%chk=000045514.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045514

0 1
 Cl  -7.102100      -2.213900      0.9487000    
 O    3.472200      -2.679000      -1.101000    
 O    4.983500      -1.627600      0.9777000    
 N   0.1130000       2.417600     -0.3148000    
 C   0.2508000       1.011300     -0.7545000    
 C    1.525000      0.3240000     -0.2915000    
 C   0.4793000       2.587600       1.096700    
 C  -0.9835000      0.2153000     -0.3009000    
 C    1.911100       2.152800       1.417400    
 C    2.287800      0.8475000      0.7677000    
 C   0.8402000       3.340000      -1.187500    
 C   -2.261300      0.8738000     -0.8002000    
 C    1.939500     -0.8666000     -0.9097000    
 C    3.450900      0.1825000       1.181400    
 C    3.093500      -1.524500     -0.4851000    
 C   0.5259000       4.785700     -0.8418000    
 C    3.848500      -1.000500      0.5603000    
 C   -3.476000      9.7300000E-02 -0.3605000    
 C   -3.971000     -0.9119000      -1.173000    
 C   -4.080600      0.4054000      0.8494000    
 C   -5.096000      -1.629400     -0.7665000    
 C   -5.205600     -0.3122000       1.255800    
 C   -5.713300      -1.329600      0.4479000    
 C    2.964100      -3.897300     -0.5611000    
 C    6.204500      -1.248200      0.3452000    
 H   0.2509000      0.9925000      -1.854000    
 H  -0.2090000       1.987700       1.706600    
 H   0.3078000       3.609300       1.451600    
 H   -1.007500      0.1080000      0.7915000    
 H  -0.9287000     -0.8094000     -0.6934000    
 H    2.013300       2.063000       2.505700    
 H    2.617900       2.922200       1.083500    
 H    1.923800       3.177200      -1.174100    
 H   0.5119000       3.182600      -2.222700    
 H   -2.250400      0.9477000      -1.895500    
 H   -2.362300       1.902300     -0.4328000    
 H    1.357300      -1.283000      -1.729000    
 H    4.051300      0.5941000       1.989700    
 H  -0.5524000       4.954300     -0.7490000    
 H    1.015500       5.109400      8.1500001E-02
 H   0.8920000       5.441600      -1.639500    
 H   -3.496300      -1.154000      -2.119600    
 H   -3.691400       1.194500       1.486500    
 H   -5.480500      -2.419700      -1.406100    
 H   -5.676100     -6.7800000E-02   2.204800    
 H    3.358400      -4.726100      -1.155300    
 H    1.871000      -3.915100     -0.6172000    
 H    3.289500      -4.024500      0.4762000    
 H    6.413800     -0.1882000      0.5207000    
 H    6.160500      -1.449900     -0.7297000    
 H    7.013800      -1.841300      0.7795000    


%chk=000045514-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045514

0 1
Cl -7.260779 -2.407657 0.853553
O 3.362579 -2.706842 -1.131647
O 5.064920 -1.609899 0.994913
N 0.129798 2.546129 -0.202811
C 0.227748 1.132855 -0.672770
C 1.520585 0.422223 -0.226252
C 0.508115 2.657915 1.229784
C -1.032405 0.317054 -0.255525
C 1.983894 2.264680 1.496217
C 2.338452 0.946877 0.814288
C 0.815627 3.511870 -1.106001
C -2.333536 0.891241 -0.874949
C 1.890154 -0.798409 -0.841980
C 3.513352 0.247400 1.185152
C 3.046661 -1.501471 -0.456744
C 0.487098 4.979365 -0.775364
C 3.887116 -0.955490 0.556964
C -3.565364 0.101822 -0.465554
C -3.991690 -1.023426 -1.218374
C -4.299516 0.441045 0.700868
C -5.110481 -1.793178 -0.827968
C -5.421695 -0.313851 1.111890
C -5.808479 -1.423794 0.337271
C 3.365916 -3.908952 -0.265015
C 6.117942 -1.733699 -0.039793
H 0.224324 1.168198 -1.782284
H -0.159010 1.992330 1.808410
H 0.311210 3.686126 1.578221
H -1.123234 0.293724 0.847672
H -0.899679 -0.734482 -0.575028
H 2.165813 2.193443 2.586020
H 2.654925 3.065441 1.122155
H 1.925421 3.375313 -1.123997
H 0.458927 3.294227 -2.130880
H -2.230189 0.883769 -1.978857
H -2.413254 1.949258 -0.565073
H 1.275886 -1.233501 -1.639396
H 4.168928 0.638110 1.972142
H -0.606999 5.123597 -0.726478
H 0.922715 5.301772 0.187518
H 0.894484 5.643467 -1.559524
H -3.446466 -1.303229 -2.128114
H -3.996406 1.311420 1.295228
H -5.433597 -2.656536 -1.417005
H -5.983872 -0.042011 2.010210
H 3.664029 -4.741769 -0.920117
H 2.350831 -4.090190 0.137032
H 4.082292 -3.793981 0.568465
H 6.473636 -0.730121 -0.342025
H 5.741574 -2.278505 -0.924498
H 6.936201 -2.292177 0.440053


