data_[Rb1Te1Au1Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Te  2.1000  1.4000  1.2933
  Au  2.5400  1.3500  1.0700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.0994]
_cell_length_b [7.5535]
_cell_length_c [7.5866]
_cell_angle_alpha [108.3272]
_cell_angle_beta [100.8143]
_cell_angle_gamma [102.5207]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [RbTeAuBr6]
_chemical_formula_sum '[Rb1 Te1 Au1 Br6]'
_cell_volume [362.3650]
_cell_formula_units_Z [1]
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
[
  Rb  Rb0  1  0.8863  0.0030  0.0800  1.0
  Te  Te1  1  0.3300  0.4709  0.6584  1.0
  Au  Au2  1  0.6509  0.6060  0.2586  1.0
  Br  Br3  1  0.0218  0.5059  0.4368  1.0
  Br  Br4  1  0.1001  0.2014  0.7338  1.0
  Br  Br5  1  0.3272  0.7830  0.9599  1.0
  Br  Br6  1  0.3866  0.1933  0.3624  1.0
  Br  Br7  1  0.5936  0.7753  0.5674  1.0
  Br  Br8  1  0.7036  0.4613  0.9427  1.0
]