%chk=000079439.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079439

0 1
 Cl   4.987200      0.7506000      -2.173900    
 S    2.111100      0.2937000       1.063900    
 O    2.359000       1.562600       1.826300    
 O  -0.3358000      -3.135900     -6.1799999E-02
 O    1.539500      -2.187800      0.5733000    
 O   -4.270800       1.612900     -0.4898000    
 O   -4.291200     -0.5621000     -0.7866000    
 N   0.3293000      -2.122200      0.2548000    
 N   -3.693800      0.4987000     -0.4829000    
 C   0.3721000      0.3153000      0.5929000    
 C  -0.3123000     -0.8515000      0.2520000    
 C    2.800400      0.5216000     -0.5956000    
 C  -0.2909000       1.542500      0.5769000    
 C   -1.659400     -0.7909000     -0.1047000    
 C   -2.322200      0.4364000     -0.1206000    
 C   -1.638000       1.603100      0.2203000    
 C    4.315800      0.5130000     -0.5445000    
 H    2.432900       1.473600     -0.9942000    
 H    2.437200     -0.2849000      -1.241200    
 H   0.2170000       2.469100      0.8308000    
 H   -2.199000      -1.696600     -0.3716000    
 H   -2.121600       2.576600      0.2175000    
 H    4.701900       1.315500      9.2100002E-02
 H    4.698000     -0.4390000     -0.1624000    


%chk=000079439-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079439

0 1
Cl 5.150712 0.949972 -2.189539
S 2.171703 0.230584 1.172778
O 2.369569 1.831719 1.602767
O -0.560088 -3.269975 -0.095660
O 1.477954 -2.321924 0.298496
O -4.321100 1.811858 -0.373306
O -4.451798 -0.432504 -0.773627
N 0.194562 -2.254823 0.120550
N -3.809503 0.631031 -0.434064
C 0.336409 0.225444 0.551904
C -0.422135 -0.907385 0.183625
C 3.011744 0.189070 -0.624608
C -0.271508 1.489780 0.619349
C -1.790145 -0.793457 -0.138518
C -2.366067 0.487863 -0.086950
C -1.631424 1.636571 0.282868
C 4.402924 0.774509 -0.460787
H 2.367845 0.822295 -1.253752
H 2.993788 -0.864039 -0.934343
H 0.355071 2.331612 0.951618
H -2.378603 -1.671485 -0.418633
H -2.131022 2.608745 0.307166
H 4.376027 1.786605 -0.031590
H 5.091485 0.122235 0.095256


