%chk=000078826.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078826

0 1
 O   0.4604000       1.271100     -0.4250000    
 N  -0.1026000     -0.6810000      0.6328000    
 C   -1.324900     -0.1590000     -1.0400000E-02
 C  -0.9615000       1.268100     -0.4053000    
 C   -2.481500     -0.2041000      0.9827000    
 C   -1.632100      -1.028800      -1.233100    
 C   0.8049000      0.1759000      0.2884000    
 C    2.248300      7.2700001E-02  0.6175000    
 C    2.989000     -0.7149000     -0.4475000    
 H   -1.345700       1.553000      -1.389900    
 H   -1.292400       2.014300      0.3257000    
 H   -3.395000      0.2127000      0.5453000    
 H   -2.692000      -1.232800       1.296500    
 H   -2.247900      0.3664000       1.888900    
 H  -0.8004000      -1.023100      -1.947100    
 H   -1.800300      -2.071700     -0.9413000    
 H   -2.527100     -0.6736000      -1.755300    
 H    2.672700       1.078000      0.7113000    
 H    2.353700     -0.4189000       1.590600    
 H    4.051300     -0.7913000     -0.1969000    
 H    2.900200     -0.2312000      -1.426000    
 H    2.583800      -1.728000     -0.5402000    


%chk=000078826-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078826

0 1
O 0.561367 1.178024 -0.348340
N -0.169424 -0.856841 0.529464
C -1.411700 -0.228892 -0.068667
C -0.898294 1.130724 -0.678759
C -2.442199 -0.003701 1.059429
C -1.972789 -1.172767 -1.153667
C 0.829705 -0.042454 0.338782
C 2.262511 -0.232203 0.748127
C 3.224227 -0.303096 -0.465884
H -0.990962 1.173473 -1.777653
H -1.369863 2.017277 -0.222096
H -3.372072 0.441062 0.657700
H -2.692062 -0.965220 1.540121
H -2.035514 0.670282 1.834480
H -1.225921 -1.343920 -1.949461
H -2.228980 -2.150353 -0.710166
H -2.884365 -0.744802 -1.611569
H 2.558437 0.612024 1.399754
H 2.316951 -1.157414 1.345297
H 4.264679 -0.437658 -0.120826
H 3.170551 0.623535 -1.062229
H 2.966620 -1.153282 -1.122138


