%chk=000182312.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182312

0 1
Cl 4.555429 2.690458 -2.147272
Cl -3.376718 3.256315 -1.370220
Cl -5.848820 -1.395386 -0.336313
S 3.209986 -0.733098 0.916603
O 3.775413 -2.058458 0.941969
O 3.361280 0.125834 2.053408
O 0.735878 0.839022 -0.354724
O -1.525622 -2.822491 1.434901
N 1.484168 -1.055528 0.750308
N -0.794260 -0.819686 0.432837
C 0.862501 -2.248999 1.380582
C 3.593893 0.085776 -0.568836
C 0.496997 -0.200104 0.214951
C -0.636409 -2.079086 1.130062
C 5.053264 0.540671 -0.563531
C -2.044593 -0.242635 0.009977
C 5.461321 1.168391 -1.890988
C -3.215145 -1.023748 0.040729
C -2.090213 1.093910 -0.429036
C -3.316546 1.621675 -0.831682
C -4.414324 -0.442824 -0.371914
C -4.499333 0.878697 -0.815030
H 1.076096 -2.305472 2.474801
H 1.250661 -3.192460 0.924488
H 3.391651 -0.541501 -1.465264
H 2.928303 0.978377 -0.746810
H 5.732565 -0.318544 -0.358413
H 5.220172 1.274810 0.260364
H 5.251646 0.507881 -2.753573
H 6.540260 1.420195 -1.902758
H -3.202181 -2.064165 0.387308
H -1.187995 1.717741 -0.465024
H -5.447824 1.312231 -1.133401


%chk=000182312-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182312

0 1
Cl 4.708758 2.254859 -2.894335
Cl -3.635968 3.507419 -0.581614
Cl -5.883678 -1.557898 -0.872519
S 3.163068 -0.545463 0.994036
O 3.892917 -1.928053 1.425210
O 3.134128 0.700274 2.023638
O 0.639491 0.867501 -0.429988
O -1.591136 -2.850355 1.485204
N 1.396096 -1.136819 0.581904
N -0.858264 -0.827932 0.430920
C 0.819240 -2.281310 1.299106
C 3.755353 0.040169 -0.755892
C 0.430527 -0.228450 0.139382
C -0.693010 -2.067693 1.110177
C 5.149190 0.654625 -0.602965
C -2.117095 -0.241668 0.051089
C 5.765778 0.993180 -1.965435
C -3.230882 -1.084867 -0.196687
C -2.233417 1.167522 -0.059853
C -3.478130 1.702659 -0.431009
C -4.449717 -0.485793 -0.555605
C -4.611450 0.906842 -0.685351
H 1.065060 -2.286147 2.377473
H 1.133517 -3.246220 0.868679
H 3.724650 -0.893522 -1.340420
H 2.970820 0.749444 -1.064691
H 5.833427 -0.062456 -0.104733
H 5.096559 1.561585 0.024510
H 5.834258 0.120514 -2.632628
H 6.751614 1.465731 -1.847833
H -3.153473 -2.167095 -0.090256
H -1.377093 1.818973 0.116706
H -5.569637 1.348242 -0.967720


