%chk=000017861.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017861

0 1
 O    4.275400     -2.6100000E-02  0.8210000    
 N   -2.413800      -1.217700      0.2433000    
 C   0.9516000      5.7000001E-03 -0.9307000    
 C    1.957300     -1.8500000E-02  0.2189000    
 C  -0.4692000      1.9900000E-02 -0.4283000    
 C    3.391400      1.2900000E-02 -0.2909000    
 C   -1.109800       1.217800     -0.1833000    
 C   -1.140500      -1.160300     -0.2076000    
 C   -2.420300       1.199500      0.2813000    
 C   -3.022100     -3.3100002E-02  0.4764000    
 H    1.122700      0.8860000      -1.563700    
 H    1.102100     -0.8649000      -1.582100    
 H    1.810600     -0.9118000      0.8399000    
 H    1.792100      0.8340000      0.8906000    
 H    3.602300     -0.8547000     -0.9235000    
 H    3.594100      0.9210000     -0.8676000    
 H  -0.6098000       2.168200     -0.3444000    
 H  -0.6767000      -2.125200     -0.3842000    
 H   -2.953600       2.121000      0.4847000    
 H   -4.043000     -0.1017000      0.8376000    
 H    4.102200      0.7632000       1.361900    


%chk=000017861-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017861

0 1
O 4.409374 -0.067453 0.829055
N -2.459396 -1.237605 0.249451
C 0.962391 0.022776 -0.950756
C 1.978612 0.008395 0.226960
C -0.477370 0.038003 -0.469664
C 3.435930 0.006681 -0.270598
C -1.167169 1.248164 -0.202240
C -1.181966 -1.171349 -0.227165
C -2.489829 1.205154 0.290296
C -3.094199 -0.054984 0.504632
H 1.158074 0.909303 -1.586322
H 1.139650 -0.869713 -1.582399
H 1.811300 -0.885129 0.857055
H 1.802088 0.893970 0.872037
H 3.638596 -0.895962 -0.872408
H 3.624425 0.898095 -0.909548
H -0.674019 2.211023 -0.384355
H -0.701305 -2.137739 -0.428893
H -3.045982 2.124191 0.501643
H -4.118149 -0.133375 0.887386
H 4.291943 0.722756 1.415134


