%chk=000124642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000124642

0 1
Cl -0.343268 2.475566 -1.660643
S 3.168551 -0.937848 1.022128
O -1.185212 -2.524850 1.169593
O -1.415806 -4.002398 -1.781058
O 0.965911 -3.459471 -1.200216
O 1.755114 -0.743937 1.878292
O 2.957425 -1.940494 0.014960
O 4.191890 -1.062160 2.011040
O 1.756442 0.479714 -1.207395
N -3.027416 -1.496987 0.134000
N -4.918712 -0.278065 0.650434
N -1.631733 0.376556 -0.781368
N 3.441931 0.599154 0.296957
N -2.805888 2.538044 -0.749032
N -5.015184 2.786661 0.047114
N 4.533495 2.793167 -0.990030
C -1.279146 -2.698918 -1.248873
C 0.169303 -2.334368 -0.835091
C -2.100809 -2.651406 0.079410
C 0.157146 -2.192533 0.707768
C 0.480208 -0.783282 1.211657
C -2.764103 -0.172678 -0.226416
C -4.359528 -1.490371 0.682471
C -3.952954 0.575159 0.089633
C -3.945639 1.973615 -0.198898
C -1.741416 1.714434 -0.997734
C 2.725703 1.096961 -0.807996
C 3.153704 2.448178 -1.417396
C 2.968172 2.384177 -2.932950
H -1.684624 -2.027034 -2.039219
H 0.545107 -1.418446 -1.353487
H -2.670886 -3.592530 0.275612
H 0.796752 -2.964325 1.197705
H 0.451452 -0.010509 0.413517
H -0.216003 -0.492554 2.030283
H -0.613187 -4.560868 -1.577261
H 1.934581 -3.229472 -1.101459
H -4.816511 -2.397005 1.058329
H 4.218747 1.190980 0.665222
H -5.860468 2.407709 0.449681
H -4.978636 3.771248 -0.170220
H 2.441887 3.209571 -0.982662
H 3.061425 3.372106 -3.396701
H 1.969982 1.992019 -3.195987
H 3.689995 1.715101 -3.417659
H 5.227504 2.346963 -1.586259
H 4.688302 3.796528 -1.045990


%chk=000124642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000124642

0 1
Cl -0.226607 2.951927 -0.238331
S 3.567764 -1.092730 0.543479
O -1.242139 -2.196015 1.402558
O -1.415499 -4.255305 -1.100644
O 0.933024 -3.322578 -1.232743
O 2.243986 -1.159567 1.853424
O 3.363048 -2.263240 -0.552192
O 4.924937 -0.990089 1.384949
O 1.889564 -0.000144 -2.089389
N -3.134751 -1.331842 0.202084
N -5.165146 -0.250166 0.126515
N -1.632968 0.655104 -0.052557
N 3.332474 0.494899 -0.262081
N -2.905283 2.740837 -0.243734
N -5.266075 2.818378 -0.232567
N 3.581414 2.969732 -0.748868
C -1.399116 -2.809247 -0.949324
C 0.051431 -2.307107 -0.675435
C -2.197338 -2.469911 0.335402
C 0.157529 -2.207839 0.875068
C 0.837001 -0.944150 1.438218
C -2.847522 0.024593 0.033024
C -4.537873 -1.431306 0.257800
C -4.115022 0.671901 -0.011194
C -4.115558 2.089280 -0.165863
C -1.791956 1.986738 -0.177081
C 2.638031 0.769779 -1.441540
C 2.948737 2.232442 -1.880489
C 3.880677 2.192653 -3.111287
H -1.838664 -2.325915 -1.842382
H 0.224652 -1.327371 -1.152733
H -2.808822 -3.348844 0.606537
H 0.660358 -3.110675 1.271960
H 0.738563 -0.074607 0.763823
H 0.365827 -0.685815 2.404871
H -0.474494 -4.503965 -1.344768
H 1.883519 -3.016568 -1.164740
H -5.034577 -2.389971 0.393139
H 3.827489 1.359278 0.103417
H -6.165483 2.344684 -0.169649
H -5.212927 3.829883 -0.335092
H 1.974235 2.668683 -2.171360
H 4.012220 3.209168 -3.524085
H 3.445933 1.552570 -3.895917
H 4.872322 1.785481 -2.841551
H 4.381997 3.546337 -1.027435
H 2.914687 3.501722 -0.177431


