%chk=000126632.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126632

0 1
 O    1.425900      0.1245000      0.2191000    
 O   0.5431000      -1.736400     -0.8522000    
 O  -0.3945000       2.458000      -1.558800    
 N  -0.8189000      5.3599998E-02 -0.3210000    
 N  -0.9327000       1.267000      0.3357000    
 N   -6.224200      -3.108300      0.1035000    
 N  -0.8304000       3.618600      0.4069000    
 C   -2.866700      -1.234300      0.1993000    
 C   -2.075100     -0.4459000     -0.8403000    
 C   -4.186700      -1.778500     -0.3607000    
 C   -4.966200      -2.618300      0.6536000    
 C   0.3924000     -0.6186000     -0.3617000    
 C  -0.7011000       2.447500     -0.3627000    
 C    2.667600     -0.5174000      0.1995000    
 C  -0.6093000       4.942600     -0.1590000    
 C   -1.194400       3.579400       1.820600    
 C    3.529500     -0.3365000     -0.8825000    
 C    3.044800      -1.339300       1.261600    
 C    4.768200     -0.9777000     -0.9023000    
 C    4.283500      -1.980300       1.241600    
 C    5.145100      -1.799500      0.1597000    
 H   -2.255800      -2.068100      0.5675000    
 H   -3.076500     -0.5965000       1.067000    
 H   -1.850300      -1.099800      -1.691300    
 H   -2.667900      0.3930000      -1.224900    
 H   -3.975100      -2.387600      -1.248800    
 H   -4.807800     -0.9371000     -0.6934000    
 H   -5.181100      -2.016300       1.543100    
 H   -4.357800      -3.471400      0.9739000    
 H   -1.172600       1.212500       1.318400    
 H   -6.037700      -3.691700     -0.7112000    
 H   -6.681300      -3.709600      0.7877000    
 H   0.2020000       5.429600      0.3897000    
 H  -0.3387000       4.880400      -1.216000    
 H   -1.528400       5.526900     -5.9200000E-02
 H   -1.269000       4.592300       2.226800    
 H   -2.160600       3.078500       1.931800    
 H  -0.4283000       3.027100       2.372900    
 H    3.241200      0.3029000      -1.712300    
 H    2.377900      -1.483600       2.107200    
 H    5.439000     -0.8369000      -1.744700    
 H    4.577100      -2.620300       2.068500    
 H    6.109500      -2.298600      0.1442000    


%chk=000126632-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126632

0 1
O 1.389313 -0.285608 0.462577
O 0.597777 -1.969643 -1.014189
O -0.488980 1.962837 -1.351626
N -0.848105 -0.401609 -0.025688
N -0.947350 0.824417 0.653755
N -6.777965 -2.592414 -0.355502
N -0.686042 3.181159 0.649163
C -3.172190 -1.326830 0.236113
C -2.060557 -0.878112 -0.731285
C -4.448947 -1.748787 -0.524737
C -5.580732 -2.205202 0.418114
C 0.393997 -0.967331 -0.295449
C -0.673617 2.008038 -0.099377
C 2.769800 -0.559971 0.231001
C -0.329066 4.443051 -0.017963
C -0.977870 3.216899 2.089232
C 3.308239 -0.680194 -1.068158
C 3.587479 -0.611665 1.378558
C 4.701978 -0.863371 -1.206728
C 4.980411 -0.788255 1.222560
C 5.541547 -0.916913 -0.069299
H -2.801370 -2.169031 0.853773
H -3.411212 -0.494260 0.927700
H -1.738287 -1.714577 -1.373699
H -2.416669 -0.060823 -1.387014
H -4.203770 -2.574012 -1.226833
H -4.827974 -0.910617 -1.140761
H -5.859610 -1.360700 1.078313
H -5.186900 -3.015147 1.082429
H -0.692473 0.780390 1.642712
H -6.612362 -3.363104 -1.011256
H -7.618767 -2.746970 0.209021
H 0.584286 4.882900 0.427398
H -0.142811 4.228365 -1.081066
H -1.154798 5.175699 0.062588
H -1.285868 4.239020 2.366919
H -1.815900 2.540861 2.338234
H -0.098012 2.950679 2.712280
H 2.655796 -0.640547 -1.943621
H 3.130495 -0.515088 2.368242
H 5.130927 -0.961794 -2.209902
H 5.622689 -0.828474 2.109147
H 6.621169 -1.057368 -0.188875


