%chk=000044119.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044119

0 1
 Cl   5.358000       1.791800      0.8527000    
 S   0.7662000      -1.606300      -1.787100    
 O   -4.044200      0.1056000     -0.2788000    
 N   -1.783200       3.527200      0.8483000    
 N   -3.136100     -0.6380000      -2.253400    
 C   -1.623400     -8.5800000E-02 -0.4357000    
 C   -1.490100       1.113300      0.5282000    
 C   -1.944900       2.432500     -0.1025000    
 C   -1.188200      -1.400100      0.1897000    
 C   -3.059200     -0.1907000     -0.9510000    
 C  -0.1443000      -2.134700     -0.3412000    
 C   -1.881000      -1.825700       1.309700    
 C   -2.177500       4.799100      0.2407000    
 C  -0.4001000       3.597300       1.322100    
 C   0.2205000      -3.335700      0.2676000    
 C   -1.516200      -3.026800       1.918200    
 C  -0.4656000      -3.781600       1.397200    
 C    2.069200     -0.6420000      -1.038100    
 C    2.945900      -1.241800     -0.1370000    
 C    2.205200      0.7073000      -1.357100    
 C    3.963600     -0.4885000      0.4485000    
 C    3.222900       1.460700     -0.7718000    
 C    4.102300      0.8627000      0.1310000    
 H   -1.015500      0.1801000      -1.304500    
 H  -0.4335000       1.146700      0.8176000    
 H   -2.066700      0.9449000       1.446700    
 H   -2.999500       2.377000     -0.3897000    
 H   -1.368200       2.616700      -1.018800    
 H   -2.705400      -1.259400       1.731700    
 H   -3.220000       4.759200     -9.4300002E-02
 H   -1.548400       5.059900     -0.6183000    
 H   -2.116600       5.611800      0.9731000    
 H  -0.2368000       4.525800       1.883500    
 H   0.3284000       3.577100      0.5031000    
 H  -0.1718000       2.800900       2.037200    
 H    1.030000      -3.946300     -0.1254000    
 H   -2.051300      -3.375000       2.796800    
 H  -0.1832000      -4.717800       1.869900    
 H   -4.033500     -0.7462000      -2.714200    
 H   -2.313900     -0.8843000      -2.795000    
 H    2.877000      -2.295600      0.1154000    
 H    1.527600       1.190500      -2.056600    
 H    4.644200     -0.9686000       1.147100    
 H    3.317800       2.512900      -1.027600    


%chk=000044119-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044119

0 1
Cl 4.964272 2.591453 -0.091390
S 0.709605 -1.968232 -1.837335
O -3.905877 0.162676 -0.690092
N -1.543331 3.482252 1.212066
N -2.587531 -0.638754 -2.429625
C -1.464001 -0.094108 -0.301727
C -1.562795 1.003585 0.785207
C -1.578085 2.422572 0.177041
C -1.186200 -1.486217 0.272006
C -2.771717 -0.165571 -1.144412
C -0.224057 -2.376156 -0.287054
C -1.931085 -1.947687 1.390043
C -2.074413 4.769566 0.719029
C -0.213297 3.645127 1.832337
C -0.005440 -3.661876 0.259464
C -1.726387 -3.233362 1.934054
C -0.758295 -4.096175 1.373137
C 1.897075 -0.665623 -1.275413
C 2.222192 -0.466740 0.085474
C 2.514384 0.121929 -2.277368
C 3.156702 0.528647 0.450273
C 3.456311 1.112099 -1.920247
C 3.760267 1.304009 -0.558222
H -0.642410 0.172500 -0.991089
H -0.705056 0.889785 1.474601
H -2.489612 0.880294 1.371781
H -2.514574 2.541248 -0.398244
H -0.725557 2.530279 -0.547854
H -2.693259 -1.290750 1.821295
H -3.101556 4.626610 0.339814
H -1.459901 5.222180 -0.101575
H -2.114951 5.496575 1.550519
H -0.270416 4.401456 2.635584
H 0.573346 3.970801 1.102819
H 0.119736 2.697186 2.288531
H 0.750035 -4.313248 -0.190984
H -2.323936 -3.561453 2.791584
H -0.589294 -5.093908 1.791565
H -3.402314 -0.767996 -3.029406
H -1.664304 -0.941973 -2.749960
H 1.755392 -1.080015 0.862635
H 2.264437 -0.025953 -3.333482
H 3.410983 0.688884 1.502046
H 3.935416 1.724184 -2.689522


