%chk=000066985.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066985

0 1
 O    1.091400      0.3487000     -0.1121000    
 O   -2.510300      4.1000000E-03  0.2187000    
 O   -4.991300      -1.098000     -0.4585000    
 N    5.931300      0.1857000     -0.2097000    
 C    3.484300      0.2673000     -0.1801000    
 C    2.209700     -0.4599000      0.2265000    
 C  -0.1333000     -0.2785000      0.2442000    
 C   -1.283800      0.6403000     -0.1192000    
 C    4.727600     -0.5432000      0.1712000    
 C   -3.625800      0.8316000     -8.0700003E-02
 C   -4.899600      0.1019000      0.2998000    
 H    3.511400       1.247200      0.3145000    
 H    3.452300      0.4768000      -1.257300    
 H    2.212600     -0.6470000       1.306700    
 H    2.141000      -1.419800     -0.2987000    
 H  -0.2363000      -1.233500     -0.2852000    
 H  -0.1526000     -0.4907000       1.320100    
 H   -1.258300      0.8644000      -1.192600    
 H   -1.187100       1.589600      0.4216000    
 H    4.713600      -1.508200     -0.3466000    
 H    4.759600     -0.7477000       1.246700    
 H   -3.554500       1.771000      0.4782000    
 H   -3.629600       1.047300      -1.155500    
 H   -5.778100      0.7198000      9.2500001E-02
 H   -4.885800     -0.1720000       1.359400    
 H    5.947800       1.089700      0.2613000    
 H    5.905800      0.3911000      -1.207900    
 H   -5.815000      -1.541000     -0.1921000    


%chk=000066985-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066985

0 1
O 1.007411 0.341271 -0.092306
O -2.633672 0.097915 0.305832
O -5.046094 -1.139206 -0.492828
N 5.988653 0.118712 -0.291999
C 3.430771 0.251710 -0.200017
C 2.169322 -0.489659 0.252125
C -0.259784 -0.275597 0.309031
C -1.360144 0.701568 -0.102031
C 4.732760 -0.535944 0.121489
C -3.798730 0.936423 -0.024178
C -5.024504 0.085921 0.310776
H 3.462738 1.241549 0.295663
H 3.368200 0.437404 -1.290031
H 2.190211 -0.671164 1.351475
H 2.088906 -1.479221 -0.253898
H -0.403293 -1.253567 -0.199784
H -0.288663 -0.444676 1.407039
H -1.337586 0.867210 -1.199737
H -1.209966 1.677554 0.405304
H 4.691671 -1.530767 -0.364226
H 4.789897 -0.725324 1.211509
H -3.782463 1.876035 0.570186
H -3.785568 1.188662 -1.106250
H -5.951237 0.629992 0.062861
H -5.022649 -0.150602 1.395637
H 6.184676 0.995865 0.200726
H 6.088245 0.226846 -1.306368
H -4.142109 -1.541910 -0.410800


