%chk=000169326.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169326

1 1
 Cl   7.996400      0.9746000       1.974700    
 S   -1.519800       2.696600      0.3735000    
 O    3.032700      0.3311000      0.6254000    
 N   -3.428500       1.144900     -0.6469000    
 N    3.482000      -1.014300      -1.149500    
 C   -4.114700      5.0999999E-02  -1.313900    
 C   -4.032200       2.341800     -0.2345000    
 C   -2.049900       1.184500     -0.4105000    
 C    4.680900     -0.6677000     -0.5654000    
 C   -4.667300     -0.8823000     -0.2783000    
 C    2.584600     -0.4111000     -0.4208000    
 C    4.403100      0.1592000      0.5252000    
 C   -3.184600       3.236500      0.3123000    
 C   -1.127900      0.2556000     -0.7068000    
 C    1.186600     -0.5283000     -0.7144000    
 C   -5.494400       2.590900     -0.4051000    
 C    5.991200      -1.005700     -0.8957000    
 C    3.296700      -1.851500      -2.298300    
 C   0.2773000      0.4120000     -0.4107000    
 C    5.386200      0.6961000       1.345700    
 C   -3.892100      -1.943700      0.1768000    
 C   -5.950300     -0.6789000      0.2189000    
 C    7.001000     -0.4745000     -8.0200002E-02
 C    6.704400      0.3556000       1.013000    
 C   -4.405900      -2.811800       1.140200    
 C   -6.463900      -1.547100       1.182400    
 C   -5.691600      -2.613400       1.642900    
 H   -3.453000     -0.4921000      -1.999900    
 H   -4.918500      0.4142000      -1.965200    
 H   -3.470600       4.211100      0.6845000    
 H   -1.412300     -0.6669000      -1.201800    
 H   0.8599000      -1.428600      -1.229600    
 H   -5.709300       3.664900     -0.3466000    
 H   -6.064700       2.117900      0.3968000    
 H   -5.865900       2.260200      -1.377900    
 H    6.242600      -1.645700      -1.733400    
 H    4.244100      -2.052700      -2.804300    
 H    2.859200      -2.805300      -1.988000    
 H    2.634400      -1.361000      -3.018700    
 H   0.6421000       1.303000      8.7700002E-02
 H    5.140500       1.335000       2.185500    
 H   -2.895000      -2.124100     -0.2106000    
 H   -6.590400      0.1078000     -0.1625000    
 H    8.035600     -0.7208000     -0.3125000    
 H   -3.806300      -3.644400       1.496200    
 H   -7.469900      -1.400600       1.564600    
 H   -6.093000      -3.291600       2.390400    


%chk=000169326-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169326

1 1
Cl 8.264376 1.765963 1.019369
S -1.490586 2.720842 0.988345
O 3.191637 0.640920 -0.013696
N -3.344829 1.376015 -0.289977
N 3.604102 -1.329224 -1.067104
C -4.055952 0.379224 -1.138240
C -4.044650 2.440710 0.348236
C -1.978337 1.335683 -0.067020
C 4.863568 -0.805535 -0.675770
C -4.771062 -0.714849 -0.346833
C 2.605298 -0.455849 -0.669335
C 4.598476 0.420272 -0.020162
C -3.209407 3.257957 1.063786
C -1.075281 0.359879 -0.553188
C 1.221492 -0.561334 -0.847604
C -5.531355 2.596730 0.195340
C 6.184139 -1.264361 -0.822562
C 3.365349 -2.590024 -1.783083
C 0.316224 0.418627 -0.380404
C 5.584676 1.246463 0.515771
C -4.198245 -1.286043 0.816899
C -6.018720 -1.196035 -0.815349
C 7.213116 -0.451445 -0.290054
C 6.907878 0.769363 0.359552
C -4.865688 -2.328123 1.498521
C -6.680946 -2.244132 -0.137858
C -6.105825 -2.812275 1.021819
H -3.314955 -0.052087 -1.832646
H -4.780045 0.927334 -1.765197
H -3.468745 4.144215 1.635906
H -1.493025 -0.499893 -1.089236
H 0.848836 -1.444179 -1.376411
H -5.884414 3.425186 0.828301
H -6.068144 1.680453 0.498410
H -5.814459 2.831369 -0.847717
H 6.431667 -2.204047 -1.323008
H 4.325366 -3.101280 -1.942586
H 2.711273 -3.253709 -1.191617
H 2.902618 -2.398442 -2.766777
H 0.750473 1.280859 0.146510
H 5.357406 2.189156 1.016953
H -3.239415 -0.919962 1.202506
H -6.475218 -0.756914 -1.711482
H 8.256053 -0.765994 -0.379760
H -4.419889 -2.761294 2.400227
H -7.644049 -2.609863 -0.508783
H -6.621284 -3.619930 1.551706


