%chk=000186415.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186415

0 1
Cl 4.083036 1.224124 -2.784564
S 3.777535 -0.488454 0.015673
O -2.456616 2.624645 0.870787
O -3.836225 1.069833 -0.243066
O -3.913806 -4.470237 -0.040538
O 4.710512 -0.901486 -0.999546
O 4.028917 -0.771674 1.401359
O 0.891612 -0.304411 0.918496
N -1.813574 -1.008244 0.439821
N -3.941081 -2.150856 0.469567
N 2.349100 -1.410680 -0.450481
N 0.163242 -2.289688 -0.111134
N -1.904129 -3.401065 -0.071578
C -1.806597 2.569786 -1.943433
C -3.215214 2.959755 -1.482529
C -0.767585 2.956424 -0.884339
C -3.500483 2.471317 -0.061546
C -1.109647 2.282172 0.441960
C -3.879442 0.271746 0.948417
C -3.172690 -1.024392 0.596307
C 3.312283 1.160135 -0.168313
C -1.221073 -2.207861 0.107781
C -3.262294 -3.304008 0.127759
C 3.458526 1.914453 -1.335198
C 2.763975 1.789776 0.966062
C 1.104934 -1.244501 0.186430
C 3.100159 3.266693 -1.384908
C 2.402381 3.136767 0.932664
C 2.575694 3.876834 -0.242549
C -5.367934 -4.443642 0.146433
H -1.770630 1.474067 -2.119824
H -1.575095 3.052661 -2.909556
H -3.970774 2.528963 -2.171860
H -3.342776 4.058634 -1.516229
H -0.743657 4.055354 -0.759641
H 0.246162 2.653444 -1.207686
H -4.351465 2.971952 0.448148
H -1.036909 1.176658 0.388633
H -0.511280 2.657138 1.289371
H -3.368729 0.780407 1.795717
H -4.951362 0.097496 1.172927
H 2.460249 -2.128175 -1.181870
H 2.610432 1.209061 1.889543
H 0.502623 -3.207651 -0.438912
H 3.232046 3.837996 -2.305046
H 1.983600 3.609631 1.821855
H 2.297812 4.932911 -0.270235
H -5.605952 -4.154888 1.174996
H -5.825069 -3.755016 -0.571739
H -5.619943 -5.490407 -0.061483


%chk=000186415-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186415

0 1
Cl 3.369189 0.059363 -2.939504
S 3.773827 -0.504423 0.410441
O -3.152438 2.554942 1.199094
O -3.663723 1.072389 -0.657301
O -3.756639 -4.732063 -0.132383
O 4.945489 -1.310208 -0.361213
O 3.842466 -0.297381 2.010607
O 0.710685 -0.023986 0.844858
N -1.988431 -1.055616 0.229034
N -4.004230 -2.388677 0.033086
N 2.290185 -1.500832 -0.039341
N 0.101956 -2.235334 0.182995
N -1.834238 -3.481385 0.029455
C -1.533758 3.111958 -1.183571
C -3.063591 3.339231 -1.171337
C -0.959713 3.288570 0.243128
C -3.744560 2.449451 -0.120517
C -1.670472 2.332114 1.212075
C -4.194956 0.053515 0.250962
C -3.346334 -1.193554 0.156801
C 3.425503 1.201174 -0.351841
C -1.295237 -2.226334 0.154215
C -3.193126 -3.491501 -0.017117
C 3.305995 1.412146 -1.735905
C 3.344847 2.252424 0.576889
C 0.993681 -1.149378 0.373064
C 3.102617 2.724870 -2.211632
C 3.146385 3.564335 0.097035
C 3.028877 3.795722 -1.292966
C -5.237643 -4.799546 -0.192722
H -1.323098 2.084308 -1.533588
H -1.053595 3.814523 -1.890744
H -3.511377 3.124713 -2.158177
H -3.287316 4.392608 -0.914321
H -1.095422 4.336698 0.578193
H 0.123042 3.061047 0.258791
H -4.805469 2.724332 0.046988
H -1.458124 1.281505 0.946634
H -1.388255 2.513415 2.261747
H -4.157705 0.432252 1.294232
H -5.236408 -0.205238 -0.015010
H 2.537744 -2.325250 -0.597545
H 3.427135 2.026813 1.645120
H 0.486332 -3.180586 0.089447
H 3.002042 2.897335 -3.287120
H 3.079174 4.395443 0.805078
H 2.873427 4.811818 -1.669561
H -5.679639 -4.379184 0.725307
H -5.612626 -4.241167 -1.065882
H -5.449677 -5.873875 -0.283072


