data_[Tb4Bi4H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Bi  2.0200  1.6000  1.0350
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.1153]
_cell_length_b [3.7316]
_cell_length_c [5.7806]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.1404]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TbBiH]
_chemical_formula_sum '[Tb4 Bi4 H4]'
_cell_volume [257.2535]
_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  0.1471  0.0000  0.3005  1.0
  Bi  Bi1  4  0.0861  0.5000  0.7886  1.0
  H  H2  4  0.2338  0.5000  0.3718  1.0
]