%chk=000291546.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291546

0 1
Cl -1.619843 0.391570 3.152733
Cl -0.849104 -0.056966 -2.209399
Cl 1.942511 -1.045044 -1.721746
Cl 1.185492 -0.593526 3.614097
S -3.910335 -0.351592 0.710247
S 4.211447 -0.089370 1.034648
O -4.198813 0.003590 2.078812
O -4.940278 -0.189174 -0.290154
O 3.699487 1.257128 1.054293
O 5.083555 -0.583547 2.077278
N -2.525430 0.566957 0.169567
N 2.840569 -1.179726 1.163192
N -2.993230 6.086858 -1.055901
C -2.685746 1.973825 -0.152158
C -1.190503 0.146143 0.473319
C -3.342926 2.381979 -1.340455
C -3.281915 -1.961718 0.653381
C -0.676310 0.013922 1.785405
C -0.319398 -0.175043 -0.591281
C -2.163426 2.942680 0.726800
C 1.510536 -0.725330 0.937897
C -3.469422 3.753116 -1.603682
C 0.993316 -0.612331 -0.367427
C 0.633576 -0.425034 2.005125
C -2.938042 4.713651 -0.723477
C -2.281180 4.299417 0.455883
C -3.955991 1.427451 -2.305608
C -3.111459 -2.607189 -0.575398
C -2.971093 -2.624433 1.845843
C 4.880418 -0.440438 -0.510246
C -2.621134 -3.915862 -0.613382
C -2.482015 -3.932973 1.809395
C -2.307046 -4.577006 0.579259
C 4.532039 0.344575 -1.615992
C 5.779866 -1.502478 -0.656616
C 5.082711 0.064669 -2.870235
C 6.328163 -1.784018 -1.910874
C 5.977826 -1.000516 -3.016497
H -1.655267 2.632478 1.641607
H -3.975779 4.073099 -2.511119
H -1.860239 5.029488 1.141052
H -3.430599 0.466693 -2.357766
H -4.987495 1.173659 -1.981251
H -4.016240 1.829668 -3.322725
H 2.898914 -1.868216 1.937076
H -3.361187 -2.092865 -1.509136
H -3.111686 -2.116983 2.809306
H -2.485408 -4.419089 -1.569657
H -2.239674 -4.449758 2.737102
H -1.925106 -5.598544 0.550004
H -2.894700 6.739995 -0.292778
H -3.710168 6.365041 -1.709282
H 3.836402 1.184853 -1.500211
H 6.063750 -2.108562 0.210611
H 4.813899 0.676603 -3.730618
H 7.028453 -2.610134 -2.026258
H 6.406457 -1.219946 -3.995707


%chk=000291546-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291546

0 1
Cl -2.025070 0.989559 2.283986
Cl -0.853733 0.507898 -3.132009
Cl 1.819212 -1.133816 -2.401154
Cl 0.715887 -0.514210 3.004688
S -4.109421 -0.879360 -0.085289
S 4.028173 -0.204168 0.510353
O -5.237768 -0.785852 1.130844
O -4.610011 -1.303810 -1.611708
O 3.569206 1.227251 -0.124829
O 4.666569 -0.326955 2.011390
N -2.491855 1.289451 -0.812563
N 2.310731 -1.458567 0.535118
N -4.156524 6.542450 0.202758
C -2.898584 2.544739 -0.459153
C -1.286854 0.719654 -0.403753
C -4.231979 2.975499 -0.875942
C -2.932692 -2.293176 0.423403
C -0.906655 0.472786 0.960928
C -0.404873 0.210166 -1.415387
C -2.034362 3.509186 0.191022
C 1.152706 -0.728851 0.264867
C -4.616357 4.299586 -0.644289
C 0.767131 -0.486728 -1.094877
C 0.268317 -0.218126 1.275406
C -3.745815 5.241918 -0.011861
C -2.432469 4.823402 0.391925
C -5.175466 1.989134 -1.509980
C -2.213875 -2.953270 -0.588911
C -2.830488 -2.615191 1.786961
C 5.247957 -1.014238 -0.680739
C -1.334240 -3.991393 -0.202551
C -1.949389 -3.659705 2.153752
C -1.199939 -4.338289 1.163317
C 5.266502 -0.569984 -2.011802
C 6.111872 -1.991621 -0.160679
C 6.216862 -1.155927 -2.879186
C 7.050935 -2.567427 -1.047712
C 7.098927 -2.153323 -2.399865
H -1.024045 3.201722 0.477975
H -5.618414 4.622668 -0.951828
H -1.748238 5.545382 0.852482
H -4.643157 1.277287 -2.164864
H -5.663020 1.368193 -0.732737
H -5.973581 2.497778 -2.076624
H 2.376139 -1.694516 1.549316
H -2.363104 -2.680661 -1.638989
H -3.438144 -2.082259 2.525320
H -0.761358 -4.527621 -0.966532
H -1.853095 -3.941422 3.207722
H -0.516435 -5.143688 1.454283
H -3.547686 7.215548 0.663453
H -5.082711 6.853538 -0.082729
H 4.576913 0.209552 -2.349115
H 6.069963 -2.271111 0.896560
H 6.265863 -0.831426 -3.923621
H 7.742690 -3.332163 -0.679914
H 7.830053 -2.603796 -3.079746


