%chk=000029490.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029490

0 1
 Cl  -2.274500       4.756600      0.2100000    
 S   0.6928000      0.5996000      -1.550600    
 O    1.060500       1.676300      -2.450400    
 O   0.1254000     -0.6280000      -2.071700    
 O   0.9645000      -2.729100      0.7712000    
 N  -0.4957000     -0.9202000      0.9231000    
 N   -2.414500      -2.250100     -0.7813000    
 C  -0.8610000      0.4571000      0.7283000    
 C   -1.542600      -1.800100       1.458600    
 C  -0.4145000       1.251000     -0.3403000    
 C    2.104800      0.1991000     -0.5934000    
 C    1.972900     -0.7033000      0.4575000    
 C   0.7617000      -1.512800      0.6978000    
 C   -2.770400      -1.805600      0.5600000    
 C   -1.788000       1.045700       1.613300    
 C  -0.8514000       2.573400     -0.5043000    
 C    3.319100      0.8425000     -0.8414000    
 C    3.087500     -0.9723000       1.264500    
 C   -2.222000       2.364800       1.457200    
 C   -1.752000       3.128800      0.3986000    
 C    4.418700      0.5742000     -2.7600000E-02
 C    4.303000     -0.3292000       1.026400    
 C   -3.583900      -2.221800      -1.662000    
 C   -1.840700      -3.596800     -0.7439000    
 H   -1.167100      -2.815200       1.624500    
 H   -1.805000      -1.473500       2.470900    
 H   -3.524200      -2.470300       1.003800    
 H   -3.238800     -0.8179000      0.5091000    
 H   -2.176800      0.5164000       2.478200    
 H  -0.5004000       3.179700      -1.335000    
 H    3.432900       1.557500      -1.650200    
 H    3.024600      -1.686100       2.082600    
 H   -2.924400       2.779400       2.176000    
 H    5.365900       1.072300     -0.2136000    
 H    5.161100     -0.5397000       1.658100    
 H   -3.996700      -1.208400      -1.720200    
 H   -4.375500      -2.898700      -1.320800    
 H   -3.304200      -2.502700      -2.683400    
 H   -1.707500      -3.973100      -1.766100    
 H   -2.489000      -4.307800     -0.2183000    
 H  -0.8469000      -3.640900     -0.3087000    


%chk=000029490-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029490

0 1
Cl -2.495613 4.426984 -0.324286
S 0.759821 0.110736 -1.677627
O 1.081507 1.259438 -2.800001
O 0.369234 -1.396637 -2.147051
O 1.205777 -2.706693 1.630193
N -0.393426 -1.118402 1.065061
N -2.613360 -1.969517 -0.693657
C -0.836022 0.199699 0.724961
C -1.430268 -2.099034 1.525332
C -0.484843 0.878333 -0.463316
C 2.209621 0.071481 -0.465933
C 2.096012 -0.681302 0.721231
C 0.941472 -1.566251 1.137382
C -2.769454 -2.011001 0.765021
C -1.719181 0.886129 1.603441
C -0.957206 2.149839 -0.813012
C 3.350715 0.797888 -0.833234
C 3.236974 -0.696281 1.569149
C -2.225461 2.163126 1.287181
C -1.842247 2.780961 0.080333
C 4.460853 0.782125 0.039648
C 4.398328 0.031861 1.237783
C -3.853096 -1.581017 -1.391548
C -1.980384 -3.167087 -1.279497
H -0.966855 -3.091059 1.409854
H -1.619221 -1.971883 2.610679
H -3.377350 -2.886702 1.121530
H -3.326888 -1.104405 1.067852
H -1.997759 0.419019 2.553160
H -0.627975 2.611459 -1.750409
H 3.351999 1.357030 -1.775268
H 3.194504 -1.307300 2.475908
H -2.898832 2.676443 1.979412
H 5.366549 1.340185 -0.218324
H 5.260618 0.007137 1.912039
H -4.223508 -0.617906 -0.994688
H -4.675557 -2.334873 -1.295995
H -3.639721 -1.447774 -2.466494
H -1.816263 -2.997263 -2.355945
H -2.599413 -4.090252 -1.147260
H -0.986384 -3.336433 -0.837105


