%chk=000078598.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078598

0 1
 O   -2.887700     -0.1416000       0.000000    
 N    1.725900       1.500200     -9.9999997E-05
 N    2.611600     -0.5383000      9.9999997E-05
 C   0.6596000      0.6379000     -9.9999997E-05
 C    1.238500     -0.6282000       0.000000    
 C  -0.7195000      0.8501000       0.000000    
 C   -1.531600     -0.2887000      9.9999997E-05
 C   0.4075000      -1.761200     -9.9999997E-05
 C  -0.9801000      -1.572000       0.000000    
 C    2.869100      0.7505000      9.9999997E-05
 C   -3.393200       1.191200      9.9999997E-05
 H   -1.082800       1.869400     -9.9999997E-05
 H   0.8262000      -2.762600     -9.9999997E-05
 H    1.675700       2.510300     -1.9999999E-04
 H   -1.632000      -2.442500     -9.9999997E-05
 H    3.850600       1.202500      1.9999999E-04
 H   -3.108800       1.730800      0.9099000    
 H   -4.486100       1.122100      9.9999997E-05
 H   -3.109000       1.730900     -0.9098000    


%chk=000078598-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078598

0 1
O -2.915928 -0.160582 -0.000054
N 1.825774 1.525979 0.000004
N 2.688329 -0.591677 0.000031
C 0.712872 0.670783 -0.000027
C 1.272855 -0.651747 -0.000011
C -0.677162 0.923656 -0.000038
C -1.512975 -0.217496 -0.000043
C 0.405343 -1.771004 -0.000015
C -0.978957 -1.544606 -0.000032
C 2.974966 0.716500 0.000012
C -3.539649 1.158578 0.000047
H -1.081177 1.939979 -0.000058
H 0.811989 -2.786594 0.000000
H 1.809185 2.544147 -0.000025
H -1.688554 -2.377208 -0.000035
H 3.979204 1.136423 0.000025
H -3.264289 1.737913 0.904475
H -4.623509 0.969765 0.000115
H -3.264418 1.737991 -0.904370


