%chk=000033398.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033398

0 1
 Cl  0.8195000      -3.535600       1.276200    
 Cl  -1.667200      -3.525200     -0.1808000    
 Cl  0.8098000      -3.262100      -1.637600    
 O    4.669100       2.632200     -0.7799000    
 O   -4.601300       2.657900     -0.8291000    
 N    2.344100       1.352200      0.2373000    
 N   -2.345500       1.384800      0.2709000    
 N  -6.0000003E-04   1.399900      0.2586000    
 N   -1.215900     -0.6614000      8.0600001E-02
 N    1.183500     -0.6780000      6.3500002E-02
 C    3.639300      0.6923000      0.1673000    
 C   -3.622200      0.7440000      0.2194000    
 C    1.144300      0.6735000      0.1858000    
 C   -1.128100      0.6732000      0.2005000    
 C  -2.0800000E-02  -1.270300      1.7899999E-02
 C    4.765600       1.705600      0.2938000    
 C   -4.741200       1.771800      0.2736000    
 C  -3.2200001E-02  -2.754900     -0.1179000    
 H    3.723200      0.1749000     -0.7957000    
 H    3.728700     -4.8000000E-02  0.9703000    
 H   -3.735700      4.7100000E-02   1.057500    
 H   -3.708000      0.1734000     -0.7133000    
 H    2.304600       2.361400      0.3220000    
 H   -2.277100       2.392000      0.3609000    
 H    5.738000       1.206600      0.2410000    
 H    4.695600       2.257500       1.236800    
 H   -4.692200       2.364000       1.192900    
 H   -5.723000       1.291800      0.2196000    
 H    5.400600       3.264600     -0.6770000    
 H   -4.671200       2.128800      -1.641900    


%chk=000033398-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000033398

0 1
Cl 1.052487 -3.079103 1.998504
Cl -1.607853 -3.531560 0.655358
Cl 0.925387 -3.686526 -0.971177
O 4.611261 2.893989 0.030642
O -4.635799 2.996009 -0.139783
N 2.357290 1.328618 -0.467490
N -2.314570 1.337240 -0.311048
N 0.021802 1.386216 -0.396175
N -1.183583 -0.697836 0.044974
N 1.238978 -0.701671 -0.032421
C 3.689975 0.723529 -0.379511
C -3.636332 0.720478 -0.166042
C 1.182466 0.657641 -0.295607
C -1.129189 0.666716 -0.221533
C 0.029016 -1.287924 0.126116
C 4.575861 1.522862 0.578765
C -4.581886 1.693117 0.555188
C 0.071509 -2.794543 0.431398
H 4.166808 0.712711 -1.379130
H 3.571791 -0.316924 -0.037260
H -3.521327 -0.221236 0.396644
H -4.054410 0.459065 -1.162620
H 2.304217 2.336296 -0.634460
H -2.276993 2.340977 -0.509051
H 5.591600 1.077548 0.605159
H 4.141082 1.515971 1.599133
H -4.196699 1.935169 1.558440
H -5.591297 1.244591 0.650659
H 5.122795 3.489364 0.631823
H -5.140687 2.893216 -0.986296


