%chk=000246320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246320

0 1
Cl -4.123859 -1.440567 -2.227545
S -1.559370 0.933103 -0.281550
O 5.100379 0.642601 0.105321
O 3.170692 2.302341 -0.580509
O 4.617935 -1.422506 0.904239
N 1.043759 1.558625 -0.404912
N 0.506023 -0.633775 0.404412
C -3.843459 -0.248702 0.201193
C -2.401146 -0.614176 0.197622
C 0.146295 0.573147 -0.072048
C 2.836312 0.038475 0.253172
C -4.708462 -0.576568 -0.855006
C -4.380356 0.448136 1.300304
C 2.504788 1.352467 -0.257313
C 1.848772 -0.887183 0.559703
C -6.062723 -0.228277 -0.835316
C -5.729670 0.802657 1.330369
C -6.571789 0.466173 0.263707
C 4.238293 -0.356047 0.462520
C 6.536954 0.383100 0.241530
C 7.010331 -0.508026 -0.886910
H -2.042985 -0.961169 1.192776
H -2.133001 -1.434566 -0.502375
H -3.733027 0.713863 2.138045
H 0.738497 2.470646 -0.769597
H 2.104633 -1.888970 0.950774
H -6.711292 -0.497589 -1.670330
H -6.129509 1.343202 2.188470
H -7.625545 0.744350 0.290098
H 6.928194 1.415937 0.178737
H 6.722482 -0.053318 1.238460
H 8.103323 -0.585442 -0.906440
H 6.606905 -1.526985 -0.783913
H 6.683024 -0.126759 -1.863286


%chk=000246320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246320

0 1
Cl -5.435068 0.183010 -2.376974
S -1.665103 0.205793 -2.394528
O 4.590021 0.851077 0.332418
O 2.990071 1.947000 -1.695716
O 3.705086 -0.897874 1.597762
N 0.868013 1.006844 -1.832538
N 0.059018 -0.748881 -0.454747
C -3.576265 -0.447667 -0.363770
C -2.716133 -1.081593 -1.421115
C -0.116320 0.127538 -1.450735
C 2.354167 0.117986 -0.139918
C -4.833173 0.142283 -0.647654
C -3.147517 -0.438367 0.991710
C 2.194880 1.093334 -1.229443
C 1.287392 -0.733284 0.173452
C -5.647207 0.714416 0.346660
C -3.944055 0.130401 2.007600
C -5.195079 0.705714 1.686281
C 3.589916 -0.041810 0.677599
C 5.872530 0.739875 1.097752
C 6.784136 -0.318664 0.470862
H -1.969389 -1.765172 -0.989640
H -3.295681 -1.572337 -2.216828
H -2.172165 -0.878203 1.226218
H 0.712870 1.677699 -2.595356
H 1.423299 -1.455868 0.984500
H -6.611775 1.156550 0.081485
H -3.592371 0.124005 3.044370
H -5.820706 1.148477 2.468332
H 6.298404 1.752428 1.019382
H 5.637453 0.499010 2.149445
H 7.764883 -0.313627 0.981995
H 6.346573 -1.325584 0.574583
H 6.950692 -0.106311 -0.599042


