%chk=000281406.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281406

0 1
Cl 7.010053 3.826326 2.472464
S -5.323347 -1.017378 -0.369031
O -5.955374 -2.061892 0.415830
O -5.914005 -0.601262 -1.610582
O 4.745050 -1.321345 -1.345022
O 2.303307 -4.029401 0.850988
N -5.399783 0.294255 0.785081
N 3.543653 -0.548717 0.472460
N 1.335572 -1.882814 -0.606677
N 0.379641 -2.459247 -1.151501
N -4.038679 1.686194 -0.530564
C -3.656530 -1.384630 -0.565429
C -3.031529 -2.265654 0.327593
C -2.934171 -0.820431 -1.623154
C 2.678405 -2.434380 -0.916260
C -0.967957 -2.007073 -0.890101
C -1.682462 -2.581103 0.177280
C -1.581036 -1.125749 -1.793362
C 3.755240 -1.364249 -0.638582
C -4.843776 1.561938 0.578585
C 2.999865 -3.700071 -0.071512
C 4.412534 0.505000 0.910391
C -5.081113 2.637786 1.473484
C 5.629167 0.797756 0.269019
C 3.999657 1.246623 2.039273
C 4.217429 -4.428540 -0.525799
C 6.433339 1.828984 0.755732
C 4.806812 2.274898 2.521902
C -4.480027 3.861588 1.199473
C 6.014224 2.553568 1.873823
C -3.472776 2.898487 -0.766098
C -3.664669 4.006813 0.068301
H -3.605445 -2.717853 1.146657
H -3.429058 -0.130763 -2.322099
H 2.782863 -2.715842 -2.007053
H -5.998146 0.183781 1.615302
H -1.189292 -3.266030 0.868277
H -1.016900 -0.688298 -2.615566
H 2.657461 -0.642824 0.988423
H -5.718951 2.509690 2.341529
H 5.949792 0.224775 -0.609533
H 3.058058 1.024268 2.539267
H 3.980142 -5.135664 -1.337181
H 5.011752 -3.764107 -0.909287
H 4.654211 -5.028256 0.289827
H 7.379608 2.064739 0.265368
H 4.500580 2.854747 3.393839
H -4.644581 4.710856 1.864701
H -2.845287 2.959664 -1.663893
H -3.194824 4.958339 -0.158981


%chk=000281406-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281406

0 1
Cl 7.092398 2.839245 3.972207
S -4.846338 -0.769305 0.949187
O -4.900358 -1.420073 2.441398
O -5.960608 -1.134678 -0.166400
O 5.197373 -1.395619 -1.346448
O 2.670990 -4.477456 -0.073603
N -4.832828 1.042546 1.387492
N 3.791302 -0.831043 0.467332
N 1.665544 -1.945544 -0.588091
N 0.644445 -1.951279 -1.385120
N -4.693149 1.770696 -0.848725
C -3.123417 -1.079908 0.243795
C -2.134246 -1.500154 1.151219
C -2.934076 -0.956630 -1.140529
C 2.924792 -2.328738 -1.261934
C -0.615989 -1.651723 -0.757860
C -0.855350 -1.785955 0.637969
C -1.654609 -1.266028 -1.644516
C 4.096353 -1.457050 -0.723185
C -5.071323 2.043742 0.435293
C 3.260262 -3.841181 -0.975666
C 4.609269 0.023118 1.254283
C -5.625570 3.296840 0.828995
C 5.941200 0.363274 0.894636
C 4.046866 0.548298 2.448756
C 4.321415 -4.427756 -1.882178
C 6.692713 1.220721 1.725863
C 4.797474 1.403700 3.278926
C -5.758297 4.300177 -0.149052
C 6.115601 1.730450 2.904084
C -4.854987 2.751287 -1.780856
C -5.370318 4.031496 -1.484729
H -2.376476 -1.622303 2.211703
H -3.754623 -0.626330 -1.782005
H 2.873440 -2.196639 -2.360312
H -5.209381 1.142153 2.339814
H -0.049251 -2.137100 1.288697
H -1.436991 -1.207128 -2.715028
H 2.821360 -1.005052 0.778060
H -5.934275 3.472579 1.864470
H 6.373880 -0.039882 -0.022796
H 3.020335 0.288676 2.733892
H 3.887453 -4.600815 -2.886617
H 5.158993 -3.718657 -2.011159
H 4.675643 -5.388150 -1.477293
H 7.718216 1.486299 1.453450
H 4.364350 1.806378 4.198673
H -6.173280 5.275703 0.125082
H -4.555142 2.489053 -2.801665
H -5.472087 4.783244 -2.271907


