%chk=000045359.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045359

0 1
 Cl   7.109000     -1.7700000E-02  0.2450000    
 S  -0.5813000      0.8611000      -1.069800    
 N    3.096500     -0.2810000      0.2107000    
 C    2.080300      0.4474000     -0.5428000    
 C   0.6925000     -3.5599999E-02 -0.1406000    
 C    4.430800      0.1891000     -0.1315000    
 C   -2.078700      0.1242000     -0.4267000    
 C   -3.051100      0.8863000      0.2208000    
 C   -2.261000      -1.249600     -0.5860000    
 C    5.474900     -0.5997000      0.6434000    
 C   -4.205900      0.2745000      0.7088000    
 C   -2.902100       2.361400      0.4172000    
 C   -3.415700      -1.861200     -9.8099999E-02
 C   -4.388200      -1.099200      0.5494000    
 H    2.232800      0.2832000      -1.616800    
 H    2.170400       1.523200     -0.3453000    
 H   0.5247000      0.1274000      0.9301000    
 H   0.6043000      -1.109100     -0.3379000    
 H    2.935400     -0.1636000       1.210800    
 H    4.526700       1.256500      0.1033000    
 H    4.607700      6.4400002E-02  -1.207000    
 H   -1.525500      -1.865800      -1.097000    
 H    5.341200     -0.4869000       1.724000    
 H    5.434000      -1.665600      0.3974000    
 H   -4.974900      0.8512000       1.216000    
 H   -2.013900       2.583700       1.018000    
 H   -2.832100       2.875000     -0.5474000    
 H   -3.760600       2.790800      0.9459000    
 H   -3.559300      -2.930300     -0.2246000    
 H   -5.287600      -1.575500      0.9286000    


%chk=000045359-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000045359

0 1
Cl 7.281219 -0.505269 -0.589855
S -0.547758 1.294558 -0.029467
N 3.271505 -0.214578 0.370425
C 2.179215 0.750362 0.118689
C 0.827457 0.022653 0.220889
C 4.639463 0.227945 0.026412
C -2.069434 0.268486 0.125830
C -3.314858 0.956610 0.007373
C -2.037309 -1.128363 0.348887
C 5.499421 -1.019809 -0.210261
C -4.506229 0.199642 0.122004
C -3.367445 2.452987 -0.234146
C -3.241971 -1.858609 0.459264
C -4.482819 -1.196003 0.346331
H 2.303698 1.149359 -0.905099
H 2.189179 1.624162 0.813602
H 0.699579 -0.435260 1.218638
H 0.758582 -0.756357 -0.555412
H 3.219571 -0.615485 1.316200
H 5.118015 0.874809 0.796539
H 4.593130 0.816495 -0.907385
H -1.086656 -1.662056 0.436091
H 5.565497 -1.663735 0.680790
H 5.149474 -1.595870 -1.077864
H -5.467060 0.720896 0.032398
H -2.860993 3.010936 0.577118
H -2.855113 2.727994 -1.176391
H -4.409910 2.807783 -0.295353
H -3.203616 -2.940058 0.631222
H -5.420536 -1.755627 0.430430


