data_[Tm10Bi8Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Bi  2.0200  1.6000  1.0350
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [I4/m]
_cell_length_a [9.9150]
_cell_length_b [9.9150]
_cell_length_c [6.2584]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [87]
_chemical_formula_structural [Tm5Bi4Pb]
_chemical_formula_sum '[Tm10 Bi8 Pb2]'
_cell_volume [615.2474]
_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
[
  Tm  Tm0  8  0.1001  0.2973  0.0000  1.0
  Tm  Tm1  2  0.0000  0.0000  0.5000  1.0
  Bi  Bi2  8  0.0984  0.3009  0.5000  1.0
  Pb  Pb3  2  0.0000  0.0000  0.0000  1.0
]