%chk=000188644.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188644

0 1
Cl -5.713986 -2.592684 1.810804
S 1.697685 -2.839927 -0.162124
O 2.096039 2.389154 0.494289
O 0.297405 3.145762 -0.726438
O 4.358234 -2.556575 -0.326472
O -1.326634 0.539956 -0.457526
C 0.672484 2.680340 0.571109
C 2.554411 1.110572 0.273439
C 2.393484 -1.242577 -0.008783
C 3.792260 -1.308320 -0.125081
C 1.744524 -0.036247 0.194900
C -0.119307 2.150396 -1.676206
C 3.960757 1.054867 0.153442
C 4.598006 -0.168516 -0.047419
C -1.535319 1.669353 -1.361594
C 0.596942 3.899400 1.466141
C 3.362348 -3.607320 -0.366804
C -2.434532 -0.130308 0.014741
C -3.763736 0.200645 -0.275056
C -2.097316 -1.215584 0.853128
C -4.784326 -0.573518 0.289133
C -3.119879 -1.976120 1.406730
C -4.452288 -1.644315 1.118140
H 0.091481 1.792446 0.885809
H 0.657497 0.019013 0.284997
H -0.084959 2.716425 -2.628925
H 0.607039 1.316894 -1.715159
H 4.531487 1.981291 0.221084
H 5.679151 -0.243181 -0.142031
H -2.125290 2.441279 -0.835708
H -2.066501 1.309356 -2.258959
H 1.136504 3.732862 2.408188
H 1.063072 4.770883 0.977379
H -0.441952 4.165441 1.692235
H 3.468059 -4.090896 -1.351092
H 3.600302 -4.289463 0.465033
H -4.019238 1.034639 -0.920522
H -1.050962 -1.445492 1.048631
H -5.829073 -0.338345 0.080049
H -2.891575 -2.822384 2.057398


%chk=000188644-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188644

0 1
Cl -5.795198 -3.052830 1.500657
S 1.620632 -2.883793 -0.279155
O 2.159585 2.488602 -0.090985
O -0.019486 3.414997 -0.450399
O 4.363141 -2.688441 -0.217436
O -1.452805 0.689778 -0.380430
C 0.843986 2.799371 0.535743
C 2.654057 1.163773 -0.081063
C 2.443108 -1.247153 -0.147513
C 3.851975 -1.368094 -0.129718
C 1.820662 0.011555 -0.133042
C -0.448488 2.563227 -1.569343
C 4.064228 1.041988 -0.066801
C 4.675484 -0.232607 -0.099589
C -1.752218 1.821877 -1.278540
C 1.073895 3.842139 1.620154
C 3.329649 -3.651980 0.160236
C -2.520962 -0.136470 0.017165
C -3.873473 0.084832 -0.341183
C -2.166667 -1.246598 0.824177
C -4.871757 -0.807790 0.114503
C -3.161252 -2.134487 1.277223
C -4.504944 -1.902164 0.916067
H 0.402563 1.861370 0.923786
H 0.731281 0.095854 -0.182994
H -0.625502 3.263864 -2.404231
H 0.353722 1.862581 -1.866589
H 4.667720 1.952755 -0.025617
H 5.763239 -0.341810 -0.092386
H -2.472886 2.509002 -0.792531
H -2.189673 1.436106 -2.223453
H 1.746558 3.438460 2.395092
H 1.537375 4.737453 1.174484
H 0.115105 4.128090 2.085043
H 3.481872 -4.569413 -0.423413
H 3.355578 -3.827660 1.249573
H -4.169100 0.933411 -0.963653
H -1.116608 -1.411442 1.084683
H -5.919068 -0.645473 -0.155883
H -2.893029 -2.993677 1.898262


