%chk=000241588.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241588

0 1
Br 0.720356 3.312590 -0.257849
Br -0.720227 -3.313438 -0.247804
O 1.905118 -0.042364 1.190873
O -1.903422 0.045330 1.193117
O 3.031704 1.007361 -0.476398
O -3.031777 -1.008709 -0.470234
C 0.016375 0.766399 -1.409949
C -0.017645 -0.770434 -1.407809
C 0.610601 1.357432 -0.132878
C -0.610349 -1.357935 -0.128399
C 2.003296 0.811240 0.114290
C -2.002756 -0.811093 0.118893
C 3.090524 -0.810130 1.581704
C -3.088471 0.814034 1.583232
C 3.191340 -2.044157 0.711431
C -3.190526 2.045619 0.709667
H -1.010343 1.168883 -1.554838
H 0.594161 1.107988 -2.298668
H 1.008911 -1.173323 -1.552775
H -0.596500 -1.114472 -2.294874
H -0.058749 1.148922 0.751355
H 0.060055 -1.146933 0.754435
H 2.854883 -1.035231 2.638226
H 3.977696 -0.155955 1.506379
H -2.851591 1.042092 2.638842
H -3.975632 0.159516 1.510780
H 3.965298 -2.729696 1.080031
H 2.245525 -2.603319 0.683055
H 3.452128 -1.787757 -0.325087
H -3.964069 2.732114 1.077359
H -2.244808 2.604799 0.678500
H -3.452606 1.786326 -0.325809


%chk=000241588-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241588

0 1
Br 1.516168 3.135657 -0.462591
Br -1.515135 -3.136683 -0.449806
O 2.677185 0.176743 1.109601
O -2.675622 -0.173897 1.113701
O 3.058565 -0.001332 -1.191685
O -3.058832 -0.001821 -1.187730
C 0.216132 0.746553 -1.568135
C -0.217249 -0.751038 -1.565353
C 1.041116 1.144102 -0.338942
C -1.040436 -1.144546 -0.333677
C 2.363763 0.391210 -0.227590
C -2.363179 -0.391691 -0.223150
C 3.964324 -0.542029 1.392116
C -3.962837 0.545048 1.395406
C 3.747526 -2.057095 1.387366
C -3.746695 2.060191 1.386728
H -0.673744 1.396759 -1.634211
H 0.825112 0.917230 -2.472845
H 0.672540 -1.401451 -1.630597
H -0.827559 -0.924704 -2.468597
H 0.491400 1.088053 0.612172
H -0.489453 -1.085116 0.616508
H 4.252846 -0.164374 2.385498
H 4.705299 -0.235053 0.633517
H -4.250446 0.169750 2.389947
H -4.704267 0.235879 0.638143
H 4.682989 -2.564380 1.687357
H 2.956643 -2.346114 2.100822
H 3.472864 -2.414503 0.380762
H -4.682171 2.567805 1.686125
H -2.955433 2.351333 2.098897
H -3.472914 2.415216 0.379042


