%chk=000264578.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264578

0 1
Cl -4.291135 -1.011389 -2.101315
Cl -1.772581 3.135352 1.767764
Cl -3.319897 4.061810 -0.762952
S -2.670020 -2.005088 0.588893
O -3.696815 -2.838826 0.017359
O -2.384156 -2.067903 1.995849
O 5.349928 1.448571 0.285572
O 3.394991 1.201122 2.109790
N -1.266526 -2.491541 -0.321463
N -0.178450 -1.706270 -0.113741
C -2.894187 -0.338919 0.140974
C -3.580370 0.094017 -0.995289
C -2.326607 0.616104 0.999582
C 2.120370 -1.096465 -0.422641
C -2.460361 1.977451 0.719606
C -3.724804 1.457955 -1.289700
C -3.159518 2.394453 -0.425364
C 2.225950 -0.345456 0.764352
C 3.114766 -1.007487 -1.405699
C 4.335263 0.575100 -0.061762
C 3.328316 0.485905 0.942021
C 0.974419 -1.999924 -0.651648
C 4.226496 -0.169913 -1.230847
C 6.444779 1.598177 -0.649389
H -1.775762 0.296958 1.900005
H -1.224279 -3.372313 -0.853809
H -4.269388 1.781745 -2.180915
H 1.461582 -0.405726 1.541252
H 3.031676 -1.586448 -2.323692
H 1.186265 -2.874026 -1.282803
H 4.983971 -0.113977 -2.007654
H 4.222770 1.757858 2.139863
H 6.080105 2.007413 -1.596115
H 6.959134 0.642476 -0.786644
H 7.086276 2.320707 -0.127842


%chk=000264578-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264578

0 1
Cl -4.262073 -1.019747 -2.244437
Cl -2.994217 3.113320 2.520941
Cl -4.704548 4.040301 -0.129108
S -2.511844 -2.029151 0.551608
O -3.588726 -3.175079 0.156570
O -1.839507 -1.987035 2.033817
O 5.751273 1.356873 0.200881
O 3.388924 2.056957 1.228224
N -1.177955 -2.089861 -0.891618
N -0.059909 -1.384321 -0.544077
C -3.172283 -0.273107 0.254958
C -3.898160 0.109551 -0.887136
C -2.892523 0.633248 1.290337
C 2.319981 -0.922508 -0.731423
C -3.357803 1.957340 1.187614
C -4.361939 1.437220 -0.989394
C -4.091076 2.354606 0.046201
C 2.265071 0.219738 0.119818
C 3.562372 -1.317310 -1.298014
C 4.679424 0.529324 -0.175887
C 3.432380 0.937981 0.395636
C 1.125644 -1.712258 -1.028502
C 4.744261 -0.595047 -1.021080
C 7.082781 1.038123 -0.322367
H -2.320772 0.291061 2.160219
H -1.085080 -3.110069 -1.117907
H -4.927630 1.755762 -1.868621
H 1.314000 0.532347 0.558179
H 3.607001 -2.192828 -1.955882
H 1.253631 -2.580559 -1.704670
H 5.693687 -0.911966 -1.462556
H 4.306870 2.429747 1.310150
H 7.094104 1.093671 -1.427196
H 7.404767 0.032757 0.008606
H 7.752076 1.802420 0.097713


