%chk=000029120.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029120

0 1
 Cl   3.520000     -0.8785000      -1.887600    
 S  -0.4291000       2.290200      0.1332000    
 N   -3.259900      0.2280000      0.1806000    
 N   -1.515600     -0.9772000     -0.6148000    
 N   -3.328400      -1.081400      0.4596000    
 N   -2.316000      -1.834200      7.1999999E-03
 C   -1.530900       1.470100      -1.053300    
 C   0.8381000       1.057800      0.3624000    
 C   -2.118500      0.2211000     -0.4826000    
 C    1.594300      0.6230000     -0.7261000    
 C    1.073500      0.5285000       1.631300    
 C    2.586000     -0.3413000     -0.5455000    
 C    2.065100     -0.4357000       1.811900    
 C    2.821400     -0.8705000      0.7235000    
 H  -0.9909000       1.246600      -1.979000    
 H   -2.329500       2.172900      -1.314600    
 H    1.423600       1.036400      -1.717800    
 H   0.4935000      0.8543000       2.491200    
 H    2.248100     -0.8482000       2.799800    
 H    3.590700      -1.622500      0.8792000    
 H   -4.101300      -1.479400      0.9823000    


%chk=000029120-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029120

0 1
Cl 5.110787 1.389851 -0.518548
S -0.418094 1.717757 -0.757615
N -3.880259 0.474503 -0.119688
N -2.329672 -0.875836 0.905360
N -4.350346 -0.108592 1.025030
N -3.441719 -0.934052 1.675189
C -1.628158 0.318591 -1.241525
C 1.065333 0.771079 -0.203687
C -2.604095 -0.022747 -0.170186
C 2.324288 1.327636 -0.541437
C 0.980323 -0.417228 0.561137
C 3.485891 0.674186 -0.090263
C 2.171604 -1.056483 0.973783
C 3.440558 -0.517043 0.659068
H -1.015140 -0.551517 -1.519374
H -2.157286 0.700089 -2.127190
H 2.394119 2.234179 -1.149095
H 0.008792 -0.830283 0.852174
H 2.110496 -1.977000 1.563967
H 4.362026 -1.004969 0.988000
H -5.295249 0.047879 1.375801


