%chk=000097479.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097479

0 1
 O   -1.039000       1.745600      0.5737000    
 O   -4.798400      0.2771000     -0.3646000    
 O   -3.194700     -0.9147000      -1.447500    
 N   -1.477800     -0.5297000      0.6591000    
 C   0.7763000      0.2952000      0.2578000    
 C    3.471300     -0.2370000     -0.2280000    
 C    1.556800       1.222400     -0.4326000    
 C    1.343300     -0.8980000      0.7054000    
 C    2.904300      0.9562000     -0.6756000    
 C    2.690800      -1.164100      0.4625000    
 C  -0.6283000      0.5731000      0.5129000    
 C   -2.899700     -0.4176000      0.8926000    
 C    4.912000     -0.5214000     -0.4890000    
 C   -3.616900     -0.3872000     -0.4266000    
 H    1.133400       2.156400     -0.7931000    
 H   0.7807000      -1.632700       1.273900    
 H    3.502500       1.686600      -1.214000    
 H    3.123700      -2.093300      0.8235000    
 H   -1.119000      -1.469100      0.5249000    
 H   -3.100900      0.5031000       1.448000    
 H   -3.230500      -1.286100       1.467600    
 H    5.092000      -1.597900     -0.5817000    
 H    5.242200     -5.9900001E-02  -1.425800    
 H    5.525900     -0.1325000      0.3295000    
 H   -5.260300      0.2839000      -1.230000    


%chk=000097479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097479

0 1
O -0.867410 2.054047 0.665132
O -5.186632 -0.626223 0.233192
O -3.429379 -2.049850 -0.311602
N -1.570508 -0.083897 0.150833
C 0.848664 0.402269 0.149108
C 3.604915 -0.294487 -0.202600
C 1.853201 1.403229 0.132330
C 1.238109 -0.953952 -0.004165
C 3.206732 1.059733 -0.044914
C 2.596476 -1.292495 -0.178684
C -0.572723 0.856141 0.342654
C -2.968876 0.281744 0.339416
C 5.068207 -0.664687 -0.362163
C -3.840926 -0.923467 0.049245
H 1.539284 2.444198 0.261994
H 0.501374 -1.765946 0.028270
H 3.967940 1.849093 -0.061937
H 2.879375 -2.345636 -0.294102
H -1.383622 -1.038916 -0.163713
H -3.263924 1.120099 -0.321978
H -3.160149 0.639447 1.369784
H 5.188888 -1.635622 -0.873148
H 5.617912 0.098959 -0.940361
H 5.564355 -0.746730 0.624585
H -5.741584 -1.428653 0.035724


