%chk=000078894.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078894

0 1
 O   -2.965000       1.505700     -0.5811000    
 N  -0.4741000      0.5551000       1.014500    
 C    1.696800     -0.1561000      0.2231000    
 C   -2.491700     -0.6413000      0.4147000    
 C   -1.009700     -0.4852000      0.3373000    
 C    3.167900      5.8400001E-02  0.1853000    
 C    1.108900      -1.214500     -0.4606000    
 C  -0.2696000      -1.389200     -0.4075000    
 C   0.8686000      0.6930000      0.9394000    
 C   -3.230200      0.1134000     -0.6944000    
 C    3.598100      0.9606000     -0.9705000    
 H   -2.827000     -0.2618000       1.388600    
 H   -2.763800      -1.703200      0.3839000    
 H    3.506100      0.4967000       1.132700    
 H    3.684300     -0.9063000      0.1039000    
 H    1.713800      -1.907400      -1.039000    
 H  -0.7375000      -2.210500     -0.9396000    
 H    1.267400       1.538200       1.491800    
 H   -4.309400     -4.3000001E-02 -0.6010000    
 H   -2.906900     -0.2233000      -1.685000    
 H    3.314300      0.5286000      -1.936100    
 H    4.684600       1.092500     -0.9623000    
 H    3.133800       1.949600     -0.8940000    
 H   -3.453600       1.947900      -1.296100    


%chk=000078894-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078894

0 1
O -3.344942 -0.623282 -1.638778
N -0.333009 0.051519 1.336438
C 1.715320 -0.197793 -0.007614
C -2.543522 0.503268 0.360962
C -1.054351 0.261303 0.189576
C 3.220242 -0.404088 -0.053372
C 0.948619 0.009550 -1.184271
C -0.438782 0.238837 -1.090471
C 1.009301 -0.171479 1.220712
C -3.423699 -0.643329 -0.163984
C 3.992094 0.911384 -0.343637
H -2.853821 1.428537 -0.161055
H -2.738803 0.634632 1.439776
H 3.566512 -0.823060 0.910722
H 3.473398 -1.149084 -0.833211
H 1.436952 -0.013255 -2.166592
H -1.060359 0.379659 -1.978260
H 1.544834 -0.337217 2.165162
H -4.471830 -0.480446 0.164948
H -3.066442 -1.613532 0.240033
H 3.683158 1.345976 -1.311672
H 5.081637 0.728847 -0.381192
H 3.794045 1.664170 0.440343
H -3.830455 -1.403216 -2.006564


