%chk=000258991.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258991

0 1
Cl 3.161446 -1.142281 2.345864
S -2.769650 2.643774 -0.930103
N 1.664145 0.424307 0.324835
N -1.118253 1.107115 0.452180
C 1.170892 1.682738 -0.321785
C 0.622959 -0.654334 0.260119
C -0.074126 2.170596 0.446583
C -0.622940 -0.173691 1.032349
C 2.961840 -0.020430 -0.127335
C -2.307339 1.235547 -0.178464
C 3.761186 -0.747303 0.780264
C 3.501792 0.288025 -1.389587
C -3.268171 0.105544 -0.174437
C 5.053831 -1.155956 0.448038
C 4.798115 -0.112558 -1.720735
C -4.147023 -0.060832 0.906439
C -3.327811 -0.760929 -1.275998
C 5.574046 -0.834547 -0.808746
C -5.077020 -1.103462 0.886302
C -4.260602 -1.801342 -1.286415
C -5.132512 -1.975090 -0.206431
H 0.926099 1.558876 -1.399627
H 1.970397 2.453842 -0.248003
H 1.019552 -1.576997 0.739436
H 0.352773 -0.920821 -0.784991
H 0.187645 2.404054 1.505313
H -0.456762 3.115926 -0.010188
H -1.410712 -0.957709 1.015379
H -0.359834 0.004601 2.103114
H 2.910799 0.839004 -2.119573
H 5.653307 -1.714924 1.168109
H 5.204913 0.137654 -2.700794
H -4.115151 0.630742 1.748253
H -2.663307 -0.610718 -2.126470
H 6.583383 -1.145654 -1.073625
H -5.765016 -1.231624 1.720962
H -4.313579 -2.472588 -2.142488
H -5.860711 -2.784754 -0.219946


%chk=000258991-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258991

0 1
Cl 2.951577 -1.507858 2.298221
S -2.602770 2.363017 -1.608502
N 1.686632 0.339118 0.083378
N -1.122622 0.968751 0.227782
C 1.171807 1.584388 -0.528167
C 0.668263 -0.740589 0.085797
C -0.097585 2.038081 0.222542
C -0.605882 -0.288198 0.832518
C 3.052670 0.004404 -0.105069
C -2.283631 1.068100 -0.511854
C 3.765355 -0.850100 0.788923
C 3.812117 0.553588 -1.183031
C -3.338785 0.026260 -0.290667
C 5.121044 -1.174524 0.611861
C 5.179517 0.259435 -1.357728
C -3.760109 -0.319892 1.023893
C -3.995929 -0.567657 -1.399846
C 5.841062 -0.617718 -0.470309
C -4.812421 -1.240215 1.220279
C -5.031291 -1.504902 -1.201265
C -5.445067 -1.844310 0.109123
H 0.924269 1.456098 -1.607128
H 1.936626 2.375034 -0.437956
H 1.073123 -1.635949 0.580945
H 0.395846 -1.013941 -0.960242
H 0.164054 2.264506 1.273838
H -0.531615 2.927890 -0.262271
H -1.369854 -1.075823 0.770565
H -0.358452 -0.103942 1.895064
H 3.308125 1.204559 -1.903928
H 5.614293 -1.834055 1.332093
H 5.722241 0.703434 -2.199275
H -3.287416 0.161897 1.887831
H -3.693660 -0.269968 -2.409163
H 6.899847 -0.860575 -0.602718
H -5.141582 -1.479714 2.237516
H -5.522971 -1.962200 -2.066899
H -6.258225 -2.562628 0.261646


