%chk=000054105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054105

0 1
 Cl  0.6896000       5.113400      0.2454000    
 S   -1.374400      0.6137000      -1.918000    
 O  -0.5482000      -2.944400     -8.1200004E-02
 N   0.4773000     -0.8697000      0.2182000    
 N    4.075900      -1.793500     -0.2482000    
 C    1.763100      -1.517900      0.4970000    
 C    2.799400      -1.163100     -0.5592000    
 C   0.4688000      0.5697000      0.2145000    
 C  -0.6321000      -1.718200      3.2000002E-02
 C  -0.3114000       1.334900     -0.6749000    
 C   -2.012100      -1.187800      8.1299998E-02
 C   -2.474500     -0.1996000     -0.7902000    
 C    1.333300       1.260400       1.088400    
 C  -0.2348000       2.739200     -0.6556000    
 C    4.551600      -1.372800       1.071200    
 C    5.072700      -1.473800      -1.272000    
 C   -2.897700      -1.796600      0.9821000    
 C    1.397600       2.655400       1.104700    
 C   -3.821800      0.1813000     -0.7484000    
 C   0.6110000       3.395400      0.2340000    
 C   -4.235500      -1.406300       1.022600    
 C   -4.697800     -0.4196000      0.1563000    
 H    2.037400      -1.265000       1.523500    
 H    1.640700      -2.608000      0.5070000    
 H    2.438600      -1.522500      -1.532100    
 H    2.929400     -7.9499997E-02 -0.6605000    
 H    1.959400      0.7433000       1.809100    
 H  -0.8370000       3.326900      -1.347300    
 H    3.986100      -1.843800       1.880700    
 H    4.533300     -0.2841000       1.197400    
 H    5.585700      -1.705000       1.226400    
 H    6.012800      -2.000200      -1.072500    
 H    5.282500     -0.3992000      -1.324300    
 H    4.731800      -1.807600      -2.258500    
 H   -2.557100      -2.577900       1.657300    
 H    2.067500       3.146300       1.806100    
 H   -4.204000      0.9535000      -1.412100    
 H   -4.917700      -1.876700       1.724600    
 H   -5.740300     -0.1165000      0.1847000    


%chk=000054105-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054105

0 1
Cl 0.136673 5.490363 1.394324
S -0.828411 0.959756 -1.721940
O -0.093626 -2.718316 0.432780
N 0.629540 -0.526167 0.641775
N 4.076800 -1.844812 -0.293416
C 2.007274 -1.073628 0.844560
C 2.665561 -1.460813 -0.505351
C 0.433165 0.887749 0.816595
C -0.369431 -1.477002 0.376204
C -0.163247 1.709286 -0.177457
C -1.780527 -1.055013 0.056424
C -2.131199 -0.060230 -0.892405
C 0.911237 1.507457 2.003339
C -0.265351 3.106905 -0.001069
C 5.000388 -0.695072 -0.266758
C 4.546650 -2.924711 -1.182734
C -2.819713 -1.830633 0.636832
C 0.830485 2.901606 2.187963
C -3.479472 0.155081 -1.253247
C 0.248701 3.686129 1.172677
C -4.168363 -1.608627 0.295790
C -4.500450 -0.618550 -0.658742
H 2.613556 -0.306027 1.350550
H 1.954672 -1.972138 1.480377
H 2.113207 -2.321335 -0.918745
H 2.555064 -0.614532 -1.226737
H 1.339512 0.885770 2.796178
H -0.741353 3.720322 -0.770373
H 4.656444 0.059605 0.462762
H 5.098356 -0.187931 -1.260495
H 6.005385 -1.030059 0.047279
H 5.555836 -3.249317 -0.868970
H 4.603284 -2.625432 -2.259776
H 3.870508 -3.793266 -1.102031
H -2.539667 -2.626499 1.334023
H 1.200474 3.364792 3.106751
H -3.722046 0.928624 -1.988539
H -4.955447 -2.211875 0.760069
H -5.545368 -0.447359 -0.938969


