%chk=000047972.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047972

0 1
 Cl   4.395000       2.812900     -0.9425000    
 Cl  -7.026800     -0.3313000      0.3262000    
 S    1.400800     -0.9189000       1.998300    
 O    1.238400       3.806000     -0.6482000    
 O   -4.642100      0.8422000      -1.155900    
 N    1.576500       1.823900      0.5736000    
 N   -3.387300     -0.6906000      0.1153000    
 C   0.3444000       1.169100      0.4759000    
 C   0.1244000     -7.3500000E-02   1.070100    
 C   -2.143000     -7.0900001E-02  0.2359000    
 C   -1.119200     -0.6935000      0.9501000    
 C  -0.6794000       1.791900     -0.2382000    
 C   -1.923000       1.171800     -0.3582000    
 C    2.182300      -1.876000      0.7096000    
 C    1.939200       3.063500      3.4600001E-02
 C    3.247700      -1.336200     -8.1000002E-03
 C    1.724800      -3.161000      0.4249000    
 C   -4.525300     -0.2235000     -0.5566000    
 C    3.858300      -2.084200      -1.014700    
 C    2.335400      -3.909200     -0.5817000    
 C    3.402100      -3.370800      -1.301400    
 C    3.366500       3.439600      0.3554000    
 C   -5.689800      -1.181100     -0.4644000    
 H   -1.299200      -1.662700       1.411500    
 H  -0.6011000       2.750500     -0.7283000    
 H   -2.665000       1.714400     -0.9269000    
 H    2.283000       1.330000       1.113600    
 H   -3.461700      -1.595300      0.5749000    
 H    3.625700     -0.3400000      0.2041000    
 H   0.8952000      -3.597600      0.9754000    
 H    4.690000      -1.665700      -1.573800    
 H    1.980500      -4.911000     -0.8051000    
 H    3.877800      -3.953500      -2.084800    
 H    3.693600       3.014500       1.308100    
 H    3.463800       4.527800      0.3977000    
 H   -5.997200      -1.475300      -1.471600    
 H   -5.457400      -2.076800      0.1163000    


%chk=000047972-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047972

0 1
Cl 4.371479 1.674874 1.890894
Cl -6.042875 -2.303199 0.089366
S 1.006549 -1.192838 1.969891
O 1.690442 3.552079 -0.538005
O -4.775925 1.265387 -1.425396
N 1.582089 1.541779 0.696215
N -3.701770 -0.398785 -0.139509
C 0.262437 1.097093 0.433425
C -0.142617 -0.171367 0.950773
C -2.391659 0.136790 0.018566
C -1.453704 -0.636573 0.750315
C -0.678980 1.856963 -0.311740
C -1.989301 1.387177 -0.518623
C 2.098946 -1.959529 0.671564
C 2.200824 2.681429 0.232993
C 1.706971 -2.078909 -0.679489
C 3.345114 -2.464713 1.110883
C -4.769359 0.154551 -0.811309
C 2.576526 -2.709609 -1.599057
C 4.200047 -3.104607 0.185312
C 3.820950 -3.227187 -1.171858
C 3.647326 2.930744 0.670705
C -6.081090 -0.637811 -0.823984
H -1.735060 -1.610875 1.165566
H -0.368072 2.819771 -0.721792
H -2.704488 1.982622 -1.089011
H 2.134693 0.932836 1.320392
H -3.885245 -1.309999 0.298416
H 0.742101 -1.684812 -1.014943
H 3.649100 -2.356308 2.157771
H 2.274765 -2.797620 -2.648634
H 5.164752 -3.496109 0.526136
H 4.488910 -3.717521 -1.888013
H 3.712292 3.909948 1.166715
H 4.304499 2.909442 -0.211264
H -6.872206 -0.046720 -0.340051
H -6.360560 -0.868893 -1.862119


