%chk=000096520.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096520

0 1
 O   0.8810000      -1.371900      0.6377000    
 O   -2.253000       1.245700     -9.3699999E-02
 N   3.5200000E-02  0.7535000      0.1044000    
 N    2.293600      0.1811000     -0.3204000    
 N   -1.576600     -0.9619000     -9.1100000E-02
 C    1.063000     -0.2449000      0.1699000    
 C   -1.347800      0.4100000     -3.4600001E-02
 C   0.3371000       2.179500      0.1755000    
 C    3.466000     -0.6624000     -0.3235000    
 C   -2.898500      -1.528600     -0.2241000    
 H    1.269900       2.348000      0.7208000    
 H  -0.4684000       2.724000      0.6763000    
 H   0.4380000       2.558800     -0.8459000    
 H    2.359400       1.079800     -0.7863000    
 H  -0.7999000      -1.610600     -0.1257000    
 H    3.488200      -1.283800      0.5754000    
 H    4.352600     -2.5699999E-02 -0.3618000    
 H    3.429500      -1.301600      -1.209200    
 H   -2.883100      -2.545300      0.1750000    
 H   -3.159100      -1.551100      -1.285200    
 H   -3.628300     -0.9231000      0.3193000    


%chk=000096520-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096520

0 1
O 0.917925 -1.527424 -0.209041
O -2.232314 1.239699 0.089167
N 0.053092 0.677952 -0.063929
N 2.384670 0.272789 -0.204347
N -1.642452 -1.020061 -0.047910
C 1.106283 -0.260334 -0.161592
C -1.363457 0.318682 -0.001651
C 0.339230 2.126416 -0.016218
C 3.566255 -0.591563 -0.307628
C -3.021045 -1.511311 0.007358
H 0.939693 2.391170 0.875084
H -0.633479 2.636742 0.053675
H 0.850675 2.467610 -0.936505
H 2.520868 1.280944 -0.165161
H -0.828387 -1.657965 -0.122708
H 3.216415 -1.634925 -0.333064
H 4.234614 -0.459514 0.563260
H 4.134533 -0.382496 -1.232906
H -3.167135 -2.176569 0.878726
H -3.277794 -2.071652 -0.911101
H -3.699390 -0.648690 0.099289


