data_image0
_chemical_formula_structural       Al2Br6
_chemical_formula_sum              "Al2 Br6"
_cell_length_a       6.45059974606253
_cell_length_b       6.9402694863638725
_cell_length_c       20.55192907
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    89.99999967041629

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  'x, y, z'

loop_
  _atom_site_type_symbol
  _atom_site_label
  _atom_site_symmetry_multiplicity
  _atom_site_fract_x
  _atom_site_fract_y
  _atom_site_fract_z
  _atom_site_occupancy
  Al  Al1       1.0  9.301481506139223e-09  0.4999999793693983  0.5249316467205967  1.0000
  Al  Al2       1.0  0.5000000196832449  1.0091224680193251e-08  0.4750683532794034  1.0000
  Br  Br1       1.0  0.2639667241492571  0.15584714716684442  0.5416490691498869  1.0000
  Br  Br2       1.0  0.7360332656094838  0.8441528634534587  0.5416490691498869  1.0000
  Br  Br3       1.0  0.23603326569683133  0.6558471265359542  0.4583509308501132  1.0000
  Br  Br4       1.0  0.7639667333633702  0.3441528826434826  0.4583509308501132  1.0000
  Br  Br5       1.0  2.0623047269095126e-14  0.5000000096275893  0.6349941154210105  1.0000
  Br  Br6       1.0  0.4999999995301216  0.999999980356951  0.3650058845789895  1.0000