%chk=000182119.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182119

0 1
Cl 3.855792 -3.742686 1.189786
Cl 1.916976 -2.772997 -0.675846
S -4.836157 -1.603985 -0.137476
P 3.063831 1.326516 0.303807
O 1.551868 1.347994 0.884794
O 2.883432 2.144347 -1.104997
O 3.189265 -0.217267 -0.362271
O 4.142345 1.678848 1.229788
C -1.977477 0.440080 0.093681
C -0.723238 0.824714 0.882669
C -3.207961 0.367671 1.014822
C 0.498383 0.883543 -0.030517
C -4.434745 0.059516 0.247694
C -5.384660 0.891483 -0.262009
C -6.442673 0.197029 -0.964693
C -6.290771 -1.153150 -0.985926
C 4.125035 2.504027 -1.761941
C 3.740879 -1.176409 0.461687
C 3.225338 -2.411052 0.342222
H -1.829301 -0.536370 -0.410269
H -2.163708 1.173605 -0.716296
H -0.853913 1.806306 1.384338
H -0.536132 0.104430 1.705600
H -3.039073 -0.386514 1.814437
H -3.331437 1.333709 1.554144
H 0.390969 1.629640 -0.840818
H 0.769204 -0.110091 -0.440781
H -5.381623 1.968038 -0.169048
H -7.263282 0.736907 -1.418319
H -6.925543 -1.896230 -1.434071
H 3.790755 3.224638 -2.523758
H 4.558226 1.618538 -2.245517
H 4.832670 2.985377 -1.073269
H 4.574926 -0.887707 1.104354


%chk=000182119-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182119

0 1
Cl 4.895237 -3.797243 1.166540
Cl 2.861546 -3.225065 -1.036578
S -4.796156 -1.502167 -0.579270
P 3.115770 1.323829 0.435677
O 1.501945 1.391839 0.959501
O 3.033723 2.180950 -1.045454
O 3.327297 -0.314733 -0.224495
O 4.206834 1.698255 1.517495
C -2.119296 0.567822 0.069211
C -0.873315 0.953504 0.901757
C -3.398940 0.511821 0.948803
C 0.380408 1.004467 0.031945
C -4.645829 0.136828 0.191227
C -5.791271 0.882480 -0.046114
C -6.798388 0.197989 -0.825571
C -6.431354 -1.084245 -1.194293
C 4.260766 2.293921 -1.876301
C 4.035605 -1.261764 0.532512
C 3.928417 -2.580937 0.254296
H -1.962260 -0.419590 -0.408694
H -2.276565 1.295671 -0.750551
H -1.022789 1.942078 1.375716
H -0.718746 0.220519 1.715992
H -3.223761 -0.197079 1.783513
H -3.565622 1.504322 1.410814
H 0.310655 1.770427 -0.760637
H 0.613809 0.021735 -0.419499
H -5.913180 1.901385 0.331996
H -7.757872 0.643825 -1.098901
H -6.982621 -1.821320 -1.775240
H 3.960518 2.928389 -2.722250
H 4.572317 1.297272 -2.233519
H 5.072476 2.776594 -1.304765
H 4.688841 -0.889277 1.331141


