%chk=000050326.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050326

0 1
 Cl -0.9695000      -4.806300      -1.095700    
 S   -1.487300      0.7035000      -2.095200    
 S   0.8898000      0.4740000       1.824000    
 N   -4.227500       1.900200      0.6333000    
 C   0.1899000      0.2292000      -1.479100    
 C   0.8729000       1.541500      -1.056200    
 C   7.1199998E-02 -0.9479000     -0.5125000    
 C    2.234800       1.338200     -0.4407000    
 C   0.3026000     -0.9316000      0.8797000    
 C    2.351900      0.8700000      0.8783000    
 C   -2.214800       1.099600     -0.4941000    
 C   -3.649200       1.582200     -0.6689000    
 C  -0.3117000      -2.182400      -1.094200    
 C    3.395600       1.616100      -1.174600    
 C   0.1033000      -2.105000       1.636200    
 C    3.616500      0.7041000       1.453700    
 C  -0.4949000      -3.337900     -0.3352000    
 C  -0.2946000      -3.296500       1.034900    
 C    4.654100       1.442900     -0.5982000    
 C    4.764000      0.9906000      0.7147000    
 C   -4.198300      0.7277000       1.508400    
 C   -5.598800       2.387800      0.4814000    
 H   0.7471000     -0.1406000      -2.351200    
 H   0.2920000       2.154200     -0.3615000    
 H   0.9870000       2.182000      -1.943400    
 H   -2.201600      0.1791000      8.9000002E-02
 H   -1.650000       1.870500      3.2600001E-02
 H   -3.651700       2.485500      -1.292900    
 H   -4.249900      0.8221000      -1.187300    
 H  -0.4741000      -2.233700      -2.170800    
 H    3.328000       1.972600      -2.199300    
 H   0.2705000      -2.108200       2.712300    
 H    3.723700      0.3455000       2.474600    
 H  -0.4328000      -4.182300       1.649000    
 H    5.548800       1.663000      -1.173200    
 H    5.744500      0.8577000       1.162500    
 H   -3.189800      0.5169000       1.877800    
 H   -4.606800     -0.1684000       1.027100    
 H   -4.790200      0.9135000       2.413300    
 H   -6.012600       2.684300       1.451700    
 H   -6.259800       1.633300      3.9600000E-02
 H   -5.622100       3.281000     -0.1530000    


%chk=000050326-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000050326

0 1
Cl -1.935243 -4.143710 -1.605125
S -1.305247 1.462383 -2.367012
S 0.797208 0.649691 1.788912
N -4.250025 1.453066 0.624871
C 0.271481 0.635185 -1.603750
C 1.189206 1.759311 -1.059169
C -0.128620 -0.537498 -0.708171
C 2.468506 1.286051 -0.393637
C -0.006705 -0.628095 0.707265
C 2.432277 0.778476 0.930302
C -2.267597 1.956676 -0.805088
C -3.460600 1.015289 -0.550780
C -0.716941 -1.644847 -1.386479
C 3.728016 1.376788 -1.036686
C -0.507616 -1.758414 1.403268
C 3.606308 0.393492 1.609300
C -1.192804 -2.756542 -0.680949
C -1.115743 -2.831630 0.723584
C 4.913826 0.989973 -0.371369
C 4.855762 0.505978 0.955602
C -3.589000 1.159357 1.913424
C -5.639909 0.952206 0.594238
H 0.734649 0.214859 -2.515956
H 0.618383 2.368284 -0.333310
H 1.426084 2.414702 -1.915532
H -1.552295 1.959620 0.034153
H -2.620864 2.987986 -0.965120
H -4.121620 1.040637 -1.436921
H -3.093127 -0.035912 -0.451893
H -0.826673 -1.599409 -2.474504
H 3.776817 1.767923 -2.060006
H -0.394063 -1.804463 2.490928
H 3.542536 0.002373 2.629660
H -1.493814 -3.702158 1.266420
H 5.879087 1.071934 -0.882957
H 5.772179 0.209345 1.477074
H -2.595174 1.636895 1.958175
H -3.451740 0.061897 2.092658
H -4.194823 1.570496 2.740585
H -6.208359 1.386232 1.436756
H -5.713713 -0.162537 0.668605
H -6.129808 1.266111 -0.344464


