%chk=000096180.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096180

0 1
 O  -0.9703000      -2.206400     -0.1573000    
 O    5.189500      5.3599998E-02  0.2136000    
 N    1.495800      0.1805000      0.1269000    
 C   0.5331000      9.0499997E-02 -0.9488000    
 C  -0.8621000      0.1734000     -0.4236000    
 C    2.864600      0.1118000     -0.3775000    
 C   -1.553000     -0.9795000     -5.0500002E-02
 C   -1.474100       1.421400     -0.3077000    
 C    3.877700      0.1585000      0.7517000    
 C   -2.855900     -0.8842000      0.4382000    
 C   -2.777100       1.516600      0.1811000    
 C   -3.468100      0.3639000      0.5541000    
 H   0.6643000     -0.8377000      -1.519800    
 H   0.6912000      0.9041000      -1.669300    
 H    1.346600     -0.5801000      0.7902000    
 H    3.057900      0.9442000      -1.065600    
 H    3.018500     -0.8096000     -0.9538000    
 H  -0.9474000       2.328500     -0.5927000    
 H    3.733800     -0.6750000       1.446800    
 H    3.808000       1.093100       1.318300    
 H   -3.406000      -1.774000      0.7326000    
 H   -3.253600       2.488500      0.2718000    
 H   -4.482500      0.4381000      0.9348000    
 H   -1.598300      -2.883800      0.1470000    
 H    5.323500      0.8102000     -0.3823000    


%chk=000096180-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096180

0 1
O -0.616696 -1.977852 0.107125
O 5.294830 -0.183638 0.281313
N 1.522774 0.070531 0.069093
C 0.513806 0.374263 -0.979128
C -0.905049 0.352772 -0.436026
C 2.913953 0.090174 -0.430170
C -1.461557 -0.842349 0.093008
C -1.727865 1.502054 -0.450644
C 3.896321 -0.120140 0.737250
C -2.785536 -0.893265 0.582735
C -3.057940 1.473606 0.031533
C -3.586500 0.270407 0.548494
H 0.582472 -0.339769 -1.838889
H 0.729660 1.382849 -1.380123
H 1.295736 -0.833399 0.509813
H 3.099885 1.083781 -0.890722
H 3.124719 -0.675622 -1.217407
H -1.313760 2.436770 -0.846789
H 3.723941 -1.099330 1.217477
H 3.746171 0.673226 1.497435
H -3.190378 -1.830231 0.988122
H -3.671254 2.380142 0.005559
H -4.613651 0.232714 0.927028
H -1.099922 -2.771457 0.445703
H 5.541941 0.690364 -0.113589


