data_global
_amcsd_formula_title 'Br'
loop_
_publ_author_name
'Vonnegut B'
'Warren B'
_journal_name_full 'Journal of the American Chemical Society'
_journal_volume 58 
_journal_year 1936
_journal_page_first 2459
_journal_page_last 2461
_publ_section_title
;
 The Structure of Crystalline Bromine
 _cod_database_code 1010096
;
_database_code_amcsd 0017029
_chemical_formula_sum 'Br'
_cell_length_a 16.67
_cell_length_b 4.48
_cell_length_c 8.72
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 651.224
_exptl_crystal_density_diffrn      1.630
_symmetry_space_group_name_H-M 'C m c a'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,z'
  'x,1/2-y,1/2+z'
  '1/2+x,-y,1/2+z'
  '-x,1/2+y,1/2-z'
  '1/2-x,+y,1/2-z'
  '-x,y,z'
  '1/2-x,1/2+y,z'
  'x,-y,-z'
  '1/2+x,1/2-y,-z'
  'x,1/2+y,1/2-z'
  '1/2+x,+y,1/2-z'
  '-x,1/2-y,1/2+z'
  '1/2-x,-y,1/2+z'
  '-x,-y,-z'
  '1/2-x,1/2-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Br1   0.00000   0.13500   0.11000