%chk=000129042.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129042

0 1
 O  -0.4084000     -0.5497000      0.4996000    
 O    4.069500      3.7400000E-02  0.7976000    
 O   -2.347800       1.737300      0.6733000    
 O    1.053500      -2.348000     -1.9400001E-02
 O   -3.320500       1.119800      -1.285300    
 N   -3.975800      -1.305700     -8.0899999E-02
 N    1.426000       1.256500      0.3074000    
 N    1.148400       2.269500      0.4883000    
 C   -2.818100     -0.5653000      0.4175000    
 C   -1.532600      -1.276800      4.8000002E-03
 C    3.260300     -0.3733000     -0.3042000    
 C    1.809900     -0.1446000      5.8100000E-02
 C   0.8546000      -1.107400      0.1689000    
 C    3.656700      0.4248000      -1.540800    
 C   -2.875700      0.8255000     -0.1848000    
 H   -2.887400     -0.4826000       1.507900    
 H   -1.541900      -2.290500      0.4260000    
 H   -1.465200      -1.340600      -1.089800    
 H    3.481200      -1.430000     -0.4827000    
 H    3.045100      0.1524000      -2.406900    
 H    3.571000       1.504600      -1.375200    
 H    4.707800      0.2365000      -1.786700    
 H   -3.943400      -1.368200      -1.097700    
 H   -4.834100     -0.8089000      0.1542000    
 H    3.924400      0.9885000      0.9410000    
 H   -2.370600       2.644900      0.3017000    


%chk=000129042-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129042

0 1
O -0.455614 -0.405087 0.167919
O 4.022629 -0.751039 0.748172
O -3.139182 1.934305 0.294794
O 0.906940 -2.131745 -0.649718
O -3.023372 0.716352 -1.683974
N -4.046482 -1.326499 0.424590
N 1.569330 1.288284 0.171824
N 1.349159 2.407459 0.480747
C -2.849459 -0.473459 0.489440
C -1.630442 -1.310557 0.078073
C 3.292660 -0.363406 -0.478537
C 1.848509 0.042412 -0.183148
C 0.768542 -0.947981 -0.253452
C 4.077803 0.680024 -1.290502
C -2.982753 0.751543 -0.433460
H -2.717284 -0.116927 1.523093
H -1.504524 -2.161767 0.766504
H -1.723007 -1.682989 -0.958343
H 3.211574 -1.316199 -1.027182
H 3.591072 0.876303 -2.262181
H 4.166198 1.643882 -0.751192
H 5.095869 0.301077 -1.480458
H -4.320397 -1.601969 -0.523622
H -4.832455 -1.015277 0.999454
H 4.269523 0.067376 1.252745
H -3.257935 2.701985 -0.329686


