%chk=000273167.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273167

0 1
Br 4.717678 0.589866 0.059916
Cl -2.951962 0.491004 -2.078867
Cl -3.152540 1.748259 0.428850
S -1.551061 -0.714028 0.214444
O -1.868573 -1.791031 -0.680022
O -2.046788 -0.667219 1.560875
N -2.167479 0.785524 -0.586758
C 0.134667 -0.366658 0.174391
C 0.900676 -0.765838 -0.927051
C 0.728174 0.320558 1.239807
C 2.269524 -0.484395 -0.965320
C 2.096124 0.606896 1.211341
C 2.849292 0.200683 0.106121
H 0.434608 -1.306181 -1.760823
H 0.126767 0.631256 2.103602
H 2.868926 -0.796398 -1.823299
H 2.561167 1.141702 2.042293


%chk=000273167-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273167

0 1
Br 4.846842 0.582889 0.052745
Cl -3.149867 0.549231 -2.289412
Cl -3.571532 1.816700 0.477283
S -1.602410 -0.759242 0.246871
O -1.908741 -2.004285 -0.758156
O -2.102721 -0.738260 1.796767
N -2.298920 1.143829 -0.725895
C 0.234495 -0.369532 0.189713
C 0.963575 -0.793332 -0.934209
C 0.797876 0.325230 1.273359
C 2.346685 -0.509285 -0.969693
C 2.181436 0.606206 1.229920
C 2.934646 0.189727 0.108819
H 0.479107 -1.346190 -1.744969
H 0.188490 0.619610 2.133425
H 2.950782 -0.828613 -1.822942
H 2.659455 1.139318 2.055873


