%chk=000253188.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253188

0 1
Cl -5.239707 0.524971 -1.655241
Cl -3.505568 1.758601 0.248711
Cl -4.141704 -0.996590 0.487553
S -2.447520 -0.110364 -1.816995
O 2.010914 -1.701988 2.272521
O 0.563480 -3.128993 1.559122
O 0.662600 3.588755 -0.027886
O 2.166430 2.679341 1.228476
N 2.878784 -0.023891 -0.017559
N 1.119826 -2.042819 1.499543
N 1.247598 2.614772 0.421099
C 1.557264 0.077485 0.218119
C 0.724053 -1.093431 0.483040
C -0.527499 -1.198393 -0.172754
C 0.814306 1.305013 -0.024405
C -1.039162 -0.049155 -0.821287
C -0.439793 1.199680 -0.635969
C -1.292580 -2.460568 -0.139640
C 3.631631 -1.288772 0.148563
C 3.731074 1.144073 -0.338355
C -3.814448 0.291404 -0.666205
H -0.954620 2.125359 -0.950703
H -2.128008 -2.519434 -0.854888
H -0.654954 -3.348347 -0.316216
H -1.728493 -2.637051 0.866266
H 3.814697 -1.509526 1.227334
H 4.613582 -1.236690 -0.352398
H 3.085060 -2.143132 -0.291577
H 3.267895 1.776113 -1.118411
H 4.718417 0.828175 -0.716170
H 3.904743 1.778205 0.564014


%chk=000253188-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253188

0 1
Cl -5.596521 0.369207 -1.340345
Cl -3.637479 2.294878 -0.055201
Cl -3.953098 -0.481260 1.075776
S -2.700528 -0.145849 -1.782488
O 1.716032 -1.903280 2.318741
O 1.100154 -3.482496 0.789188
O 0.789388 3.589508 -0.450992
O 2.011690 2.693549 1.261093
N 2.951868 0.006741 0.166541
N 1.218180 -2.250804 1.169824
N 1.249106 2.579241 0.215266
C 1.578210 0.034372 0.166683
C 0.749489 -1.160981 0.300943
C -0.550263 -1.279252 -0.264317
C 0.825904 1.228091 -0.174227
C -1.104435 -0.106452 -0.869589
C -0.444000 1.130440 -0.765317
C -1.332043 -2.573930 -0.191668
C 3.731303 -1.209548 0.482976
C 3.752256 1.183936 -0.235992
C -3.934897 0.503353 -0.512368
H -0.925524 2.055026 -1.094554
H -2.356124 -2.425059 -0.560372
H -0.841422 -3.358086 -0.792562
H -1.381596 -2.962827 0.840434
H 3.747685 -1.408947 1.569589
H 4.759866 -1.071787 0.120903
H 3.302648 -2.091737 -0.023627
H 3.223236 1.757710 -1.016231
H 4.705570 0.828903 -0.656057
H 3.943646 1.860141 0.615653


