%chk=000127552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127552

0 1
 Cl  -3.822700      -4.722000     -0.2857000    
 S   0.4572000       1.557900      0.6015000    
 O    5.681400      -1.675100     -9.1799997E-02
 O    1.418300      -1.369700       1.264600    
 N    1.927200      0.7828000      0.3613000    
 N    3.014900       1.416800     -0.2255000    
 C   -1.742300       1.740600      -1.026500    
 C   -2.652400       1.119200      2.6500000E-02
 C  -0.3330000       1.138700     -0.9694000    
 C   -1.633700       3.244300     -0.9086000    
 C   -3.235900       1.855000      0.9926000    
 C   -3.055800       3.337900       1.138000    
 C   -2.938000     -0.3057000     -5.0299998E-02
 C   -2.217800       3.956600      6.3800000E-02
 C   -4.006100     -0.7622000     -0.8217000    
 C   -2.142900      -1.213900      0.6483000    
 C    3.535200     -0.7397000      0.3266000    
 C    2.143200     -0.5491000      0.7386000    
 C    3.966400      0.5326000     -0.2517000    
 C   -4.279600      -2.128000     -0.8947000    
 C   -2.416200      -2.579900      0.5753000    
 C   -3.484600      -3.036900     -0.1964000    
 C    5.339700      0.6309000     -0.7557000    
 C    4.385200      -1.759000      0.3805000    
 C    6.092300     -0.4721000     -0.6397000    
 H   -2.171300       1.525900      -2.014800    
 H   0.2788000       1.547000      -1.783400    
 H  -0.3478000      5.2900001E-02  -1.106900    
 H   -1.050500       3.767900      -1.662300    
 H   -3.888900       1.380800       1.722500    
 H   -2.601000       3.547800       2.112600    
 H   -4.043900       3.812000       1.127700    
 H   -2.089100       5.034900      8.2599998E-02
 H   -4.634600     -6.6600002E-02  -1.372800    
 H   -1.319500     -0.8799000       1.272000    
 H   -5.115400      -2.469800      -1.499900    
 H   -1.790800      -3.275900       1.128500    
 H    5.699600       1.552400      -1.191100    
 H    4.167800      -2.735600      0.7854000    
 H    7.119400     -0.5351000     -0.9702000    


%chk=000127552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127552

0 1
Cl -1.191555 -4.817630 -1.350414
S 0.627070 3.028379 -0.753948
O 3.656293 -2.187000 1.236731
O 1.037001 1.498905 2.093151
N 1.456451 1.526107 -0.284956
N 2.137949 0.754036 -1.285345
C -2.139838 2.143028 -1.029815
C -2.045384 1.112653 0.097971
C -0.791204 2.300078 -1.796820
C -2.636291 3.499636 -0.560310
C -2.117371 1.508549 1.403065
C -2.275405 2.937158 1.861388
C -1.834696 -0.320900 -0.265385
C -2.672253 3.872700 0.742104
C -2.267864 -0.852805 -1.513487
C -1.179390 -1.216171 0.631087
C 2.398049 -0.187396 0.839756
C 1.554733 1.017649 1.046895
C 2.683167 -0.263120 -0.596246
C -2.082342 -2.211519 -1.849880
C -0.988975 -2.576634 0.316409
C -1.445784 -3.058785 -0.925484
C 3.478394 -1.366389 -1.070200
C 2.883664 -1.126588 1.702986
C 3.932512 -2.278760 -0.151264
H -2.852853 1.774311 -1.801701
H -0.898261 3.008230 -2.638388
H -0.406834 1.342585 -2.187652
H -2.935385 4.207212 -1.346458
H -2.056341 0.758423 2.201397
H -1.311058 3.267187 2.308191
H -3.015472 2.992459 2.686713
H -3.001515 4.883794 1.016046
H -2.780543 -0.211955 -2.238506
H -0.792939 -0.838758 1.583505
H -2.431262 -2.600752 -2.810764
H -0.484703 -3.246519 1.019439
H 3.721943 -1.488760 -2.128050
H 2.741294 -1.164226 2.784348
H 4.539798 -3.159712 -0.356311


