%chk=000080788.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080788

0 1
 Cl   4.810800      -2.358500     -0.1692000    
 Cl   2.881500       3.584300      0.6910000    
 Cl   6.839600      0.1129000     -0.4703000    
 Cl  -4.909900       3.072300      -1.739200    
 S   0.8003000       1.149200       1.077900    
 O    5.407100       2.658900     -0.3998000    
 N    2.035200      -1.511600     -3.3799998E-02
 N   -3.569700      -1.453500      0.2728000    
 C   0.6435000      -1.430500      6.5800004E-02
 C  -4.0600002E-02 -0.3085000      0.5342000    
 C  -9.2500001E-02  -2.559900     -0.3281000    
 C   -2.161700      -1.453300      0.2046000    
 C   -1.443000     -0.3271000      0.6029000    
 C   -1.485000      -2.572900     -0.2618000    
 C    2.816700     -0.4858000      0.1173000    
 C    2.401300      0.9124000      0.4606000    
 C   0.6024000      -3.787800     -0.8289000    
 C    4.288500     -0.7043000     -7.6399997E-02
 C    3.272100       1.928100      0.3326000    
 C   -4.531100     -0.4299000      0.1589000    
 C    5.142300      0.3170000     -0.2017000    
 C    4.669100       1.717000     -0.1252000    
 C   -4.274600      0.6853000     -0.6403000    
 C   -5.742400     -0.5302000      0.8447000    
 C   -5.227300       1.697700     -0.7534000    
 C   -6.695100      0.4824000      0.7317000    
 C   -6.437500       1.596300     -6.7299999E-02
 H   -1.966400      0.5433000      0.9945000    
 H   -2.043500      -3.452800     -0.5723000    
 H   -3.970000      -2.373000      0.4374000    
 H    1.191700      -3.555700      -1.722300    
 H    1.262100      -4.195200     -5.5500001E-02
 H  -0.1057000      -4.577600      -1.102500    
 H   -3.344900      0.7670000      -1.198400    
 H   -5.954800      -1.392900       1.471200    
 H   -7.637400      0.4035000       1.266100    
 H   -7.189200       2.377600     -0.1458000    


%chk=000080788-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080788

0 1
Cl 4.780634 -2.423383 -0.600439
Cl 2.978190 3.630818 0.703252
Cl 7.009825 -0.078280 -0.268928
Cl -5.156065 3.288751 -1.524262
S 0.756879 1.413014 0.393972
O 5.792364 2.588857 0.334977
N 2.022104 -1.466127 -0.233551
N -3.599619 -1.448082 0.157427
C 0.650319 -1.378960 -0.127514
C -0.085850 -0.175504 0.141532
C -0.094934 -2.609800 -0.296968
C -2.207591 -1.368206 0.051532
C -1.485369 -0.158421 0.234247
C -1.488115 -2.580607 -0.206159
C 2.873534 -0.445022 -0.094744
C 2.506107 0.947977 0.200808
C 0.650229 -3.894377 -0.577807
C 4.307606 -0.723084 -0.235777
C 3.465877 1.928735 0.338968
C -4.569424 -0.410579 0.147877
C 5.259824 0.262623 -0.097410
C 4.912602 1.682318 0.205876
C -4.383088 0.791824 -0.587027
C -5.792067 -0.625800 0.841285
C -5.409336 1.751948 -0.578707
C -6.804987 0.353167 0.811784
C -6.624337 1.567158 0.108524
H -2.007113 0.767292 0.489599
H -2.051522 -3.510939 -0.348650
H -3.975983 -2.392107 0.271150
H 1.251955 -3.805313 -1.499052
H 1.370604 -4.114774 0.229041
H -0.045379 -4.743779 -0.682510
H -3.486650 0.955058 -1.188993
H -5.938097 -1.549488 1.413010
H -7.741301 0.180373 1.351934
H -7.399925 2.336919 0.093702


