%chk=000099768.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099768

0 1
 Cl   6.394600     -0.9612000      -1.633700    
 S   -2.811800      -1.402200      0.5127000    
 S   -3.009700       1.323300     -0.7009000    
 O   -3.367600      -2.164600       1.615200    
 O   -2.648500      -2.009200     -0.7941000    
 O   -3.711600       2.576700     -0.4958000    
 O   -2.851000      0.7778000      -2.035200    
 O    1.661900      -1.256100     -0.7484000    
 O    4.394500       1.498400       1.725300    
 N   0.7618000      0.4761000      0.4659000    
 N    3.093500      9.2500001E-02  0.4775000    
 N    3.228400       1.263200       1.391100    
 C   -3.786100      8.9299999E-02  0.3378000    
 C  -0.6044000      0.2027000      7.4000001E-02
 C   -1.223600     -0.7988000       1.044500    
 C   -1.390900       1.509100      1.6300000E-02
 C   -5.185000     -0.2374000     -0.1677000    
 C    1.827600     -0.2969000      1.2200000E-02
 C    4.300100     -0.6238000      8.3300002E-02
 C    4.927700     -5.9000000E-02  -1.179900    
 H   -3.858200      0.5298000       1.338800    
 H  -0.5810000     -0.2397000     -0.9291000    
 H  -0.5868000      -1.684300       1.153700    
 H   -1.352800     -0.3638000       2.041900    
 H   -1.519900       1.946000       1.012900    
 H  -0.8677000       2.248300     -0.6016000    
 H   -5.803400      0.6644000     -0.2230000    
 H   -5.154800     -0.6809000      -1.168700    
 H   -5.686200     -0.9496000      0.4958000    
 H   0.9107000       1.198400       1.161400    
 H    5.014900     -0.6384000      0.9145000    
 H    4.026400      -1.671400     -9.4999999E-02
 H    5.213600      0.9887000      -1.044700    
 H    4.231600     -0.1106000      -2.023000    


%chk=000099768-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099768

0 1
Cl 6.327210 -0.616400 -2.150885
S -3.002798 -1.385514 0.958682
S -2.912740 1.417389 -0.760820
O -3.774649 -1.837094 2.328373
O -2.757626 -2.414548 -0.279602
O -3.634629 2.875313 -0.594476
O -2.614054 0.757557 -2.220149
O 1.678111 -1.042106 -1.013416
O 4.456773 1.113484 1.962779
N 0.846896 0.301668 0.727198
N 3.184907 -0.014376 0.467586
N 3.274688 0.855246 1.574399
C -4.040029 0.157111 0.268078
C -0.572493 0.126374 0.381594
C -1.256154 -0.693322 1.491463
C -1.207125 1.512933 0.180139
C -5.134010 -0.364054 -0.635052
C 1.848359 -0.303689 -0.011290
C 4.364945 -0.622013 -0.190422
C 4.797116 0.195561 -1.420232
H -4.328649 0.720279 1.170131
H -0.596510 -0.442070 -0.571323
H -0.713319 -1.627105 1.707755
H -1.469983 -0.131512 2.415853
H -1.450141 2.053090 1.110441
H -0.617137 2.142924 -0.504394
H -5.741884 0.476138 -1.017083
H -4.705141 -0.914069 -1.490826
H -5.797954 -1.043701 -0.070716
H 1.133582 0.873301 1.530034
H 5.176415 -0.646768 0.556480
H 4.097560 -1.645980 -0.494175
H 5.091778 1.222432 -1.160356
H 4.034984 0.180320 -2.211768


