data_[Tl8B8Rh24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  B  2.0400  0.8500  0.4100
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [11.4954]
_cell_length_b [9.1594]
_cell_length_c [5.6706]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [TlBRh3]
_chemical_formula_sum '[Tl8 B8 Rh24]'
_cell_volume [597.0615]
_cell_formula_units_Z [8]
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  8  0.2500  0.0599  0.2500  1.0
  B  B1  8  0.0000  0.1693  0.9054  1.0
  Rh  Rh2  16  0.1200  0.6960  0.8836  1.0
  Rh  Rh3  8  0.0000  0.0531  0.2345  1.0
]