%chk=000095195.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095195

0 1
 O   -1.087800      -2.112600      -1.108500    
 O   -3.545900       1.263800      0.7667000    
 N   -1.244500      0.9407000      0.5331000    
 N   -2.627000     -0.6068000     -0.2593000    
 C  -0.3281000     -4.7300000E-02 -1.9400001E-02
 C   0.4897000     -0.6946000       1.110700    
 C   0.4321000      0.5212000      -1.224800    
 C    1.689100      -1.539100      0.6684000    
 C    1.331800       1.729000     -0.9625000    
 C    3.043300     -0.8392000      0.7993000    
 C    2.476000       1.549500      3.2800000E-02
 C    3.323200      0.2964000     -0.1858000    
 C   -1.363500      -1.064900     -0.5382000    
 C   -2.588200      0.6040000      0.3876000    
 H  -0.1799000      -1.354900       1.681900    
 H   0.8072000      5.9099998E-02   1.840600    
 H  -0.2997000      0.8354000      -1.984200    
 H    1.008500     -0.2683000      -1.720300    
 H    1.559100      -1.942300     -0.3410000    
 H    1.728800      -2.415500       1.329600    
 H   0.7202000       2.581000     -0.6412000    
 H    1.766500       2.027200      -1.926100    
 H    3.821500      -1.599700      0.6526000    
 H    3.171400     -0.4748000       1.826300    
 H    2.106800       1.607600       1.061100    
 H    3.130600       2.424300     -8.0799997E-02
 H    4.374100      0.5819000     -4.2500000E-02
 H    3.253700     -6.2799998E-02  -1.218500    
 H  -0.9364000       1.795000      0.9872000    
 H   -3.479600      -1.098800     -0.5008000    


%chk=000095195-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095195

0 1
O -0.997792 -2.152226 -1.195180
O -3.717199 1.164025 0.769259
N -1.353075 0.957938 0.523315
N -2.629484 -0.694058 -0.280914
C -0.374065 -0.013492 -0.021133
C 0.478623 -0.628350 1.139874
C 0.439770 0.571537 -1.209411
C 1.658470 -1.546244 0.709896
C 1.353610 1.786013 -0.922104
C 3.065556 -0.897414 0.769509
C 2.572120 1.573165 0.019356
C 3.380263 0.263559 -0.211304
C -1.331127 -1.106626 -0.586018
C -2.677773 0.572026 0.394382
H -0.221263 -1.193783 1.784896
H 0.856525 0.201324 1.765853
H -0.288657 0.872036 -1.988756
H 1.026283 -0.255997 -1.647511
H 1.462897 -1.966120 -0.294458
H 1.675075 -2.419180 1.391244
H 0.743980 2.634016 -0.546212
H 1.739976 2.116203 -1.907398
H 3.811512 -1.700105 0.597688
H 3.241648 -0.532920 1.803872
H 2.258958 1.622436 1.080002
H 3.242505 2.443156 -0.126136
H 4.459060 0.492005 -0.105052
H 3.249977 -0.082096 -1.256733
H -1.097075 1.824694 0.991673
H -3.476299 -1.211022 -0.518500


