%chk=000220940.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220940

0 1
Cl -4.014576 -0.625241 3.223971
Cl 6.795028 -2.166109 -0.037299
Cl -9.193323 -0.334305 1.893701
Cl 8.869909 2.037511 2.559497
S 0.126455 -0.704401 -3.595609
S 0.699589 -2.158161 -2.267978
O -2.279538 1.516066 -3.265816
O 0.458699 0.417030 0.615511
N -1.832584 1.262471 -0.986424
N 1.846791 -1.450021 0.660368
N -3.129047 0.987298 -0.672074
N 2.952045 -0.700277 0.966402
C -0.015186 1.762569 -2.478531
C -0.515057 -1.713028 0.137265
C 0.835183 0.781745 -2.999785
C -0.617157 -2.320428 -1.118835
C 0.506859 3.001298 -2.092383
C -1.521354 -1.915205 1.089127
C 2.204947 1.015477 -3.128232
C -1.719798 -3.109805 -1.445189
C -1.492848 1.495397 -2.354695
C 0.612039 -0.778230 0.469267
C 1.880141 3.242644 -2.221613
C -2.625591 -2.714780 0.770771
C 2.726281 2.253562 -2.732477
C -2.727864 -3.305201 -0.492027
C -4.861839 0.501766 0.892783
C 5.276504 -0.453647 1.424481
C -5.225804 -0.133096 2.093162
C 6.565973 -0.790666 0.975312
C -5.892542 0.865236 0.001366
C 5.129457 0.691538 2.230544
C -3.450594 0.783880 0.580441
C 4.114922 -1.286936 1.062840
C -6.556409 -0.399272 2.423714
C 7.689490 -0.034631 1.314911
C -7.229631 0.608693 0.303865
C 6.236379 1.464813 2.583802
C -7.543345 -0.018593 1.513312
C 7.501301 1.088898 2.122910
H -0.150203 3.773643 -1.690417
H -1.454832 -1.444091 2.072053
H 2.867797 0.247155 -3.530389
H -1.805924 -3.567178 -2.433785
H 2.290259 4.205758 -1.915727
H -3.415009 -2.862889 1.510991
H 3.796120 2.444039 -2.821959
H -3.598275 -3.914265 -0.741276
H -1.072731 1.224732 -0.267877
H 1.918496 -2.453225 0.437563
H -5.630738 1.351230 -0.946435
H 4.130226 0.978855 2.575263
H -2.756220 0.813847 1.433386
H 4.321696 -2.356450 0.902169
H -6.816157 -0.887929 3.364322
H 8.683262 -0.312163 0.957895
H -8.018974 0.893818 -0.393440
H 6.115397 2.350555 3.209308


%chk=000220940-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220940

0 1
Cl -4.346038 -0.605513 3.506609
Cl 6.928232 -1.626354 -0.514993
Cl -9.519928 0.606004 1.959960
Cl 8.488184 2.820947 2.377298
S 0.235754 -0.746211 -3.673180
S 0.911838 -2.676090 -2.522704
O -1.913966 1.616985 -2.908437
O 0.050900 -0.212826 1.194860
N -1.729442 1.184474 -0.594323
N 1.802203 -1.449484 0.259187
N -3.095451 1.166012 -0.391246
N 2.769737 -0.593752 0.746469
C 0.298528 1.471846 -1.902390
C -0.524498 -2.215351 -0.042557
C 1.060200 0.592381 -2.724230
C -0.457591 -2.887713 -1.303081
C 0.972410 2.484580 -1.175605
C -1.649678 -2.455824 0.792569
C 2.462942 0.756837 -2.834814
C -1.492074 -3.779058 -1.681821
C -1.217052 1.427192 -1.877922
C 0.456311 -1.202888 0.503902
C 2.371753 2.640560 -1.280803
C -2.666809 -3.355041 0.415337
C 3.119053 1.779665 -2.117076
C -2.587180 -4.024341 -0.826571
C -4.949070 0.716957 1.078011
C 5.094105 0.016878 0.875928
C -5.472100 0.145525 2.267844
C 6.455932 -0.207757 0.538921
C -5.896260 1.248537 0.150872
C 4.809910 1.147027 1.701452
C -3.510250 0.761655 0.794323
C 4.015881 -0.857415 0.405139
C -6.848545 0.101181 2.557098
C 7.497986 0.627888 0.981996
C -7.277992 1.219861 0.403589
C 5.825356 2.000436 2.163122
C -7.735328 0.647434 1.610314
C 7.160931 1.727613 1.793600
H 0.391833 3.162338 -0.540510
H -1.706353 -1.925717 1.748550
H 3.029320 0.082005 -3.484635
H -1.433094 -4.264862 -2.660461
H 2.875732 3.434120 -0.718771
H -3.517576 -3.522380 1.083632
H 4.202957 1.905053 -2.211316
H -3.375705 -4.717684 -1.136683
H -1.079321 0.865087 0.157644
H 2.040162 -2.190815 -0.424495
H -5.503058 1.681627 -0.774068
H 3.763216 1.324224 1.967623
H -2.819772 0.444584 1.593554
H 4.296925 -1.712477 -0.234692
H -7.214102 -0.345530 3.484296
H 8.534920 0.426391 0.704064
H -7.988074 1.633957 -0.317085
H 5.591192 2.858525 2.798706


