%chk=000017332.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017332

0 1
 O   -6.482500     -0.7041000     -0.4412000    
 O    6.470000      0.7062000     -0.4782000    
 O   -5.658300       1.172800      0.3911000    
 O    5.679500      -1.178900      0.3683000    
 N   -4.337700     -0.5829000      4.0000002E-03
 N    4.342100      0.5752000      3.5999998E-02
 N   -5.569000      1.2500000E-02 -2.2900000E-02
 N    5.572900     -1.6200000E-02 -3.5100002E-02
 C  -0.6641000      0.4220000      2.0300001E-02
 C   0.6355000     -0.3854000      5.5399999E-02
 C   -1.888400     -0.4972000      3.7200000E-02
 C    1.894100      0.4880000      7.1199998E-02
 C   -3.184500      0.3085000     -3.4100000E-02
 C    3.190300     -0.3207000      2.8000001E-02
 H  -0.6986000       1.098300      0.8829000    
 H  -0.6815000       1.045800     -0.8815000    
 H   0.6698000      -1.047500     -0.8188000    
 H   0.6392000      -1.031500      0.9420000    
 H   -1.876500      -1.103700      0.9517000    
 H   -1.836100      -1.190900     -0.8114000    
 H    1.880900       1.115400      0.9718000    
 H    1.861500       1.169200     -0.7890000    
 H   -3.195500      0.9011000     -0.9575000    
 H   -3.204700       1.003500      0.8148000    
 H    3.212800     -0.9887000      0.8979000    
 H    3.197800     -0.9403000     -0.8774000    
 H   -4.309500      -1.320100     -0.6963000    
 H    4.290600       1.314000     -0.6614000    


%chk=000017332-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017332

0 1
O -6.635326 -0.849061 -0.039642
O 6.631697 0.851116 -0.021610
O -5.782861 1.298692 -0.081287
O 5.779273 -1.297013 -0.010740
N -4.377334 -0.505410 -0.040897
N 4.373722 0.507210 -0.036851
N -5.669632 0.011083 -0.054557
N 5.666078 -0.009266 -0.022033
C -0.654089 0.414470 -0.042124
C 0.650569 -0.412847 -0.032842
C -1.918796 -0.474026 -0.036218
C 1.915248 0.475668 -0.038239
C -3.204587 0.376252 -0.047170
C 3.201091 -0.374573 -0.029008
H -0.670662 1.085504 0.840761
H -0.667951 1.069311 -0.937101
H 0.667270 -1.083089 -0.916280
H 0.664300 -1.068490 0.861590
H -1.906607 -1.122472 0.862986
H -1.903980 -1.139607 -0.922546
H 1.900050 1.140247 0.848996
H 1.903394 1.125134 -0.936562
H -3.237692 1.024094 -0.943947
H -3.239628 1.044344 0.835097
H 3.234296 -1.024635 0.866598
H 3.236031 -1.040501 -0.912476
H -4.339760 -1.526144 -0.010060
H 4.335986 1.528408 -0.036037


