%chk=000108713.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108713

0 1
 O    3.619000      0.3786000       0.000000    
 O  -0.9760000       2.953200      7.9999998E-04
 O   -3.307900      -1.030500     -1.9999999E-04
 N    1.550500     -0.8336000      1.9999999E-04
 N  -0.9619000      -1.134600     -9.9999997E-05
 N    1.495400       1.417700     -6.9999998E-04
 N   -2.137400      0.9415000      1.9999999E-04
 C   0.2223000     -0.4163000     -9.9999997E-05
 C   0.2250000      0.9243000     -3.9999999E-04
 C    2.398400      0.3257000     -1.9999999E-04
 C  -0.9919000       1.728400     -3.0000001E-04
 C   -2.211900     -0.4637000      1.9999999E-04
 C    1.999900      -2.201400      7.9999998E-04
 C  -0.9236000      -2.589300     -3.9999999E-04
 H    1.738700       2.400500     -8.9999998E-04
 H    3.094800      -2.215900      1.1000000E-03
 H    1.668400      -2.710600     -0.9059000    
 H    1.667800      -2.709900      0.9077000    
 H   -3.025000       1.436800      5.0000002E-04
 H  -0.4385000      -2.951400      0.9082000    
 H  -0.4380000      -2.951000     -0.9089000    
 H   -1.938900      -2.998600     -7.9999998E-04


%chk=000108713-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108713

0 1
O 3.662714 0.274187 0.000086
O -1.083643 3.046061 -0.000244
O -3.337828 -1.071826 -0.000025
N 1.526014 -0.841585 0.000140
N -0.981211 -1.147648 0.000003
N 1.542831 1.410260 -0.000072
N -2.154850 0.942533 -0.000098
C 0.199077 -0.408261 0.000028
C 0.202915 0.988587 -0.000032
C 2.406097 0.314827 0.000123
C -0.993802 1.781336 0.000094
C -2.234274 -0.458428 -0.000216
C 2.118634 -2.184966 0.000338
C -1.030017 -2.625940 -0.000040
H 1.850259 2.380650 -0.000104
H 3.211096 -2.032599 0.000610
H 1.840776 -2.754272 -0.902051
H 1.840300 -2.754199 0.902623
H -3.060950 1.421095 -0.000183
H -0.550612 -3.037764 0.903222
H -0.549840 -3.037696 -0.902919
H -2.094486 -2.904450 -0.000483


