data_[Tm16Pt4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Pt  2.2800  1.3500  0.8050
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.6947]
_cell_length_b [13.2661]
_cell_length_c [5.4258]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.6157]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm8Pt2Pb]
_chemical_formula_sum '[Tm16 Pt4 Pb2]'
_cell_volume [605.5832]
_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  0.2058  0.1302  0.5838  1
  Tm  Tm1  4  0.0000  0.2497  0.0000  1
  Tm  Tm2  4  0.1048  0.5000  0.7983  1
  Pt  Pt3  4  0.0000  0.3027  0.5000  1
  Pb  Pb4  2  0.0000  0.0000  0.0000  1
]