%chk=000078633.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078633

0 1
 O    1.380100      -1.744200     -0.4112000    
 O   -3.222900     -0.5747000     -5.5000000E-02
 O    2.408000       2.167100      0.1247000    
 O    3.025600      8.6700000E-02 -0.2067000    
 N    2.135700      0.9548000     -4.3499999E-02
 C   0.4252000     -0.7877000     -0.2319000    
 C   0.7722000      0.5509000     -4.8599999E-02
 C   -1.912800     -0.2058000     -5.2499998E-02
 C  -0.9174000      -1.166100     -0.2339000    
 C  -0.2231000       1.511100      0.1329000    
 C   -1.565600       1.132700      0.1308000    
 C    1.883800      -2.383100      0.7595000    
 C   -4.188700      0.4582000      0.1354000    
 H   -1.189800      -2.208800     -0.3775000    
 H   8.1000002E-03   2.563300      0.2788000    
 H   -2.287600       1.929000      0.2771000    
 H    1.179500      -3.154900       1.085600    
 H    2.050800      -1.673600       1.576900    
 H    2.834000      -2.862800      0.5089000    
 H   -5.176400     -1.3400000E-02  0.1050000    
 H   -4.159400       1.191400     -0.6778000    
 H   -4.088300      0.9264000       1.120500    


%chk=000078633-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078633

0 1
O 1.324125 -1.826689 -0.442522
O -3.250776 -0.578155 -0.051259
O 2.417327 2.295677 -0.193596
O 3.138119 0.187593 0.279902
N 2.195511 1.038638 0.036097
C 0.425599 -0.795924 -0.150481
C 0.800010 0.578035 0.030151
C -1.937439 -0.119732 -0.013810
C -0.945162 -1.116438 -0.176569
C -0.198576 1.570163 0.173319
C -1.561766 1.239571 0.166981
C 1.969578 -2.507977 0.704333
C -4.332135 0.408424 0.085014
H -1.244201 -2.153362 -0.350492
H 0.126631 2.608109 0.286214
H -2.308178 2.027669 0.292307
H 1.198959 -2.955055 1.361684
H 2.606472 -1.800889 1.260194
H 2.586078 -3.298095 0.251646
H -5.259441 -0.177809 0.019500
H -4.298288 1.150507 -0.734530
H -4.281445 0.922238 1.063418


