%chk=000044135.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044135

0 1
 Cl  -5.794700      -1.978200      -1.108800    
 S   -1.033700      0.8087000       1.953000    
 N    5.079400      -1.326800      0.6733000    
 C    1.659000      -1.240200     -0.9649000    
 C    2.738300     -0.9314000      6.2500000E-02
 C   0.3517000     -0.5910000     -0.5814000    
 C    4.049800      -1.617700     -0.3174000    
 C   0.3537000      0.8947000     -0.4996000    
 C  -0.7301000      -1.363400     -0.3559000    
 C  -0.2079000       1.609600      0.5793000    
 C   -2.086600     -0.9331000      2.4700001E-02
 C   -2.346000     -1.8000000E-03   1.046300    
 C   0.9746000       1.629200      -1.528100    
 C  -0.1301000       3.011900      0.6139000    
 C    5.336200      0.1129000      0.7421000    
 C    6.314300      -2.048200      0.3606000    
 C   -3.169200      -1.549100     -0.6239000    
 C    1.039600       3.023300      -1.488700    
 C   -3.670800      0.3077000       1.388400    
 C   0.4902000       3.714200     -0.4166000    
 C   -4.483600      -1.229800     -0.2818000    
 C   -4.734000     -0.3015000      0.7231000    
 H    1.539800      -2.330100      -1.029800    
 H    1.974000     -0.9279000      -1.966900    
 H    2.871300      0.1529000      0.1088000    
 H    2.417700      -1.265000       1.058300    
 H    3.876300      -2.700600     -0.3576000    
 H    4.363200      -1.302600      -1.321600    
 H  -0.6353000      -2.442300     -0.4742000    
 H    1.407100       1.132400      -2.393100    
 H    4.523900      0.6508000       1.240000    
 H    6.221100      0.3127000       1.359300    
 H    5.515300      0.5558000     -0.2444000    
 H    6.735400      -1.747200     -0.6056000    
 H    7.069100      -1.875300       1.135800    
 H    6.133800      -3.128700      0.3371000    
 H  -0.5560000       3.574300       1.442300    
 H   -2.983400      -2.282700      -1.407400    
 H    1.520200       3.566600      -2.297000    
 H   -3.890700       1.026500       2.174700    
 H   0.5416000       4.798300     -0.3824000    
 H   -5.752000     -4.2500000E-02   1.002200    


%chk=000044135-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044135

0 1
Cl -5.838106 -2.464330 -0.896552
S -1.170801 0.995717 1.923202
N 5.194396 -1.439641 0.624498
C 1.658243 -1.106735 -0.955115
C 2.791491 -0.869945 0.079967
C 0.339750 -0.447440 -0.552977
C 4.119312 -1.497089 -0.392845
C 0.319898 1.045816 -0.515679
C -0.745162 -1.260575 -0.319260
C -0.340106 1.812287 0.488886
C -2.129897 -0.927745 0.064078
C -2.481292 0.077753 1.011355
C 0.998470 1.775137 -1.537756
C -0.325225 3.224931 0.469760
C 5.640080 -0.065072 0.928952
C 6.331249 -2.314992 0.273140
C -3.184683 -1.702681 -0.503088
C 1.021676 3.183626 -1.560530
C -3.830820 0.320594 1.350164
C 0.362181 3.918652 -0.549373
C -4.517240 -1.451358 -0.145095
C -4.869231 -0.446621 0.777169
H 1.498898 -2.194948 -1.077005
H 2.001939 -0.732574 -1.941713
H 2.910067 0.217789 0.240171
H 2.511297 -1.314476 1.052683
H 3.941754 -2.566180 -0.624886
H 4.433733 -1.006811 -1.355437
H -0.587099 -2.333069 -0.505248
H 1.502086 1.224758 -2.338736
H 4.803786 0.533304 1.326967
H 6.425913 -0.098088 1.704561
H 6.057106 0.469290 0.035776
H 6.860976 -2.005041 -0.664726
H 7.069421 -2.313424 1.095197
H 5.975196 -3.351937 0.136883
H -0.851565 3.771753 1.258429
H -2.947637 -2.488780 -1.226800
H 1.549022 3.705392 -2.366488
H -4.070166 1.104810 2.074797
H 0.377913 5.013683 -0.554316
H -5.914324 -0.270341 1.045591


