%chk=000054550.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054550

0 1
 Cl   5.109500      -2.641000      0.3203000    
 O    1.371300       1.752000     -0.3258000    
 O   -4.272800     -0.7870000     -0.2194000    
 O   -2.038200      0.8168000      0.3251000    
 O   -1.233400       2.874400     -0.2897000    
 N   0.4663000     -0.2347000      0.2831000    
 C    1.827000     -0.3717000      0.1516000    
 C    2.384400      0.8425000     -0.2211000    
 C   -4.335500      0.2560000      0.7458000    
 C   -3.365800       1.353600      0.3520000    
 C   0.2597000       1.030500     -9.4999997E-03
 C    2.669400      -1.478800      0.3268000    
 C    3.739500       1.057600     -0.4401000    
 C   -5.147900      -1.856000      0.1117000    
 C   -1.007100       1.674200     -1.5900001E-02
 C    4.044300      -1.300700      0.1147000    
 C    4.566100     -5.6800000E-02 -0.2611000    
 C   -5.036700      -2.930800     -0.9485000    
 H   -5.353700      0.6570000      0.7947000    
 H   -4.056100     -0.1490000       1.725300    
 H   -3.413400       2.174700       1.075200    
 H   -3.609900       1.725500     -0.6495000    
 H    2.261200      -2.441600      0.6181000    
 H    4.132800       2.023700     -0.7305000    
 H   -4.873300      -2.271800       1.087700    
 H   -6.179500      -1.489600      0.1588000    
 H    5.636100      6.1200000E-02 -0.4213000    
 H   -5.699100      -3.771500     -0.7241000    
 H   -5.296700      -2.529200      -1.933500    
 H   -4.008000      -3.300000      -1.016900    


%chk=000054550-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054550

0 1
Cl 5.542815 -2.340922 0.874661
O 1.324648 1.573193 -0.665126
O -4.521898 -0.686219 -0.268094
O -2.023941 0.759855 0.561222
O -1.286902 2.623528 -0.652373
N 0.640731 -0.219222 0.648928
C 2.029924 -0.329012 0.398632
C 2.449510 0.770114 -0.408147
C -4.344844 0.155943 0.912846
C -3.417705 1.296827 0.534381
C 0.266523 0.887762 0.020345
C 2.958502 -1.308710 0.814311
C 3.770385 0.956175 -0.836420
C -5.266426 -1.921588 0.023461
C -1.069571 1.532868 -0.076181
C 4.282255 -1.120514 0.383744
C 4.699149 -0.023809 -0.420723
C -5.385500 -2.702062 -1.284540
H -5.323392 0.574576 1.242304
H -3.910005 -0.422286 1.756693
H -3.473501 2.128389 1.260377
H -3.643776 1.678454 -0.475966
H 2.657944 -2.157791 1.431473
H 4.072799 1.804467 -1.454439
H -4.721084 -2.511729 0.793134
H -6.271619 -1.669162 0.431193
H 5.748514 0.056102 -0.717163
H -5.932498 -3.648386 -1.121210
H -5.926815 -2.108735 -2.041381
H -4.383724 -2.938605 -1.681941


