%chk=000046306.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046306

0 1
 Cl  -3.066500       4.947000     -0.2978000    
 Cl  1.0100000E-02  -5.034400      -1.011400    
 S   0.3982000       1.096900       1.302000    
 S   -3.017500      -1.323300       1.561200    
 S    1.854400       2.326900      0.5331000    
 O   -1.897900      -1.327600       2.716900    
 O   -3.865500      -2.545800       1.751900    
 O    5.937300      0.1828000     -0.9036000    
 N    4.196700      0.1808000      0.6437000    
 C   -1.707300      0.6497000     -0.4894000    
 C   -1.310500     -0.7430000     -0.5871000    
 C   -1.025100       1.561400      0.3163000    
 C   -1.824300      -1.717200      0.2679000    
 C   -2.809400       1.067000      -1.235500    
 C  -0.3888000      -1.094300      -1.572600    
 C   -1.444900       2.890200      0.3757000    
 C   -1.415900      -3.044600      0.1372000    
 C   -3.229300       2.395900      -1.176100    
 C   1.9700000E-02  -2.421600      -1.703300    
 C   -2.546900       3.307500     -0.3706000    
 C  -0.4940000      -3.396800     -0.8484000    
 C    2.535400       1.306000     -0.7959000    
 C    3.108800     -6.0000001E-03 -0.2778000    
 C    5.526000      0.2598000      0.2511000    
 C    6.457100      0.4823000       1.412700    
 H   -3.354900      0.3717000      -1.869600    
 H   1.5400000E-02 -0.3515000      -2.255700    
 H  -0.9321000       3.610600       1.010000    
 H   -1.804200      -3.813400      0.8015000    
 H   -4.089800       2.706900      -1.762800    
 H   0.7376000      -2.681400      -2.476900    
 H    2.361300     -0.6360000      0.2119000    
 H    3.481200     -0.5812000      -1.134000    
 H    3.323300       1.889600      -1.284800    
 H    1.762500       1.124600      -1.547900    
 H    3.967600      0.2755000       1.628800    
 H    7.488200      0.2977000       1.098500    
 H    6.364700       1.515000       1.759700    
 H    6.214000     -0.2005000       2.231700    
 H   -2.267100      -1.702300       3.550900    


%chk=000046306-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000046306

0 1
Cl -3.144763 4.951215 -0.319755
Cl -0.023569 -5.352116 -1.119016
S 0.148033 0.853714 1.613619
S -3.246274 -1.583493 1.422884
S 1.784541 2.427772 1.216903
O -1.924917 -0.793049 2.559130
O -3.633732 -3.060565 2.004903
O 5.831477 -0.133980 -1.056655
N 4.282735 0.405153 0.595729
C -1.750951 0.523512 -0.470882
C -1.306103 -0.906938 -0.590971
C -1.151031 1.442549 0.436136
C -1.889043 -1.955268 0.155904
C -2.790641 0.991579 -1.319149
C -0.299461 -1.275991 -1.521921
C -1.575566 2.791899 0.483641
C -1.532801 -3.306444 0.025906
C -3.223954 2.333610 -1.285049
C 0.093967 -2.622512 -1.683677
C -2.599122 3.215229 -0.380658
C -0.529751 -3.620335 -0.906768
C 2.468198 1.777777 -0.434967
C 3.132541 0.398551 -0.312337
C 5.573190 0.139588 0.156159
C 6.656033 0.190141 1.229909
H -3.256799 0.294290 -2.023621
H 0.176295 -0.498671 -2.129473
H -1.101131 3.491122 1.177216
H -2.031496 -4.059698 0.647905
H -4.020261 2.684750 -1.946799
H 0.870314 -2.891978 -2.405543
H 2.380217 -0.342529 0.022471
H 3.520167 0.083773 -1.299269
H 3.197376 2.549620 -0.740203
H 1.632417 1.764394 -1.155006
H 4.113779 0.651374 1.573229
H 7.120886 -0.807212 1.318804
H 7.446547 0.890453 0.910902
H 6.280753 0.497469 2.221303
H -2.410502 -0.313856 3.290567


