%chk=000014518.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014518

0 1
 O   -1.372000     -0.7577000       1.117000    
 O   -1.568100       1.038300     -0.4141000    
 O    2.049400     -9.0200000E-02   1.117500    
 O   0.9788000       1.685200      0.3717000    
 N    1.210500      0.4727000      0.4076000    
 C   0.4138000     -0.3902000     -0.5117000    
 C  -0.3360000      -1.394800      0.3660000    
 C  -0.5461000      0.5279000      -1.273200    
 C    1.410800      -1.071300      -1.443400    
 C   -2.241100     -1.9700000E-02  0.2626000    
 H  -0.8012000      -2.170400     -0.2562000    
 H   0.3171000      -1.916600       1.074500    
 H  -4.7300000E-02   1.371500      -1.765900    
 H   -1.041500     -3.4400001E-02  -2.076000    
 H    2.099600      -1.731700     -0.9036000    
 H   0.8881000      -1.686800      -2.184500    
 H    2.016500     -0.3391000      -1.990700    
 H   -2.737800     -0.6853000     -0.4545000    
 H   -3.016500      0.4300000      0.8894000    


%chk=000014518-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014518

0 1
O -1.413033 -0.813853 1.140973
O -1.642527 1.038997 -0.389292
O 1.759585 -0.031435 1.501346
O 1.551777 1.710175 0.054219
N 1.290410 0.514817 0.439803
C 0.414166 -0.379308 -0.511689
C -0.347417 -1.425288 0.335982
C -0.587913 0.522669 -1.271108
C 1.413045 -1.052417 -1.478153
C -2.319874 -0.058018 0.288163
H -0.777947 -2.175940 -0.363934
H 0.324936 -1.918613 1.051529
H -0.085345 1.406134 -1.688846
H -1.034075 -0.085423 -2.089576
H 2.141218 -1.668780 -0.922961
H 0.870954 -1.706549 -2.183412
H 1.964978 -0.294516 -2.060763
H -2.776697 -0.740657 -0.468857
H -3.069238 0.395407 0.949076


