%chk=000211282.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211282

0 1
Cl 1.118530 -1.335258 -0.004823
S 3.374821 1.171122 -0.256899
O -3.930221 -4.038278 1.484536
O 2.181486 2.596169 2.139352
N -1.143047 1.900240 0.756934
N -2.526074 -1.584667 1.066677
C -1.647055 0.674353 1.456857
C -2.245013 -0.275140 0.394677
C -2.257306 2.852750 0.438073
C -0.069588 2.574147 1.549536
C -1.863870 3.720517 -0.785215
C -3.895032 -1.597263 1.679673
C -2.389088 -2.725824 0.102848
C 1.270269 1.836840 1.318910
C -4.095567 -2.938488 2.403137
C -2.627952 -4.039815 0.863577
C -2.815209 4.918707 -0.893578
C -1.882086 2.890698 -2.073053
C 1.715582 1.889978 -0.140089
C 3.246211 -0.221646 -1.326152
C 2.355383 -1.288886 -1.205961
C 4.219929 -0.254812 -2.337031
C 2.423617 -2.386010 -2.077103
C 4.300258 -1.347542 -3.201975
C 3.400826 -2.413331 -3.072691
H -2.387531 0.892695 2.252879
H -0.797015 0.155349 1.957110
H -1.499086 -0.412932 -0.420419
H -3.136778 0.180067 -0.083855
H -2.522795 3.502602 1.298364
H -3.174758 2.275143 0.195027
H 0.042609 3.632263 1.221690
H -0.270833 2.619722 2.641785
H -0.824268 4.106028 -0.630583
H -4.705370 -1.449088 0.933713
H -3.959644 -0.762221 2.408571
H -3.089927 -2.655252 -0.756048
H -1.355604 -2.712879 -0.307194
H 1.234300 0.793186 1.705026
H -3.386594 -3.061374 3.240891
H -5.133331 -3.075066 2.752668
H -2.688694 -4.909858 0.187532
H -1.860778 -4.207066 1.640312
H -2.760811 5.561430 -0.008951
H -2.566288 5.539453 -1.761924
H -3.857213 4.603555 -1.012269
H -1.255557 1.995797 -1.961518
H -1.499115 3.463717 -2.923059
H -2.891267 2.554143 -2.329300
H 0.973057 1.383445 -0.789274
H 1.779049 2.937200 -0.499058
H 3.041764 2.138068 2.223617
H 4.919450 0.577689 -2.451531
H 1.721707 -3.213377 -1.971065
H 5.061544 -1.369333 -3.980972
H 3.462971 -3.265068 -3.749682


%chk=000211282-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211282

0 1
Cl 1.823972 -1.651786 0.453332
S 3.574608 1.212691 -0.166159
O -4.258281 -3.981627 1.452552
O 2.254377 2.625233 2.334513
N -1.112068 1.888293 0.871696
N -2.581492 -1.633076 1.103615
C -1.631574 0.652481 1.514689
C -2.035264 -0.409615 0.468318
C -2.183277 2.829603 0.449020
C -0.036495 2.545997 1.653075
C -1.819097 3.671062 -0.802234
C -4.011474 -1.510217 1.485497
C -2.374517 -2.856503 0.286399
C 1.334895 1.862139 1.469352
C -4.460286 -2.763666 2.255220
C -2.838640 -4.092724 1.073744
C -2.859936 4.796418 -1.007237
C -1.699766 2.779069 -2.057560
C 1.790691 1.895244 0.004781
C 3.369445 -0.151436 -1.380990
C 2.670552 -1.358195 -1.139308
C 4.025348 -0.011347 -2.632353
C 2.602266 -2.388248 -2.099257
C 3.981244 -1.037267 -3.601306
C 3.263995 -2.225943 -3.336950
H -2.489172 0.877666 2.194085
H -0.841645 0.211394 2.147105
H -1.124954 -0.683860 -0.094997
H -2.750692 0.030686 -0.270918
H -2.464480 3.518631 1.284774
H -3.088470 2.236536 0.212167
H 0.063865 3.595916 1.322219
H -0.255567 2.573507 2.746427
H -0.831146 4.144171 -0.620092
H -4.662658 -1.384355 0.582366
H -4.147614 -0.620871 2.128310
H -2.936949 -2.810128 -0.680868
H -1.296911 -2.951783 0.053685
H 1.288964 0.807163 1.806376
H -3.886154 -2.840408 3.203796
H -5.540492 -2.732290 2.474933
H -2.768265 -5.007444 0.461819
H -2.215510 -4.203066 1.987428
H -2.904572 5.472953 -0.132813
H -2.614781 5.405201 -1.896773
H -3.871552 4.372263 -1.160279
H -1.012458 1.935885 -1.867048
H -1.322196 3.353610 -2.923673
H -2.688049 2.361125 -2.333926
H 1.125087 1.290596 -0.629410
H 1.832019 2.931016 -0.372010
H 3.119614 2.140429 2.373519
H 4.564801 0.919994 -2.830994
H 2.049914 -3.305263 -1.874374
H 4.496833 -0.903183 -4.557715
H 3.216963 -3.026072 -4.082865


