%chk=000207314.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207314

0 1
Cl -7.185386 1.310977 -1.171449
S 1.112473 2.506349 0.415813
O 3.991844 -1.346123 -0.724325
O 5.138969 0.599335 -0.822656
N -1.077353 -0.981149 0.397451
N 3.733657 2.951475 -0.222825
C 0.076394 -1.863204 0.783217
C 1.328222 -1.473284 -0.024299
C -0.829085 0.468808 0.733445
C 1.574750 -0.006101 0.062552
C 0.567689 0.844846 0.408560
C -2.336443 -1.459735 1.060887
C 2.838291 0.648071 -0.209871
C 2.751637 2.036399 -0.059722
C -3.539053 -0.739156 0.499314
C 4.081243 0.022817 -0.599889
C -4.529564 -0.251797 1.364881
C -3.685430 -0.583671 -0.889565
C -5.664460 0.384024 0.852292
C -4.811553 0.052597 -1.413676
C -5.785968 0.525277 -0.530642
C 5.211165 -2.068501 -1.090959
C 6.088419 -2.244252 0.131289
H -0.199192 -2.912893 0.543546
H 0.306143 -1.820644 1.869789
H 1.200319 -1.749877 -1.095448
H 2.211879 -2.050019 0.326531
H -1.050092 0.706408 1.800410
H -1.550269 1.053855 0.110279
H -2.303670 -1.372407 2.169921
H -2.448285 -2.548436 0.836252
H -4.423168 -0.365247 2.442645
H -2.901547 -0.954561 -1.555723
H 4.667543 2.638263 -0.509299
H 3.575716 3.938233 -0.120769
H -6.437829 0.762386 1.519486
H -4.929200 0.178555 -2.489568
H 4.784132 -3.016560 -1.464098
H 5.719440 -1.517041 -1.902461
H 6.934902 -2.909259 -0.073375
H 6.498450 -1.277640 0.462307
H 5.526167 -2.661917 0.975649


%chk=000207314-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207314

0 1
Cl -7.237062 1.215957 -1.646134
S 1.154882 2.574079 0.536761
O 4.014278 -1.386405 -0.792353
O 5.103882 0.669508 -0.996052
N -1.100388 -0.923571 0.692525
N 3.765583 2.901504 -0.353852
C 0.015302 -1.833135 1.059604
C 1.278366 -1.532949 0.225775
C -0.799538 0.487102 1.053253
C 1.576561 -0.045828 0.216703
C 0.597442 0.832590 0.615285
C -2.412748 -1.357161 1.217354
C 2.823694 0.606774 -0.185839
C 2.763311 2.018497 -0.065773
C -3.588475 -0.676543 0.520478
C 4.055514 0.009082 -0.676198
C -4.775271 -0.378933 1.232885
C -3.530317 -0.379484 -0.864566
C -5.893406 0.193438 0.583212
C -4.633349 0.197193 -1.530865
C -5.801933 0.471278 -0.793326
C 5.266249 -2.043153 -1.275641
C 6.240577 -2.288329 -0.119303
H -0.311273 -2.872615 0.872173
H 0.264213 -1.751441 2.149046
H 1.138397 -1.887231 -0.813049
H 2.138463 -2.092807 0.632464
H -0.912658 0.650962 2.159282
H -1.544486 1.140593 0.560059
H -2.502853 -1.199010 2.323645
H -2.483483 -2.450799 1.049997
H -4.835143 -0.592490 2.307183
H -2.603740 -0.596612 -1.407155
H 4.639737 2.468604 -0.694499
H 3.652206 3.907074 -0.260091
H -6.809205 0.422010 1.136130
H -4.586142 0.427893 -2.599245
H 4.906433 -2.985564 -1.719822
H 5.722359 -1.404760 -2.052073
H 7.122759 -2.845850 -0.486076
H 6.588402 -1.331445 0.303913
H 5.764757 -2.882822 0.680080


