%chk=000276300.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276300

0 1
Cl 1.142957 3.861067 -0.985871
S -4.799644 0.733478 2.564591
F -6.214136 1.403272 2.328852
O -0.016458 1.997011 -2.724695
O -2.170631 -0.688062 -3.648666
O -5.061056 -0.225050 3.597348
O -3.925623 1.851216 2.768577
N 4.228636 -0.050894 0.306436
N 5.070174 -1.242898 2.341948
N 6.481686 -0.931767 0.365904
N 5.671677 -0.014279 -1.643594
N 7.210708 -2.232022 2.216656
N -2.245238 0.741281 -1.831017
C 3.930988 -0.532207 1.756346
C 3.643171 0.720080 2.595877
C 2.728135 -1.484213 1.713165
C 3.134024 0.431509 -0.500124
C 5.471916 -0.341878 -0.285397
C 6.192433 -1.435950 1.671566
C 2.731424 1.774007 -0.365140
C 2.481283 -0.424750 -1.404868
C 1.668857 2.240278 -1.132487
C 1.417212 0.045782 -2.176814
C 1.015523 1.378007 -2.038710
C -4.492064 -0.005358 1.042047
C -5.147944 -1.168165 0.620762
C -3.223858 0.068300 -1.029183
C -0.730839 1.228525 -3.711689
C -3.534345 0.613340 0.222654
C -4.824140 -1.707448 -0.646160
C -3.880641 -1.108119 -1.464252
C -1.779459 0.310416 -3.074914
C -6.177913 -1.844929 1.453098
H 3.583557 0.443369 3.660176
H 4.445195 1.462101 2.512720
H 2.696912 1.196803 2.326702
H 2.551967 -1.899828 2.717649
H 1.808314 -0.988474 1.392584
H 2.909549 -2.342472 1.055813
H 3.243903 2.439954 0.334386
H 2.811540 -1.462046 -1.505828
H 0.913999 -0.629340 -2.868455
H 6.630446 -0.114936 -1.973163
H 5.211365 0.812775 -2.000384
H 7.186186 -2.375778 3.217621
H 8.135027 -2.122543 1.821604
H -0.045360 0.655662 -4.363757
H -1.216765 2.029204 -4.311977
H -3.031329 1.525153 0.572504
H -5.329174 -2.613810 -0.985929
H -3.641290 -1.541657 -2.446204
H -1.830338 1.592540 -1.425493
H -7.136967 -1.301694 1.441129
H -6.396267 -2.869183 1.119573
H -5.883782 -1.930282 2.520484


%chk=000276300-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276300

0 1
Cl 1.088201 3.838977 -0.918482
S -4.923702 0.984003 2.506618
F -6.684132 1.496027 2.150314
O -0.069314 1.851419 -2.766290
O -2.213961 -0.931695 -3.785821
O -5.021587 0.028330 3.793581
O -4.043201 2.328635 2.540133
N 4.276004 -0.169196 0.306497
N 5.151632 -1.640262 2.103894
N 6.651375 -0.483374 0.541065
N 5.828438 0.807846 -1.213155
N 7.443000 -2.126126 1.993658
N -2.306480 0.551426 -1.946952
C 4.059417 -0.730584 1.739588
C 4.015773 0.470199 2.726229
C 2.738663 -1.522191 1.783276
C 3.175836 0.317256 -0.477691
C 5.594885 0.042497 -0.087903
C 6.342857 -1.403711 1.567961
C 2.728335 1.660919 -0.340071
C 2.515920 -0.533096 -1.397979
C 1.651143 2.123704 -1.111609
C 1.428833 -0.065041 -2.165213
C 0.989700 1.275361 -2.035923
C -4.618090 0.051667 0.898806
C -5.354027 -1.119447 0.610209
C -3.312307 -0.029688 -1.132791
C -0.747854 1.023581 -3.773955
C -3.625233 0.618206 0.088284
C -5.002727 -1.730031 -0.623679
C -4.013016 -1.215449 -1.484421
C -1.820943 0.097227 -3.164892
C -6.437398 -1.689274 1.500674
H 3.920398 0.084402 3.755734
H 4.951793 1.053373 2.662870
H 3.154802 1.132539 2.520259
H 2.639824 -1.946965 2.795491
H 1.860424 -0.886387 1.575837
H 2.767743 -2.360365 1.066861
H 3.223874 2.333259 0.366159
H 2.858714 -1.566532 -1.502653
H 0.928186 -0.753601 -2.852141
H 6.795474 0.884411 -1.518107
H 5.088498 1.312036 -1.692951
H 7.331092 -2.806393 2.739379
H 8.330554 -1.993373 1.518978
H -0.042565 0.417956 -4.368041
H -1.237234 1.751994 -4.443022
H -3.118731 1.539786 0.398137
H -5.536075 -2.640911 -0.916245
H -3.776314 -1.714377 -2.426137
H -1.854390 1.406198 -1.598518
H -7.208269 -0.929585 1.722295
H -6.922394 -2.550206 1.014052
H -6.027940 -2.020276 2.471802


