%chk=000258503.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258503

0 1
Cl 2.295250 4.078441 -0.182580
Cl 5.412939 -2.085213 0.408789
S -4.567948 0.819245 1.310082
O -1.310132 -0.406129 -2.263310
N 2.024808 0.054421 -0.055713
N -1.997226 0.227626 1.685678
N -2.773908 0.150582 -0.586103
N 0.222795 -0.392230 2.331707
C 0.919926 -0.846942 -0.543711
C 1.880443 1.446798 -0.590491
C 3.365328 -0.528976 -0.394415
C -0.423730 -0.399074 -0.047209
C -0.693812 -0.178162 1.286042
C 2.559344 2.401830 0.392893
C 3.778435 -1.440605 0.763101
C -1.466566 -0.242164 -1.074397
C -2.985815 0.347257 0.676296
C -5.569391 1.000080 -0.172208
H 0.893353 -0.918942 -1.660722
H 1.127564 -1.876062 -0.167940
H 2.296431 1.574138 -1.614186
H 0.796969 1.701495 -0.678227
H 3.370833 -1.093257 -1.354236
H 4.121229 0.278953 -0.521259
H 2.132851 2.321370 1.408702
H 3.650583 2.238131 0.460226
H 3.831429 -0.894154 1.722375
H 3.096604 -2.302277 0.887387
H -2.231173 0.327097 2.673032
H 1.204440 -0.441981 2.041821
H 0.103885 0.144176 3.180695
H -5.482416 0.123940 -0.837706
H -5.265741 1.875763 -0.764790
H -6.618379 1.112628 0.130279


%chk=000258503-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258503

0 1
Cl 2.753057 4.161198 -0.260830
Cl 5.294476 -2.467161 0.469715
S -4.659526 0.784272 1.460669
O -1.444402 -0.471903 -2.332501
N 2.041975 0.068591 -0.077366
N -1.987429 0.355741 1.639734
N -2.880904 0.113613 -0.560332
N 0.326992 0.035025 2.141427
C 0.883176 -0.740214 -0.616795
C 2.032180 1.474791 -0.589867
C 3.343540 -0.623452 -0.326720
C -0.473053 -0.274004 -0.134447
C -0.692842 0.025744 1.213633
C 2.702645 2.404705 0.428294
C 3.666281 -1.580102 0.828263
C -1.579799 -0.223236 -1.096009
C -3.030625 0.368217 0.707633
C -5.723660 0.757028 -0.090727
H 0.864777 -0.732276 -1.727268
H 1.057662 -1.788445 -0.300058
H 2.537265 1.556623 -1.576084
H 0.982723 1.784825 -0.730630
H 3.328518 -1.181520 -1.287509
H 4.149586 0.127213 -0.400629
H 2.131694 2.465441 1.366252
H 3.752460 2.140925 0.628971
H 3.819036 -1.043990 1.776890
H 2.917627 -2.377070 0.949468
H -2.163749 0.637334 2.607037
H 1.277357 0.022541 1.715827
H 0.171417 0.155165 3.139433
H -5.042435 0.477270 -0.914704
H -6.143969 1.760466 -0.244667
H -6.512848 0.004451 0.043797


