%chk=000299509.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299509

0 1
Br -4.208905 2.318679 0.159080
S 0.327151 -2.164298 -0.141698
O -5.264233 -0.586946 1.071021
O -5.275908 -0.450763 -1.093905
O 5.824153 1.001241 0.026430
O 5.631671 -1.150885 -0.106783
N -4.730870 -0.446496 -0.009837
N 5.169823 -0.025139 -0.034165
C -0.534669 0.314969 0.016348
C 0.926362 0.393119 0.013755
C -0.999263 -1.021559 -0.064108
C 1.528817 -0.888487 -0.068859
C -1.451940 1.376917 0.086718
C 1.733845 1.535977 0.080697
C -2.357070 -1.344171 -0.077284
C 2.906551 -1.055649 -0.086311
C -3.242343 -0.273929 -0.006725
C 3.690606 0.105286 -0.018313
C -2.803718 1.060280 0.073816
C 3.120419 1.389664 0.064439
H -1.112635 2.412196 0.149029
H 1.286558 2.528442 0.144625
H -2.705631 -2.377250 -0.139560
H 3.378756 -2.043262 -0.150182
H 3.777374 2.267062 0.115572


%chk=000299509-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299509

0 1
Br -4.033935 2.675279 0.218764
S 0.306636 -2.229973 -0.271355
O -5.558668 0.093900 0.725156
O -5.080054 -1.628941 -0.693280
O 5.892227 1.036534 0.063131
O 5.672653 -1.220225 -0.195754
N -4.745386 -0.594311 0.005802
N 5.182341 -0.034570 -0.054566
C -0.538645 0.330969 0.027303
C 0.917918 0.401445 0.027254
C -1.025496 -1.004314 -0.123602
C 1.524754 -0.886022 -0.125869
C -1.468681 1.391941 0.141688
C 1.750108 1.543913 0.155216
C -2.397706 -1.282823 -0.150430
C 2.917944 -1.055345 -0.155806
C -3.307538 -0.211636 -0.003890
C 3.703066 0.108448 -0.026359
C -2.851748 1.132920 0.134227
C 3.145835 1.403221 0.128988
H -1.119227 2.424374 0.230766
H 1.306548 2.537269 0.275150
H -2.797643 -2.291585 -0.281284
H 3.404617 -2.026825 -0.272212
H 3.814982 2.261355 0.224762


