%chk=000219052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219052

0 1
Cl -0.480475 4.388722 1.713528
S -3.443885 -0.395551 -0.936044
O -4.870570 -0.271347 -0.708846
O -2.917848 -0.616698 -2.267410
O 4.560091 2.209327 -1.489034
O 2.557139 2.375475 -0.510045
N -2.957642 -1.718260 0.046401
C -0.868947 -2.859831 0.782237
C -0.276436 -1.564808 1.406624
C 0.358121 -3.674700 0.268987
C 1.106468 -1.460723 0.834830
C 1.476858 -2.674248 0.194607
C -1.818251 -2.555212 -0.399890
C 1.967852 -0.378553 0.858439
C 2.718952 -2.802469 -0.404569
C 3.228365 -0.508413 0.234971
C 3.599854 -1.704551 -0.382092
C 4.170268 0.665885 0.241046
C -2.623283 0.949087 -0.221547
C 3.620238 1.803332 -0.569886
C -1.301620 1.235877 -0.583213
C -3.287891 1.741202 0.721367
C -0.624462 2.301084 0.016644
C -2.629299 2.815764 1.323958
C -1.302910 3.072690 0.962243
H -1.418623 -3.433782 1.556974
H -0.240018 -1.642588 2.509372
H -0.896138 -0.675845 1.193223
H 0.169475 -4.159945 -0.703614
H 0.608271 -4.489520 0.973603
H -2.174151 -3.511425 -0.846330
H -1.252026 -2.035440 -1.210191
H 1.680244 0.563046 1.324131
H 3.015477 -3.726933 -0.894232
H -3.678988 -2.250905 0.541721
H 4.572763 -1.798162 -0.861261
H 5.180765 0.380198 -0.135138
H 4.338630 1.016953 1.286715
H -0.789153 0.631885 -1.341635
H -4.330747 1.525945 0.985301
H 0.417963 2.523156 -0.250031
H -3.138041 3.441038 2.057233
H 4.249908 2.967543 -2.054348


%chk=000219052-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219052

0 1
Cl -0.967073 4.923260 2.074314
S -3.047173 -0.278873 -1.128781
O -4.670186 -0.167593 -1.242713
O -2.070170 -0.466874 -2.422371
O 4.196256 1.871579 -1.975513
O 2.403594 2.354865 -0.589206
N -2.740909 -1.696766 0.069084
C -0.834007 -3.084532 0.904045
C -0.209621 -1.865408 1.651278
C 0.403712 -3.912364 0.416268
C 1.126597 -1.671756 0.949338
C 1.482504 -2.849632 0.239283
C -1.655991 -2.626722 -0.333272
C 1.964768 -0.543043 0.931002
C 2.686711 -2.902556 -0.487905
C 3.175017 -0.582702 0.188501
C 3.528242 -1.762559 -0.512675
C 4.068792 0.657075 0.109627
C -2.427149 1.228223 -0.185316
C 3.452608 1.707066 -0.804282
C -1.080546 1.600911 -0.326287
C -3.354102 1.933257 0.600030
C -0.625740 2.743166 0.372715
C -2.899418 3.076233 1.294266
C -1.544701 3.452439 1.171449
H -1.486736 -3.677054 1.570146
H -0.054431 -2.106005 2.722478
H -0.873328 -0.984338 1.610030
H 0.200680 -4.484256 -0.508981
H 0.702917 -4.646923 1.190801
H -2.049192 -3.510213 -0.875450
H -0.990402 -2.094721 -1.041923
H 1.682816 0.371345 1.466466
H 2.971359 -3.805204 -1.040687
H -3.677331 -2.133462 0.154232
H 4.458700 -1.785628 -1.092270
H 5.071172 0.399218 -0.264517
H 4.172266 1.116189 1.109864
H -0.397390 1.040478 -0.971822
H -4.400139 1.614907 0.647688
H 0.419151 3.049403 0.279336
H -3.584878 3.660729 1.913920
H 3.749047 2.537140 -2.567390


