data_[Tb4B16Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  B  2.0400  0.8500  0.4100
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [5.9736]
_cell_length_b [11.5809]
_cell_length_c [3.5824]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [TbB4Rh]
_chemical_formula_sum '[Tb4 B16 Rh4]'
_cell_volume [247.8278]
_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
[
  Tb  Tb0  4  0.1308  0.1489  0.0000  1
  B  B1  4  0.0228  0.6925  0.5000  1
  B  B2  4  0.1120  0.5468  0.5000  1
  B  B3  4  0.1365  0.9689  0.5000  1
  B  B4  4  0.2108  0.8131  0.5000  1
  Rh  Rh5  4  0.1414  0.4056  0.0000  1
]