748852
H -1.380133 3.231954 -0.619328
H 4.345560 1.280322 0.739486
H 3.130634 2.432841 1.418474
H 3.536407 2.497144 -0.324787
H -6.365648 -1.349087 0.963202
H -4.812482 -1.809297 1.716251
H -5.490843 -0.179946 1.993017
H 1.069755 -3.467802 -0.178981
H 2.368204 -3.152218 1.043677
H 2.765145 -3.104784 -0.696806


