%chk=000078580.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078580

0 1
 O   -2.260600       1.038600       1.150600    
 O    2.074400       1.374200       1.122600    
 O   0.1959000      -2.472700       1.130100    
 N  -7.7000000E-03  6.6000000E-03 -5.5999998E-03
 N   -3.479500      0.5660000     -0.7385000    
 N    2.222900       2.728200     -0.7275000    
 N    1.261700      -3.272200     -0.7413000    
 C   -1.308100     -0.4579000     -0.4871000    
 C   0.2418000       1.377500     -0.4493000    
 C    1.056600     -0.8826000     -0.4700000    
 C   -2.371300      0.4593000      7.2300002E-02
 C    1.594000       1.802700      7.5499997E-02
 C   0.7799000      -2.267600      6.8200000E-02
 H   -1.350100     -0.4584000      -1.583900    
 H   -1.580400      -1.459900     -0.1420000    
 H   0.2263000       1.450500      -1.544400    
 H  -0.4687000       2.108900     -5.2400000E-02
 H    1.102000     -0.9079000      -1.566500    
 H    2.055200     -0.6308000     -0.1018000    
 H   -4.265400       1.149700     -0.4720000    
 H   -3.559200      7.1099997E-02  -1.621000    
 H    3.136200       3.095700     -0.4817000    
 H    1.806400       3.080200      -1.583400    
 H    1.142500      -4.247500     -0.4880000    
 H    1.752200      -3.084700      -1.610000    


%chk=000078580-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078580

0 1
O -1.731595 2.051015 0.116549
O 2.634752 0.479102 0.108662
O -0.906657 -2.516216 0.095200
N -0.002588 0.011614 -1.737946
N -2.350715 -0.125338 0.667944
N 1.067128 2.108294 0.668471
N 1.291078 -1.976924 0.647345
C -1.434520 0.312764 -1.602359
C 0.975342 1.100361 -1.602478
C 0.452503 -1.380696 -1.615980
C -1.863242 0.816725 -0.199146
C 1.633155 1.214388 -0.201698
C 0.230024 -2.016179 -0.218487
H -1.707493 1.122787 -2.306015
H -2.000124 -0.595835 -1.874458
H 1.809729 0.934905 -2.311107
H 0.469884 2.045889 -1.866952
H -0.112033 -2.015215 -2.326178
H 1.522502 -1.413933 -1.886724
H -2.607645 0.170225 1.611525
H -2.231676 -1.129879 0.467274
H 1.455033 2.182278 1.610655
H 0.138273 2.509913 0.470322
H 1.163089 -2.350798 1.589440
H 2.102795 -1.372247 0.449039


