%chk=000040933.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040933

0 1
 Cl   3.961000       4.310900       1.624600    
 O   -4.548400     -0.7196000       3.157900    
 O   -2.977300      0.8258000       2.591500    
 N   -2.318300     -0.6385000      0.2953000    
 C    1.142500     -0.3805000     -0.8401000    
 C  -0.3130000     -0.3124000     -0.5986000    
 C   -1.264300      0.4222000      -1.360300    
 C   -2.514300      0.2004000     -0.7784000    
 C  -0.9911000     -0.9539000      0.4121000    
 C    1.862700      0.8196000     -0.2105000    
 C    1.645800      -1.785000     -0.4800000    
 C   -3.353000      -1.125700       1.182100    
 C   -1.181700       1.257100      -2.492300    
 C   -3.690500      0.7741000      -1.274100    
 C    2.987100       1.307200     -0.8310000    
 C    1.352800       1.354700      0.9476000    
 C    1.612900      -2.759600      -1.447600    
 C    2.108100      -2.007600      0.7944000    
 C   -2.350000       1.837900      -2.999000    
 C   -3.584100       1.598700      -2.397700    
 C    3.642200       2.397300     -0.2581000    
 C    2.007700       2.444900       1.520500    
 C    2.070400      -4.036200      -1.120500    
 C    2.565700      -3.284100       1.121400    
 C   -3.572700     -0.2157000       2.359400    
 C    3.152600       2.966300      0.9176000    
 C    2.546800      -4.298300      0.1638000    
 H    1.293100     -0.2714000      -1.926000    
 H  -0.6572000      -1.599800       1.212800    
 H   -3.042500      -2.112200       1.543400    
 H   -4.280500      -1.233900      0.6128000    
 H  -0.2282000       1.456000      -2.973200    
 H   -4.655700      0.5982000     -0.8117000    
 H    3.374800      0.8674000      -1.744500    
 H   0.4841000      0.9725000       1.468700    
 H    1.241900      -2.564300      -2.448700    
 H    2.126700      -1.243800       1.563000    
 H   -2.292300       2.483400      -3.871400    
 H   -4.478600       2.061000      -2.807100    
 H    4.533600       2.792500     -0.7386000    
 H    1.618500       2.874900       2.439900    
 H    2.055000      -4.826000      -1.865800    
 H    2.934400      -3.489300       2.122100    
 H    2.902200      -5.292400      0.4188000    
 H   -4.714700     -0.1475000       3.937300    


%chk=000040933-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040933

0 1
Cl 4.293999 4.414223 1.174089
O -4.878416 -1.163015 2.937546
O -2.970012 0.168015 2.813711
N -2.513218 -0.815328 0.127855
C 1.089686 -0.448354 -0.923838
C -0.406899 -0.382659 -0.669667
C -1.337126 0.551825 -1.285784
C -2.646027 0.265402 -0.762406
C -1.157119 -1.185805 0.183277
C 1.849814 0.783067 -0.395965
C 1.690613 -1.768522 -0.405853
C -3.570676 -1.375140 0.944099
C -1.186589 1.601436 -2.228927
C -3.791551 0.992814 -1.151665
C 3.114889 1.103337 -0.952254
C 1.345979 1.594795 0.649064
C 1.686059 -2.913026 -1.243489
C 2.209886 -1.889994 0.907080
C -2.325812 2.328139 -2.626476
C -3.613765 2.027183 -2.093830
C 3.866314 2.202393 -0.484283
C 2.082547 2.700472 1.133861
C 2.191830 -4.149559 -0.785156
C 2.714759 -3.126706 1.370686
C -3.725745 -0.677940 2.303908
C 3.333877 2.985609 0.558608
C 2.708636 -4.261218 0.527047
H 1.229288 -0.452829 -2.026352
H -0.828850 -2.004028 0.821403
H -3.378097 -2.445935 1.140873
H -4.539375 -1.327097 0.416661
H -0.199120 1.851721 -2.632065
H -4.784914 0.780504 -0.740890
H 3.524747 0.482617 -1.758462
H 0.364354 1.372517 1.081350
H 1.280475 -2.832714 -2.259967
H 2.233837 -1.011869 1.562041
H -2.225553 3.143762 -3.350934
H -4.480128 2.614811 -2.417328
H 4.840336 2.445068 -0.918821
H 1.685753 3.326117 1.938600
H 2.186848 -5.021560 -1.449130
H 3.117694 -3.201914 2.387196
H 3.106656 -5.217731 0.884208
H -4.975686 -0.737587 3.832181


