%chk=000090267.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090267

0 1
 Cl  -8.781800       2.327100      -1.351700    
 S    3.614100      -2.326300      -1.004800    
 O    4.131400      -3.400400     -0.1840000    
 O    3.596600      -2.433000      -2.448100    
 O    6.124000       5.245900      0.4751000    
 N    4.388500     -0.8637000     -0.5647000    
 N    4.986200       1.740100      0.4988000    
 N   -1.925100      -1.155200      0.8127000    
 N   -2.777600     -0.5178000      4.6999999E-03
 C    4.602000     -0.6656000      0.8972000    
 C    3.847000      0.3673000      -1.207400    
 C    5.532800      0.5255000       1.119900    
 C    4.792300       1.538500     -0.9440000    
 C    5.864400       2.883300      0.7447000    
 C    1.969600      -1.978800     -0.4653000    
 C    5.247100       4.161400      0.1997000    
 C    1.596100      -2.308600      0.8272000    
 C    1.079600      -1.382100      -1.343500    
 C  -0.6113000      -1.433900      0.3815000    
 C   -2.397700      -1.458700       2.125700    
 C   -3.813500     -0.9090000       2.092800    
 C   0.2966000      -2.034300       1.253500    
 C  -0.2198000      -1.107700     -0.9170000    
 C   -3.864300     -0.3580000      0.6947000    
 C   -5.061300      0.2945000      0.1962000    
 C   -6.184500      0.4174000       1.016100    
 C   -5.092200      0.8026000      -1.104000    
 C   -7.334400       1.045700      0.5378000    
 C   -6.241900       1.431200      -1.582400    
 C   -7.363000       1.552800     -0.7613000    
 H    3.648400     -0.4836000       1.403600    
 H    5.067400      -1.554700       1.334200    
 H    3.762300      0.2198000      -2.289100    
 H    2.860100      0.6143000     -0.8029000    
 H    5.645100      0.6769000       2.200200    
 H    6.527500      0.2973000      0.7140000    
 H    4.321300       2.402700      -1.419600    
 H    5.752700       1.360600      -1.445900    
 H    6.024100       3.012900       1.823000    
 H    6.860600       2.730900      0.3080000    
 H    5.107300       4.161300     -0.8830000    
 H    4.284500       4.373900      0.6758000    
 H    2.288200      -2.774100       1.522300    
 H    1.364300      -1.119300      -2.357700    
 H   -2.407800      -2.535900       2.327300    
 H   -1.817400     -0.9546000       2.907100    
 H   -3.953600     -0.1200000       2.837200    
 H   -4.553400      -1.702400       2.232600    
 H   3.0999999E-02  -2.304300       2.271200    
 H  -0.9006000     -0.6403000      -1.623400    
 H    6.966000       5.066200      2.2900000E-02
 H   -6.203800      3.6899999E-02   2.032800    
 H   -4.232700      0.7215000      -1.764300    
 H   -8.200900       1.133300       1.188300    
 H   -6.250200       1.821400      -2.596900    


%chk=000090267-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090267

0 1
Cl -9.208986 2.129965 -1.597085
S 3.533794 -2.241863 -0.999120
O 4.136177 -3.436112 -0.071242
O 3.489731 -2.300301 -2.624542
O 6.644364 5.388546 0.730575
N 4.614289 -0.742914 -0.606732
N 5.497103 1.787157 0.310527
N -2.119235 -1.155346 0.939946
N -3.063424 -0.530067 0.126760
C 4.761668 -0.519880 0.852762
C 4.173194 0.474744 -1.331120
C 5.869734 0.540709 1.025538
C 5.284731 1.527159 -1.135604
C 6.417871 2.915166 0.578051
C 1.784620 -1.898014 -0.400546
C 5.725941 4.284637 0.410571
C 1.429048 -2.293989 0.900759
C 0.873777 -1.278946 -1.280653
C -0.822952 -1.400583 0.487993
C -2.656614 -1.521130 2.286621
C -4.124872 -1.016783 2.210887
C 0.118990 -2.042848 1.348239
C -0.433436 -1.027057 -0.835569
C -4.206678 -0.428820 0.797045
C -5.401285 0.185182 0.217931
C -6.604100 0.275452 0.974834
C -5.392056 0.704910 -1.111131
C -7.764243 0.864680 0.430032
C -6.542198 1.294036 -1.664917
C -7.716633 1.366580 -0.884032
H 3.824543 -0.144246 1.323173
H 5.064794 -1.470158 1.324297
H 4.065703 0.226638 -2.400846
H 3.214521 0.882476 -0.937397
H 5.983331 0.767827 2.101365
H 6.830450 0.110289 0.652041
H 4.977064 2.462455 -1.636386
H 6.216004 1.155792 -1.629831
H 6.770165 2.845676 1.623412
H 7.331012 2.877087 -0.073256
H 5.309177 4.403097 -0.611720
H 4.902285 4.378082 1.134614
H 2.153497 -2.816235 1.534344
H 1.178423 -1.032612 -2.303176
H -2.588842 -2.613658 2.440664
H -2.073792 -1.019147 3.080470
H -4.342095 -0.250543 2.976328
H -4.853591 -1.835806 2.346541
H -0.168961 -2.354918 2.356289
H -1.170074 -0.556142 -1.489601
H 7.400683 5.375300 0.090569
H -6.642915 -0.115322 1.997170
H -4.471870 0.638113 -1.699098
H -8.685726 0.931880 1.015186
H -6.531807 1.690703 -2.684129


