%chk=000148218.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148218

0 1
 O   -3.323700       1.798300      0.1340000    
 N    3.045500      0.2758000     -8.5199997E-02
 N    1.025900     -0.1731000      0.6734000    
 N    1.704000      0.1417000     -0.3288000    
 C  -0.3226000     -0.2861000      0.3214000    
 C   -1.160300      0.8262000      0.4032000    
 C  -0.8306000      -1.511500     -0.1099000    
 C   -2.505900      0.7133000      5.3500000E-02
 C   -2.176500      -1.624400     -0.4593000    
 C   -3.014000     -0.5120000     -0.3777000    
 C    3.731500     -0.4872000      0.9432000    
 C    3.826800      0.8390000      -1.167700    
 H  -0.7682000       1.782900      0.7402000    
 H  -0.1864000      -2.384400     -0.1758000    
 H   -2.572100      -2.578700     -0.7946000    
 H   -4.060400     -0.6134000     -0.6527000    
 H    3.124600     -0.5642000       1.848700    
 H    4.666500      1.8200001E-02   1.202200    
 H    3.949500      -1.485100      0.5533000    
 H    4.666700       1.402300     -0.7520000    
 H    3.206600       1.516100      -1.762600    
 H    4.197400      2.6600000E-02  -1.798700    
 H   -4.218900       1.539600     -0.1450000    


%chk=000148218-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148218

0 1
O -3.051447 1.793382 -0.823180
N 3.100672 0.375303 -0.011738
N 1.120286 -0.652295 0.127009
N 1.750115 0.478322 -0.131443
C -0.303115 -0.550539 0.001757
C -1.007239 0.627630 -0.365956
C -1.021249 -1.747058 0.276098
C -2.411259 0.592140 -0.453531
C -2.427277 -1.761001 0.182651
C -3.138367 -0.595533 -0.182124
C 3.760163 -0.885419 0.365030
C 3.867486 1.591773 -0.286994
H -0.469928 1.554795 -0.579975
H -0.457034 -2.641452 0.556918
H -2.978191 -2.683938 0.394429
H -4.233705 -0.610091 -0.253695
H 4.848443 -0.717550 0.394162
H 3.516807 -1.681726 -0.362220
H 3.401613 -1.229689 1.352477
H 4.455770 1.902685 0.597538
H 3.152845 2.388882 -0.541886
H 4.562116 1.444311 -1.136216
H -4.032105 1.666967 -0.856011


