data_[Te4Rh2Br2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  Rh  2.2800  1.3500  0.7450
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.9082]
_cell_length_b [6.9166]
_cell_length_c [8.2949]
_cell_angle_alpha [82.3826]
_cell_angle_beta [88.2775]
_cell_angle_gamma [73.7163]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Te2RhBr]
_chemical_formula_sum '[Te4 Rh2 Br2]'
_cell_volume [213.3243]
_cell_formula_units_Z [2]
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
[
  Te  Te0  2  0.1973  0.0870  0.6476  1.0
  Te  Te1  2  0.4700  0.5348  0.6671  1.0
  Rh  Rh2  2  0.1651  0.1906  0.3326  1.0
  Br  Br3  2  0.1580  0.2360  0.0251  1.0
]