%chk=000179313.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179313

0 1
Cl -5.036697 0.633428 -0.664518
S -3.226827 0.092168 1.664259
F 2.643872 3.479130 -0.526371
F 4.169235 2.477212 -1.590373
F 2.280011 2.797080 -2.493439
F 1.879050 -3.661913 -1.588851
F 1.723205 -2.382462 -3.263876
F 3.609933 -2.734382 -2.367537
F -3.276509 0.775133 -2.889887
F -1.357869 1.597640 -2.544887
F -1.578876 -0.487223 -2.855660
O 1.462773 -0.648914 3.262850
O -2.555157 -0.269311 3.606453
N -0.625131 -0.296043 2.397009
N -1.165751 0.116137 0.021142
C 1.397605 -0.289993 0.899067
C 2.387692 1.093246 -0.816010
C 2.131551 -1.294640 -1.171466
C 1.548621 -1.427593 0.094838
C 1.806236 0.973785 0.452327
C 0.819292 -0.431394 2.265557
C 2.545553 -0.036202 -1.633003
C -1.480762 -0.039497 1.291545
C 2.849957 2.428735 -1.336199
C 2.322370 -2.489226 -2.068334
C -1.331089 -0.408235 3.658051
C -2.325546 0.354806 -0.745645
C -3.504700 0.376910 -0.045813
C -0.581832 -0.674015 4.902735
C -2.134701 0.553971 -2.218151
H 1.206441 -2.399939 0.461276
H 1.662190 1.848271 1.093694
H 2.990645 0.064580 -2.630814
H 0.179343 0.102561 5.115755
H -0.005429 -1.619375 4.859279
H -1.257900 -0.731235 5.773897


%chk=000179313-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179313

0 1
Cl -4.874138 2.300621 -0.585850
S -2.995153 1.486500 1.723449
F 1.227319 3.305196 -0.634075
F 3.445543 3.020542 -0.271770
F 2.604514 2.763001 -2.359738
F 2.672584 -3.573626 -2.016516
F 3.542309 -1.937189 -3.332284
F 4.631414 -2.583230 -1.453905
F -3.814849 0.607808 -2.849890
F -1.616155 0.049843 -2.781184
F -3.188753 -1.471339 -2.194435
O 0.423948 -2.275179 2.345149
O -1.849586 0.834999 4.027675
N -0.790010 -0.250320 2.270344
N -1.772257 -0.253998 0.095799
C 1.082388 -0.708748 0.631632
C 2.105578 1.045148 -0.720792
C 2.592716 -1.291415 -1.194832
C 1.761638 -1.688915 -0.130245
C 1.262092 0.663646 0.341141
C 0.244842 -1.177616 1.774815
C 2.771172 0.075188 -1.500683
C -1.737430 0.212829 1.331772
C 2.335204 2.507639 -0.999645
C 3.338304 -2.331318 -1.992004
C -0.926297 0.055905 3.670256
C -2.757758 0.364627 -0.680807
C -3.512987 1.316884 -0.016241
C 0.077361 -0.533973 4.633602
C -2.854396 -0.098034 -2.104494
H 1.616698 -2.746968 0.107819
H 0.749436 1.429630 0.930589
H 3.402978 0.378049 -2.341027
H 1.117953 -0.408950 4.287236
H -0.092733 -1.616690 4.757386
H -0.052692 -0.027345 5.600655


