%chk=000030992.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030992

0 1
 Cl -0.7593000      -4.865400     -0.2987000    
 S   -4.124400      0.4403000      5.8600001E-02
 O    2.616900      1.7200001E-02  0.7703000    
 N   -1.061800      0.2334000      0.5495000    
 N    6.082400     -0.2181000     -0.4090000    
 C   0.2557000      0.1446000       1.192200    
 C   -1.717200     -0.9833000      0.2329000    
 C   -1.547700       1.527300      0.2329000    
 C    1.345100      6.7100003E-02  0.1361000    
 C   -3.100300      -1.014800     -3.4000002E-02
 C   -2.913900       1.744500     -3.4200002E-02
 C   -1.017600      -2.206000      0.1343000    
 C  -0.6901000       2.644900      0.1346000    
 C    3.670500     -5.6100000E-02 -0.1802000    
 C    5.004100     -0.1070000      0.5457000    
 C   -3.744100      -2.223100     -0.3553000    
 C   -3.389300       3.028200     -0.3560000    
 C   -1.661500      -3.403100     -0.1904000    
 C   -1.167000       3.917700     -0.1907000    
 C   -3.026800      -3.412200     -0.4323000    
 C   -2.518600       4.110100     -0.4333000    
 C    7.382700     -0.3028000      0.2689000    
 C    6.082300      0.9165000      -1.341900    
 H   0.3197000     -0.7145000       1.874000    
 H   0.4358000      0.9914000       1.868600    
 H    1.322700      0.9282000     -0.5382000    
 H    1.239100     -0.8129000     -0.5043000    
 H   4.6700001E-02  -2.270800      0.3339000    
 H   0.3751000       2.580500      0.3291000    
 H    3.539500     -0.9519000     -0.8000000    
 H    3.588800      0.8313000     -0.8157000    
 H    5.107500      0.7770000       1.189500    
 H    4.997300     -0.9720000       1.221500    
 H   -4.814400      -2.249900     -0.5502000    
 H   -4.446300       3.198900     -0.5508000    
 H  -0.4789000       4.756100     -0.2481000    
 H   -3.545900      -4.332700     -0.6852000    
 H   -2.894800       5.097400     -0.6831000    
 H    7.603600      0.6003000      0.8493000    
 H    7.405700      -1.163800      0.9462000    
 H    8.187700     -0.4550000     -0.4586000    
 H    5.261400      0.8526000      -2.062700    
 H    6.041100       1.882300     -0.8251000    
 H    6.992600      0.9060000      -1.954100    


%chk=000030992-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030992

0 1
Cl -0.709466 -4.905026 -0.239951
S -4.264016 0.394838 0.540894
O 2.631701 0.145732 0.520341
N -1.120549 0.268184 0.554124
N 6.250827 -0.111377 -0.410921
C 0.292101 0.224173 0.989597
C -1.785140 -0.964600 0.290069
C -1.685649 1.540084 0.217332
C 1.333511 0.142509 -0.151052
C -3.203714 -1.046367 0.162201
C -3.091731 1.728566 0.089622
C -1.046631 -2.175420 0.154419
C -0.857402 2.679562 0.008950
C 3.759996 0.032651 -0.417528
C 5.038560 0.008194 0.432476
C -3.840656 -2.265508 -0.137843
C -3.636271 2.975593 -0.274070
C -1.714434 -3.386063 -0.099829
C -1.406297 3.939722 -0.312647
C -3.105146 -3.466665 -0.265656
C -2.798381 4.096463 -0.470086
C 7.388012 -0.719795 0.309899
C 6.634382 1.158392 -1.062210
H 0.434086 -0.641859 1.658448
H 0.507184 1.121216 1.594253
H 1.248018 1.006271 -0.844680
H 1.207839 -0.780527 -0.755640
H 0.039228 -2.189044 0.246579
H 0.227509 2.597729 0.100546
H 3.683644 -0.903130 -1.009555
H 3.748286 0.893646 -1.120668
H 5.057241 0.913810 1.088455
H 4.982687 -0.871459 1.098678
H -4.929870 -2.285753 -0.248145
H -4.722344 3.071480 -0.380032
H -0.734398 4.793624 -0.450352
H -3.601646 -4.416536 -0.476586
H -3.229817 5.067052 -0.733382
H 7.757797 -0.099719 1.165868
H 7.095179 -1.708873 0.703927
H 8.230879 -0.868192 -0.389078
H 5.798976 1.551531 -1.666722
H 6.934400 1.952081 -0.330583
H 7.485616 0.981213 -1.743460


