%chk=000255931.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255931

0 1
Cl -0.539546 -3.425015 -1.719062
S 2.282403 -0.859893 0.824310
O -2.035695 -1.824608 -0.432006
O -0.977444 1.121511 -1.805239
O -2.130697 1.754921 0.425358
O -4.986045 -0.538144 0.432906
O 2.496721 -1.632435 2.020117
O 2.062185 0.571796 0.903498
O 1.059867 1.342090 -2.763213
O -2.647786 1.508249 2.615053
O -5.748548 -2.672245 0.511158
N 0.860526 -1.540397 0.124813
C -0.396577 0.522000 -0.606016
C 0.160501 -0.883706 -0.983400
C -1.568937 0.416096 0.383319
C -2.666460 -0.550353 -0.116393
C -1.039596 -1.738261 -1.460976
C -3.689348 -0.943870 0.950810
C 3.495010 -1.190187 -0.401919
C -0.123537 1.583082 -2.790276
C -2.626171 2.215370 1.637119
C 4.848633 -0.754358 0.068897
C -0.921152 2.323798 -3.801253
C -3.076609 3.618749 1.457099
C -5.948242 -1.516394 0.236035
C 5.839660 -1.705440 0.351899
C 5.129928 0.614534 0.211705
C -7.166055 -0.866312 -0.319825
C 7.106192 -1.286634 0.771232
C 6.397238 1.023478 0.630755
C 7.388299 0.075360 0.908823
H 0.405137 1.208844 -0.224263
H 0.879502 -0.754845 -1.843888
H -1.194790 0.133182 1.398605
H -3.163257 -0.142466 -1.027768
H -1.493046 -1.341730 -2.396813
H 0.250754 -2.144712 0.697907
H -3.586043 -0.381508 1.901081
H -3.667372 -2.039672 1.149528
H 3.500662 -2.266572 -0.688707
H 3.261073 -0.672646 -1.363434
H -0.598051 3.377663 -3.851357
H -2.000422 2.321130 -3.573943
H -0.782258 1.896981 -4.807391
H -2.959995 3.970241 0.418561
H -2.498977 4.298007 2.106677
H -4.137692 3.727736 1.735045
H 5.626736 -2.768545 0.256315
H 4.354760 1.358825 0.011488
H -8.029804 -1.028365 0.345410
H -7.043111 0.220226 -0.452136
H -7.425832 -1.300240 -1.298549
H 7.873234 -2.027267 0.994072
H 6.612093 2.085572 0.744279
H 8.374780 0.398179 1.236052


%chk=000255931-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255931

0 1
Cl -1.253378 -3.332813 -2.120023
S 1.855228 -1.508957 1.135631
O -2.434248 -1.512770 -0.557384
O -0.643694 1.222207 -1.781793
O -1.767716 2.009279 0.641922
O -5.181317 -0.554157 -0.137527
O 1.844356 -2.619455 2.319778
O 1.865644 0.078392 1.531938
O 1.639386 1.417256 -2.212017
O -2.272528 1.545362 2.879342
O -5.601657 -2.375461 1.273538
N 0.380210 -1.930173 0.118272
C -0.332271 0.450788 -0.536718
C -0.057333 -1.039326 -0.961416
C -1.549823 0.564995 0.388131
C -2.800872 -0.095624 -0.245973
C -1.382981 -1.564830 -1.558903
C -4.008294 -0.164970 0.679998
C 3.330511 -1.904987 -0.221214
C 0.456734 1.703022 -2.506426
C -2.067199 2.380707 1.976069
C 4.477740 -0.992793 -0.027543
C 0.001896 2.596195 -3.635413
C -2.077786 3.884264 2.103039
C -5.872381 -1.723826 0.245192
C 5.582231 -1.388161 0.777238
C 4.481101 0.290696 -0.642493
C -6.944337 -2.039382 -0.772945
C 6.680959 -0.522347 0.950308
C 5.583495 1.151617 -0.466800
C 6.684056 0.748477 0.326541
H 0.566660 0.874212 -0.057897
H 0.713211 -1.017369 -1.753569
H -1.319884 0.062933 1.347819
H -3.065937 0.430008 -1.185568
H -1.656370 -0.979721 -2.454448
H -0.357664 -2.323603 0.724198
H -4.228618 0.824892 1.109455
H -3.857831 -0.898946 1.490873
H 3.493441 -2.965617 0.019034
H 2.775769 -1.770116 -1.160015
H -0.218245 3.603025 -3.235975
H -0.923585 2.213033 -4.093940
H 0.798948 2.682705 -4.388256
H -2.541048 4.349751 1.218507
H -1.036995 4.250506 2.167870
H -2.611188 4.176679 3.019191
H 5.575268 -2.371058 1.263367
H 3.622380 0.614475 -1.241730
H -7.650295 -2.770835 -0.353780
H -7.474747 -1.123143 -1.078708
H -6.474067 -2.471385 -1.674720
H 7.530229 -0.832838 1.568210
H 5.583498 2.138435 -0.941862
H 7.538137 1.421552 0.461692


