%chk=000183564.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183564

0 1
Br 0.223542 -1.885472 0.903766
S -0.373995 0.937274 -0.973816
O -2.812123 -0.390622 -1.595260
O -2.749212 -1.494905 0.361117
N -3.582119 1.028404 1.521317
C -2.716729 0.987114 0.319924
C -1.251618 1.367434 0.564716
C 1.243429 0.504567 -0.412359
C -2.756980 -0.442198 -0.227633
C 1.554439 -0.651412 0.308222
C 2.267614 1.369595 -0.818852
C 2.886079 -0.947035 0.625855
C 3.597769 1.073681 -0.509068
C 3.905337 -0.083596 0.213997
H -3.174402 1.681178 -0.445993
H -1.143178 2.447846 0.767954
H -0.823585 0.831371 1.433377
H -3.508112 1.922743 1.995693
H -3.337256 0.294725 2.185500
H 2.030827 2.276630 -1.380794
H 3.134209 -1.849468 1.188394
H 4.393753 1.745029 -0.829998
H 4.942294 -0.316212 0.457731
H -2.783583 -1.292371 -2.017491


%chk=000183564-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183564

0 1
Br 0.795991 -2.326089 0.723098
S -0.282493 0.404226 -1.134442
O -3.533198 -0.231604 -1.659494
O -3.692843 -1.247240 0.425558
N -3.441624 1.373294 1.489983
C -2.733153 1.019111 0.255090
C -1.210825 0.786528 0.499852
C 1.434922 0.300358 -0.480793
C -3.368318 -0.266547 -0.278419
C 1.937785 -0.796527 0.264707
C 2.328483 1.357019 -0.798032
C 3.281954 -0.837034 0.696206
C 3.677773 1.323396 -0.383825
C 4.153362 0.226255 0.368979
H -2.864782 1.813275 -0.499314
H -0.764627 1.704572 0.917936
H -1.060122 -0.060643 1.189617
H -3.147122 2.243595 1.936185
H -3.590870 0.588161 2.130226
H 1.944070 2.203319 -1.376154
H 3.642903 -1.693368 1.273119
H 4.348185 2.148866 -0.644590
H 5.196439 0.188357 0.700415
H -3.885494 -1.106978 -1.979610


