%chk=000081874.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081874

0 1
 O    1.041100       2.038600     -0.9376000    
 O  -0.1312000      -2.550100     -0.7550000    
 O   -3.045400      0.6988000      0.6718000    
 N  -0.9795000       1.351800     -9.2200004E-02
 N   -1.559700     -0.9186000     -2.2000000E-03
 C   0.7346000     -0.3183000     -0.6217000    
 C    1.769900     -0.5389000      0.4794000    
 C    2.995900      0.3408000      0.2469000    
 C    1.161000     -0.2605000       1.851700    
 C   0.2924000       1.126200     -0.5861000    
 C  -0.3447000      -1.367400     -0.4870000    
 C   -1.934500      0.3975000      0.2319000    
 H    1.186200     -0.4792000      -1.610100    
 H    2.099900      -1.586000      0.4580000    
 H    2.834100       1.386100      0.5263000    
 H    3.824200     -1.5300000E-02  0.8712000    
 H    3.335100      0.2959000     -0.7932000    
 H   0.8471000      0.7804000       1.976500    
 H    1.907200     -0.4569000       2.631000    
 H   0.3090000     -0.9114000       2.068400    
 H   -1.260300       2.323200      8.5000005E-03
 H   -2.269600      -1.626300      0.1651000    


%chk=000081874-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081874

0 1
O 0.898879 2.190585 -0.853082
O -0.106907 -2.542827 -0.778619
O -3.242158 0.623670 0.561322
N -1.118540 1.366402 -0.079340
N -1.629255 -0.943206 -0.081673
C 0.716004 -0.244956 -0.600917
C 1.811875 -0.519643 0.519946
C 3.120549 0.244389 0.227544
C 1.279088 -0.220987 1.940413
C 0.201706 1.189619 -0.544315
C -0.349771 -1.336581 -0.518252
C -2.077083 0.367512 0.170880
H 1.235307 -0.370471 -1.568785
H 2.011316 -1.606399 0.436741
H 2.964403 1.336466 0.234264
H 3.874690 -0.005599 0.996115
H 3.535124 -0.030497 -0.759564
H 1.082130 0.858160 2.080912
H 2.033675 -0.517642 2.690337
H 0.351223 -0.778110 2.166784
H -1.447950 2.331847 0.026336
H -2.331507 -1.681330 0.034556


