%chk=000063905.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063905

0 1
 Cl  -9.329800       1.574700      -1.367600    
 S    1.595200      -1.036700       1.454000    
 O  -0.2771000      -3.806100       1.569900    
 O    4.656400       2.488200     -0.6044000    
 N   -4.096700     -0.8657000      3.9099999E-02
 N   -1.546100      -2.088900      0.6528000    
 N    3.190400      0.8690000      0.2730000    
 N    3.837800      -1.430200      0.2064000    
 C   -2.887300     -4.6900000E-02  0.1549000    
 C   -3.990600      -2.300600      0.3176000    
 C   -1.640400     -0.8737000     -0.1593000    
 C   -2.794900      -2.587300       1.223200    
 C   -5.323500     -0.2942000     -0.2899000    
 C  -0.3568000      -2.778200      0.8930000    
 C   0.8891000      -2.194500      0.2732000    
 C   -6.324000      -1.033300     -0.9643000    
 C   -5.620900       1.050500      3.5700001E-02
 C   -7.552100     -0.4605000      -1.294700    
 C   -6.849100       1.623400     -0.2944000    
 C    2.998500     -0.4992000      0.5338000    
 C   -7.814800      0.8679000     -0.9596000    
 C    5.354500      0.2674000     -0.6890000    
 C    4.384500       1.322800     -0.3245000    
 C    5.028600      -1.064800     -0.4305000    
 C    2.190800       1.862600      0.5524000    
 C    6.567300      0.5989000      -1.304900    
 C    5.934200      -2.067400     -0.7970000    
 C    1.233800       2.160200     -0.4087000    
 C    2.194500       2.511800       1.780100    
 C    7.460300     -0.4096000      -1.664300    
 C    7.143900      -1.742300      -1.411800    
 C   0.2630000       3.124500     -0.1375000    
 C    1.223600       3.476000       2.051200    
 C   0.2579000       3.782300       1.092300    
 H   -2.821400      0.3581000       1.172200    
 H   -2.914800      0.7975000     -0.5447000    
 H   -3.881000      -2.845200     -0.6281000    
 H   -4.893100      -2.667900      0.8211000    
 H   -1.656800      -1.196900      -1.207400    
 H  -0.7616000     -0.2424000     -2.0500001E-02
 H   -2.920800      -2.090500       2.193000    
 H   -2.718500      -3.662900       1.415200    
 H   0.6987000      -1.728800     -0.6964000    
 H    1.589100      -3.018600      9.6100003E-02
 H   -6.149400      -2.067500      -1.252600    
 H   -4.897800       1.665700      0.5664000    
 H   -8.294200      -1.060000      -1.815600    
 H   -7.041300       2.658700     -2.4700001E-02
 H    6.832000       1.631500      -1.514700    
 H    5.702600      -3.111800     -0.6012000    
 H    1.229100       1.651200      -1.368700    
 H    2.943200       2.279900       2.532500    
 H    8.401800     -0.1561000      -2.142700    
 H    7.839200      -2.528400      -1.691400    
 H  -0.4900000       3.361500     -0.8834000    
 H    1.219400       3.988000       3.009000    
 H  -0.4985000       4.532400       1.303700    


%chk=000063905-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063905

0 1
Cl -7.875828 -0.381423 -4.671826
S 1.305830 0.050469 2.447089
O -1.101396 -2.247990 3.846151
O 4.331518 2.695044 -0.675431
N -3.647376 -1.296011 -0.407492
N -1.615968 -1.720746 1.643363
N 2.933777 1.369256 0.674152
N 2.245690 -0.838194 0.012392
C -2.362685 -0.571552 -0.429016
C -3.848907 -2.269871 0.683519
C -1.254302 -1.403034 0.244241
C -3.062243 -1.863133 1.940255
C -4.622851 -1.084988 -1.391729
C -0.714095 -1.932383 2.674173
C 0.776303 -1.783638 2.372205
C -5.727965 -1.981188 -1.542864
C -4.548227 0.033593 -2.281039
C -6.711456 -1.766400 -2.529213
C -5.526767 0.242508 -3.273710
C 2.247392 0.162639 0.867423
C -6.602219 -0.657537 -3.388501
C 3.726412 0.474639 -1.471721
C 3.723635 1.602580 -0.519998
C 2.985318 -0.714211 -1.176273
C 2.868081 2.442502 1.662667
C 4.461837 0.573378 -2.681327
C 2.994323 -1.790029 -2.105347
C 1.843302 3.408130 1.563749
C 3.836425 2.507705 2.687528
C 4.462571 -0.495744 -3.592420
C 3.725860 -1.678339 -3.299768
C 1.779409 4.448035 2.516556
C 3.766265 3.550423 3.636623
C 2.738149 4.518467 3.553694
H -2.438343 0.420900 0.067158
H -2.058243 -0.396225 -1.478037
H -3.562251 -3.299344 0.374750
H -4.920005 -2.295435 0.957120
H -1.100533 -2.336447 -0.336301
H -0.309662 -0.836926 0.212126
H -3.458186 -0.909017 2.342032
H -3.176218 -2.621050 2.734046
H 1.100470 -2.131113 1.375589
H 1.333837 -2.295846 3.168010
H -5.814578 -2.870289 -0.911963
H -3.742167 0.767041 -2.186843
H -7.546031 -2.466393 -2.632461
H -5.455189 1.107394 -3.940047
H 5.017699 1.496617 -2.874919
H 2.426205 -2.693219 -1.862786
H 1.114436 3.347458 0.749021
H 4.629165 1.754416 2.735776
H 5.028745 -0.422256 -4.526485
H 3.730536 -2.510402 -4.012386
H 0.987366 5.201036 2.447617
H 4.512026 3.607539 4.436380
H 2.687205 5.326206 4.291802


