%chk=000130948.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130948

0 1
 O  -0.1189000      -2.100800     -0.3804000    
 O   -2.791100      -2.191500      4.4700000E-02
 N  -0.1359000       2.464800      4.9500000E-02
 N    4.336600      -1.319100      0.3801000    
 C    1.210000      0.7189000     -0.3337000    
 C  -0.1096000      0.2497000     -0.1627000    
 C    2.414700     -8.8200003E-02 -0.6061000    
 C  -0.9120000       1.342600      7.0299998E-02
 C    1.166600       2.093600     -0.1975000    
 C    3.133700     -0.5484000      0.6760000    
 C  -0.7203000      -1.055300     -0.1852000    
 C   -2.301500       1.361300      0.2983000    
 C   -2.225100      -1.109700      5.3900000E-02
 C   -2.947200      0.1821000      0.2928000    
 H    3.112100      0.5008000      -1.217200    
 H    2.151400     -0.9622000      -1.214900    
 H    1.943300       2.843800     -0.2531000    
 H  -0.4544000       3.414100      0.1908000    
 H    2.460500      -1.161700       1.285900    
 H    3.411300      0.3192000       1.285500    
 H   -2.831600       2.291000      0.4719000    
 H   -4.016800      0.1282000      0.4619000    
 H    4.090500      -2.126800     -0.1913000    
 H    4.968300     -0.7575000     -0.1900000    


%chk=000130948-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130948

0 1
O 0.070667 -2.059732 -0.383636
O -2.710986 -2.287810 0.118244
N -0.167471 2.594459 0.006056
N 4.212999 -1.496106 0.401482
C 1.242362 0.850293 -0.420579
C -0.089448 0.343193 -0.171738
C 2.476688 0.039330 -0.691604
C -0.945016 1.444980 0.084924
C 1.154333 2.249793 -0.295273
C 3.062843 -0.618046 0.617616
C -0.621603 -1.018373 -0.173338
C -2.355846 1.337962 0.356052
C -2.165718 -1.144133 0.112788
C -2.942295 0.087916 0.370323
H 3.263793 0.665543 -1.154789
H 2.236408 -0.785099 -1.387425
H 1.926854 3.007527 -0.407331
H -0.508985 3.545985 0.138892
H 2.261764 -1.207025 1.096532
H 3.347292 0.186766 1.321945
H -2.952915 2.238707 0.544367
H -4.010965 -0.044769 0.567701
H 3.998787 -2.392290 -0.042211
H 5.051057 -1.050171 0.020502


