%chk=000039980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039980

1 1
 O   -3.140200      0.7826000     -2.2100000E-02
 O   -2.352900      -1.387900     -0.1083000    
 N    2.553600      6.1099999E-02 -9.7800002E-02
 C    1.520600      0.3033000      0.9426000    
 C    2.133700      0.6839000      -1.435500    
 C    3.896200      0.6771000      0.3166000    
 C    2.763600      -1.443000     -0.3151000    
 C   0.1903000     -0.2786000      0.5856000    
 C  -0.9159000      0.4602000      0.4295000    
 C   -2.194100     -0.1906000      6.9799997E-02
 C   -4.454800      0.3319000     -0.3654000    
 H    1.456300       1.387400       1.100200    
 H    1.874400     -0.1454000       1.879000    
 H    1.240100      0.1767000      -1.809000    
 H    1.939900       1.748300      -1.272600    
 H    2.955100      0.5520000      -2.146600    
 H    4.629300      0.4828000     -0.4718000    
 H    3.751600       1.753200      0.4493000    
 H    4.208800      0.2119000       1.255900    
 H    1.873600      -1.875600     -0.7789000    
 H    3.618600      -1.574000     -0.9860000    
 H    2.970300      -1.906300      0.6542000    
 H   0.1270000      -1.359800      0.4975000    
 H  -0.8945000       1.539400      0.5370000    
 H   -5.113200       1.203700     -0.4061000    
 H   -4.830200     -0.3567000      0.3977000    
 H   -4.445800     -0.1479000      -1.348700    


%chk=000039980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039980

1 1
O -3.241899 0.785432 -0.058328
O -2.411695 -1.404440 -0.036986
N 2.629214 0.055298 -0.141474
C 1.512787 0.337001 0.923030
C 2.270715 0.728049 -1.464763
C 3.943410 0.630419 0.384558
C 2.788870 -1.449180 -0.359234
C 0.174479 -0.245226 0.564226
C -0.936891 0.506045 0.344832
C -2.245663 -0.165967 0.068630
C -4.615878 0.270427 -0.321291
H 1.467361 1.434034 1.029137
H 1.897608 -0.096108 1.864873
H 1.298538 0.347693 -1.810427
H 2.210899 1.816528 -1.310800
H 3.052267 0.496980 -2.204769
H 4.729228 0.485193 -0.372367
H 3.814268 1.705049 0.584385
H 4.220329 0.108313 1.313121
H 1.879385 -1.849907 -0.828319
H 3.651864 -1.620830 -1.020718
H 2.959615 -1.938382 0.612067
H 0.055389 -1.337573 0.558643
H -0.939336 1.602143 0.376700
H -5.243081 1.168989 -0.381068
H -4.931562 -0.386505 0.505421
H -4.628820 -0.293775 -1.268080


