%chk=000230696.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230696

0 1
Cl 0.485751 2.727410 0.056931
S -0.834400 0.268442 -1.698574
O -1.069948 -1.959752 0.116127
O -0.966260 1.610397 -2.236779
O -0.892089 -0.857067 -2.611047
O 5.139630 -1.342086 0.809366
O 5.031507 0.689416 1.547849
N 4.584206 -0.264399 0.935882
C -1.981678 0.099258 -0.421502
C 0.738176 0.183560 -0.885696
C -2.057843 -1.045191 0.382983
C -2.904991 1.132289 -0.203495
C -3.887305 1.020804 0.785277
C 1.298865 1.227982 -0.154460
C 1.453163 -1.010938 -1.030307
C -3.040058 -1.187658 1.378848
C -3.948150 -0.150255 1.567903
C 2.559889 1.102108 0.448394
C 2.710798 -1.168987 -0.441826
C 3.245927 -0.105068 0.295200
C -4.870903 2.120536 1.015010
C -1.128154 -3.252978 0.771170
H -2.847567 2.038805 -0.823693
H 1.017899 -1.836290 -1.616534
H -3.096834 -2.081587 1.991576
H -4.718880 -0.243626 2.336012
H 3.001704 1.926659 1.021517
H 3.274852 -2.100775 -0.553631
H -4.694085 2.989427 0.365529
H -5.900078 1.784624 0.821038
H -4.833164 2.486200 2.051106
H -2.068410 -3.758352 0.529654
H -0.984404 -3.135291 1.848815
H -0.277667 -3.773817 0.309856


%chk=000230696-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230696

0 1
Cl 0.406778 2.451603 0.748205
S -0.806910 0.321453 -1.687145
O -1.102283 -1.954209 0.313051
O -0.973714 1.835558 -2.273018
O -0.858188 -0.942521 -2.719019
O 5.535097 -1.351726 0.293956
O 5.257296 0.498832 1.598615
N 4.843094 -0.352609 0.723475
C -2.100252 0.129115 -0.318121
C 0.913823 0.167603 -0.829257
C -2.127013 -1.028100 0.491986
C -3.047815 1.156584 -0.222791
C -4.101217 1.053291 0.719296
C 1.400746 1.073426 0.127590
C 1.691504 -0.906663 -1.292891
C -3.178776 -1.133373 1.436704
C -4.142492 -0.107217 1.534625
C 2.699363 0.907919 0.646168
C 2.994627 -1.087936 -0.791914
C 3.470590 -0.173814 0.172599
C -5.151172 2.142211 0.845450
C -1.163837 -3.205891 1.079078
H -2.949132 2.024784 -0.884844
H 1.251176 -1.576538 -2.040808
H -3.247606 -2.005330 2.093788
H -4.948820 -0.211761 2.270717
H 3.111533 1.589020 1.394846
H 3.634871 -1.907265 -1.126730
H -4.943808 2.983127 0.163041
H -6.159603 1.756524 0.604882
H -5.192140 2.545292 1.874405
H -2.095195 -3.758793 0.855740
H -1.086351 -3.011291 2.165554
H -0.294673 -3.787505 0.741263


