data_[Tm2Mg6Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Mg  1.3100  1.5000  0.8600
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [4.9147]
_cell_length_b [9.6557]
_cell_length_c [12.8312]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2550]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Tm(MgPb2)3]
_chemical_formula_sum '[Tm2 Mg6 Pb12]'
_cell_volume [584.5680]
_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  2  0.0000  0.0000  0.0000  1.0
  Mg  Mg1  4  0.3802  0.1724  0.8394  1.0
  Mg  Mg2  2  0.5000  0.0000  0.5000  1.0
  Pb  Pb3  4  0.0499  0.6726  0.0600  1.0
  Pb  Pb4  4  0.1863  0.5089  0.7579  1.0
  Pb  Pb5  4  0.4301  0.6838  0.3810  1.0
]