%chk=000008678.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008678

0 1
 O   -1.793000       1.694900     -0.4377000    
 O   -2.812700     -0.7091000      0.5150000    
 N    3.450700      0.2293000      0.5225000    
 N    4.828500      0.3474000      0.1483000    
 C    1.238200     -0.3447000     -0.3200000    
 C    2.693800     -0.2186000     -0.6189000    
 C   0.3884000      0.7434000     -0.5186000    
 C  -0.9732000      0.6252000     -0.2394000    
 C   0.7265000      -1.551100      0.1581000    
 C   -1.484900     -0.5811000      0.2387000    
 C  -0.6351000      -1.669200      0.4375000    
 C   -1.971700       2.587000      0.6608000    
 C   -3.655600      -1.153300     -0.5463000    
 H    3.067100      -1.191300     -0.9690000    
 H    2.821200      0.4673000      -1.468600    
 H   0.7816000       1.686800     -0.8901000    
 H    1.377800      -2.406300      0.3190000    
 H   -1.026700      -2.611600      0.8108000    
 H    3.117200       1.142500      0.8305000    
 H   -1.016500       3.038500      0.9473000    
 H   -2.411300       2.063000       1.515300    
 H   -2.654800       3.381800      0.3490000    
 H   -3.360200      -2.153800     -0.8774000    
 H   -3.618900     -0.4530000      -1.386700    
 H   -4.682300      -1.197300     -0.1727000    
 H    4.936500       1.124600     -0.5030000    
 H    5.370700      0.5985000      0.9740000    


%chk=000008678-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008678

0 1
O -1.957834 1.636995 -0.754948
O -2.721006 -0.763138 0.747856
N 3.722959 -0.178693 0.374440
N 5.093835 -0.121315 0.008656
C 1.347174 -0.049022 -0.316925
C 2.797527 0.166045 -0.732912
C 0.347224 0.882975 -0.683656
C -1.004973 0.674132 -0.337452
C 0.971885 -1.193086 0.434307
C -1.379434 -0.501649 0.373694
C -0.379692 -1.415989 0.771325
C -2.665262 2.322170 0.351309
C -3.648271 -0.958212 -0.391013
H 3.068644 -0.494967 -1.577135
H 2.927129 1.214101 -1.097207
H 0.598845 1.793353 -1.239776
H 1.750095 -1.899206 0.740264
H -0.689065 -2.303021 1.334053
H 3.487759 0.330356 1.242466
H -1.947700 2.911938 0.953241
H -3.187065 1.595128 0.999635
H -3.387710 2.995425 -0.135132
H -3.361136 -1.860390 -0.964008
H -3.648583 -0.076915 -1.057725
H -4.641762 -1.102117 0.060805
H 5.563234 0.792113 0.021015
H 5.644483 -0.907212 0.353222


