%chk=000189975.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189975

0 1
Cl 0.131080 2.719747 0.495343
Cl -0.022705 -2.735276 0.310084
Cl -4.768153 0.605646 -1.722931
Cl 3.025100 2.552729 -0.485542
Cl 2.874244 -2.675039 -0.629434
S -1.557604 0.107496 1.166947
O -1.982379 -1.231826 1.608236
N 2.776750 -0.060275 -0.487724
C -2.432854 0.475040 -0.400337
C 0.102214 -0.011258 0.430940
C -3.900634 0.187788 -0.204431
C 0.810461 1.175479 0.226083
C 0.730900 -1.223868 0.154530
C 2.145564 1.112146 -0.232576
C 2.079106 -1.202008 -0.298016
H -2.033161 -0.109842 -1.253084
H -2.250525 1.537033 -0.661046
H -4.095087 -0.887512 0.003038
H -4.360719 0.788401 0.604220


%chk=000189975-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189975

0 1
Cl 0.336854 2.893445 0.787942
Cl -0.302253 -2.604359 -0.087236
Cl -4.947049 0.011139 -1.830709
Cl 3.448489 2.551677 -0.196905
Cl 2.845736 -2.711325 -0.929750
S -1.577767 0.336214 1.229241
O -2.037695 -1.086557 1.933481
N 2.844796 -0.065162 -0.440917
C -2.547292 0.356212 -0.503294
C 0.191685 0.120979 0.392663
C -4.016989 0.149704 -0.189287
C 1.004931 1.271117 0.339012
C 0.713674 -1.123090 -0.016130
C 2.345614 1.127331 -0.093325
C 2.077313 -1.161195 -0.417384
H -2.124888 -0.475705 -1.086279
H -2.312004 1.333585 -0.952009
H -4.193201 -0.795256 0.344940
H -4.478356 0.995847 0.340245