%chk=000117498.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117498

0 1
 O  -0.2858000      -1.450600      0.3306000    
 O    2.255800      0.7858000     -0.4872000    
 O  -0.3785000      -3.340200     -0.9810000    
 O    3.658200       1.583600       1.155000    
 N  -0.3883000      -3.480100       1.314000    
 N    4.489400      0.5874000     -0.7434000    
 C  -0.1695000      0.8596000     -0.4861000    
 C   -1.376100       1.351200      0.3403000    
 C   -2.724200       1.128800     -0.3518000    
 C  -0.2438000     -0.6375000     -0.8336000    
 C    1.126200       1.205500      0.2664000    
 C   -3.872900       1.709500      0.4745000    
 C   -5.217600       1.463700     -0.1910000    
 C  -0.3530000      -2.802000      0.1207000    
 C    3.480000       1.035300      7.2600000E-02
 H  -0.1544000       1.402800      -1.440800    
 H   -1.254600       2.423900      0.5390000    
 H   -1.385300      0.8520000       1.317700    
 H   -2.904400      5.7599999E-02 -0.4930000    
 H   -2.711100       1.593600      -1.344800    
 H   -1.127200     -0.8378000      -1.450500    
 H   0.6317000     -0.9191000      -1.431800    
 H    1.182900       2.289800      0.4222000    
 H    1.139900      0.7105000       1.245300    
 H   -3.728300       2.788000      0.6070000    
 H   -3.879100       1.257500       1.473300    
 H   -5.255700       1.928400      -1.181400    
 H   -5.408500      0.3920000     -0.3064000    
 H   -6.023800       1.888800      0.4150000    
 H  -0.3650000      -2.989000       2.201400    
 H  -0.4389000      -4.492700       1.345200    
 H    4.291000      0.1388000      -1.631400    
 H    5.464400      0.6910000     -0.4833000    


%chk=000117498-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117498

0 1
O -0.291671 -1.456154 0.399995
O 2.274997 0.883771 -0.568212
O -0.369044 -3.414686 -0.912119
O 3.747152 1.331904 1.220301
N -0.380891 -3.478055 1.436407
N 4.516866 0.727177 -0.915659
C -0.155593 0.827855 -0.438519
C -1.392414 1.282543 0.383441
C -2.742002 1.127434 -0.353393
C -0.207362 -0.651273 -0.849384
C 1.128641 1.146164 0.342247
C -3.925455 1.722651 0.443990
C -5.280227 1.553027 -0.276640
C -0.348293 -2.849118 0.209212
C 3.546880 1.009508 0.022994
H -0.129472 1.407595 -1.385141
H -1.257923 2.349710 0.656650
H -1.425942 0.711764 1.331984
H -2.947953 0.055983 -0.548064
H -2.684829 1.623551 -1.345357
H -1.086005 -0.877775 -1.477808
H 0.704017 -0.944122 -1.398247
H 1.159627 2.206463 0.652935
H 1.228414 0.510128 1.239039
H -3.735713 2.799564 0.630282
H -3.971475 1.238260 1.440695
H -5.270239 2.054203 -1.263030
H -5.507303 0.483727 -0.447043
H -6.109618 1.984823 0.313013
H -0.342385 -2.937683 2.296909
H -0.422963 -4.492591 1.460647
H 4.259616 0.464333 -1.863676
H 5.492061 0.775420 -0.635747


