%chk=000019980.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019980

1 1
 Cl   5.513000      -1.645200      0.5653000    
 O    1.633600     -0.8591000       1.218400    
 O   -2.940600      -1.860000      0.2841000    
 N  -0.2889000      -2.196500     -0.3482000    
 N    2.977300     -0.5692000     -0.6874000    
 N   -2.961300      0.4093000     -0.3255000    
 C    1.173300      -2.128400     -0.7648000    
 C  -0.9351000     -0.8319000     -0.5389000    
 C   -1.013300      -3.225000      -1.204900    
 C  -0.3805000      -2.601000       1.116200    
 C    1.938700      -1.117800      5.8899999E-02
 C   -2.392700     -0.8468000     -0.1377000    
 C    3.915100      0.4064000     -0.2732000    
 C   -4.297300      0.7984000     -6.7599997E-02
 C    3.615600       1.747700     -0.4645000    
 C    5.110400      1.6300000E-02  0.3131000    
 C    4.531100       2.719500     -6.0699999E-02
 C   -4.683000       2.104600     -0.3196000    
 C   -5.191100     -0.1351000      0.4305000    
 C    2.333400       2.187800      -1.094100    
 C    6.026000      0.9883000      0.7167000    
 C    5.736300       2.339900      0.5298000    
 C   -5.999900       2.488400     -6.5899998E-02
 C   -6.507900      0.2487000      0.6841000    
 C   -6.912200       1.560500      0.4359000    
 H    1.192300      -1.870700      -1.830200    
 H    1.619500      -3.119700     -0.6252000    
 H  -0.4117000     -8.9199997E-02  7.0500001E-02
 H  -0.8440000     -0.5635000      -1.598000    
 H   -1.108000      -2.828700      -2.220500    
 H   -1.987600      -3.496800     -0.8007000    
 H  -0.3973000      -4.130600      -1.225900    
 H   0.4830000      -3.223800       1.372000    
 H   -1.274600      -3.210700       1.278100    
 H  -0.4372000      -1.719100       1.760300    
 H    3.230100      -1.043800      -1.551600    
 H   -2.359800       1.145200     -0.6898000    
 H    4.321400       3.777100     -0.1977000    
 H   -3.980300       2.835300     -0.7105000    
 H   -4.955200      -1.166200      0.6483000    
 H    2.311000       3.270600      -1.259600    
 H    2.198900       1.711300      -2.071000    
 H    1.485500       1.935900     -0.4488000    
 H    6.969700      0.7096000       1.178500    
 H    6.449000       3.096600      0.8444000    
 H   -6.314800       3.509700     -0.2592000    
 H   -7.219700     -0.4728000       1.074900    
 H   -7.937500       1.859200      0.6334000    


%chk=000019980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019980

1 1
Cl 4.429152 -1.632627 1.875610
O 1.090133 0.647479 -0.622048
O -3.169805 -2.088876 -0.067262
N -0.325995 -1.979473 -0.762259
N 3.075500 -0.600977 -0.579817
N -3.285726 0.248546 -0.318715
C 1.041137 -1.680644 -1.414388
C -1.343415 -0.905149 -1.224702
C -0.775873 -3.370034 -1.241111
C -0.188320 -1.993365 0.765488
C 1.733252 -0.429440 -0.822712
C -2.686490 -0.979498 -0.463631
C 3.955027 0.387132 -0.010380
C -4.588984 0.554034 0.203896
C 4.157270 1.664738 -0.608559
C 4.682040 0.033801 1.155485
C 5.060577 2.552981 0.028867
C -4.954408 1.925516 0.230673
C -5.488122 -0.439416 0.669249
C 3.464893 2.063162 -1.894080
C 5.585167 0.910316 1.771753
C 5.761339 2.190821 1.198209
C -6.218975 2.305767 0.720901
C -6.752135 -0.039593 1.154641
C -7.124995 1.323223 1.184699
H 0.856840 -1.526711 -2.492379
H 1.650849 -2.592032 -1.292457
H -0.827553 0.062850 -1.096921
H -1.517269 -1.091973 -2.300361
H -0.752209 -3.389305 -2.342202
H -1.799854 -3.529785 -0.872611
H -0.084257 -4.122778 -0.831744
H 0.638268 -2.669716 1.034116
H -1.133597 -2.358086 1.189586
H 0.026387 -0.973493 1.115527
H 3.453375 -1.554564 -0.610618
H -2.752334 1.067374 -0.627976
H 5.226149 3.539911 -0.415185
H -4.257128 2.693088 -0.130551
H -5.201857 -1.491803 0.652245
H 3.960296 2.936024 -2.348774
H 3.475975 1.242041 -2.634559
H 2.407129 2.321811 -1.704696
H 6.127808 0.608832 2.671273
H 6.457254 2.895982 1.662637
H -6.496391 3.364404 0.739381
H -7.449384 -0.803786 1.513371
H -8.108041 1.617991 1.564787


