data_[Tb8Pd2Br10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pd  2.2000  1.4000  0.8462
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.7755]
_cell_length_b [3.9735]
_cell_length_c [8.6632]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.5023]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb4PdBr5]
_chemical_formula_sum '[Tb8 Pd2 Br10]'
_cell_volume [630.9813]
_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
[
  Tb  Tb0  4  0.0028  0.0000  0.2217  1.0
  Tb  Tb1  4  0.1507  0.5000  0.0783  1.0
  Pd  Pd2  2  0.0000  0.5000  0.0000  1.0
  Br  Br3  4  0.1682  0.0000  0.3316  1.0
  Br  Br4  4  0.1786  0.0000  0.8420  1.0
  Br  Br5  2  0.0000  0.5000  0.5000  1.0
]