%chk=000080804.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080804

0 1
 Cl  0.5720000      -2.729200     -3.0400001E-02
 S   -4.079600      8.5000005E-03 -0.1974000    
 O    2.173500      1.4700000E-02   2.365600    
 O   -4.565300      8.9999996E-03   1.363700    
 O   -4.506000       1.274700     -0.7750000    
 O   -4.484700      -1.253800     -0.7959000    
 N    1.852700      1.1500000E-02  1.6100001E-02
 N    2.649800      1.8100001E-02  -1.107400    
 C   0.4680000     -9.9999997E-05 -3.3700000E-02
 C  -0.2414000       1.209000     -5.8800001E-02
 C    4.019200      2.9600000E-02  0.7862000    
 C    2.580600      1.7700000E-02   1.216100    
 C    3.878400      2.7899999E-02 -0.6993000    
 C   -2.334500      4.9999999E-03 -0.1344000    
 C  -0.2458000      -1.206900     -5.9700001E-02
 C   -1.635300       1.211700     -0.1090000    
 C   -1.639700      -1.204300     -0.1098000    
 C   0.4782000       2.518900     -3.3199999E-02
 C    5.060100      3.7999999E-02  -1.603800    
 H    4.533900     -0.8707000       1.126100    
 H    4.518700      0.9388000       1.125500    
 H   -2.172300       2.156600     -0.1203000    
 H   -2.178400      -2.148700     -0.1211000    
 H    1.155900       2.603900     -0.8890000    
 H  -0.2146000       3.365900     -8.6900003E-02
 H    1.049100       2.626200      0.8948000    
 H    5.654800      0.9349000      -1.412600    
 H    4.740700      3.3000000E-02  -2.649100    
 H    5.672200     -0.8465000      -1.409700    
 H   -4.287700      0.7937000       1.892500    


%chk=000080804-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080804

0 1
Cl 0.749087 -2.618446 -0.341750
S -4.131670 0.032442 -0.294504
O 2.312636 0.982819 2.263676
O -4.429704 -0.263844 1.514471
O -4.697065 1.497541 -0.680225
O -4.601309 -1.278543 -1.116609
N 1.928576 0.194426 0.046675
N 2.699379 -0.261785 -1.087825
C 0.505950 0.163177 -0.018810
C -0.237163 1.373443 0.134844
C 4.167729 0.321527 0.677816
C 2.727492 0.563042 1.155836
C 3.973381 -0.187220 -0.735902
C -2.264138 0.077425 -0.162255
C -0.174401 -1.065409 -0.234468
C -1.650021 1.313475 0.069946
C -1.575564 -1.132616 -0.320376
C 0.457618 2.699568 0.350917
C 5.064369 -0.573510 -1.687649
H 4.669911 -0.411207 1.335528
H 4.759294 1.253867 0.725850
H -2.252781 2.221358 0.168109
H -2.100317 -2.075234 -0.497898
H 1.300587 2.827433 -0.352053
H -0.242938 3.538337 0.210593
H 0.873729 2.754088 1.373549
H 5.748082 0.275471 -1.877781
H 4.633819 -0.903096 -2.646648
H 5.677503 -1.396389 -1.273821
H -5.419570 -0.335041 1.650863


