data_[Tl4Cu4Te4Rh4Se8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cu  1.9000  1.3500  0.8200
  Te  2.1000  1.4000  1.2933
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.7312]
_cell_length_b [15.1981]
_cell_length_c [10.0627]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [TlCuTeRhSe2]
_chemical_formula_sum '[Tl4 Cu4 Te4 Rh4 Se8]'
_cell_volume [570.6272]
_cell_formula_units_Z [4]
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
[
  Tl  Tl0  4  0.0000  0.2731  0.7500  1
  Cu  Cu1  4  0.0000  0.0498  0.2500  1
  Te  Te2  4  0.0000  0.4282  0.2500  1
  Rh  Rh3  4  0.0000  0.5000  0.0000  1
  Se  Se4  8  0.0000  0.1120  0.0322  1
]