data_[Mg8Tl4In2Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.4513]
_cell_length_b [3.5902]
_cell_length_c [8.9614]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.7558]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg4Tl2InPb2]
_chemical_formula_sum '[Mg8 Tl4 In2 Pb4]'
_cell_volume [480.6491]
_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
[
  Mg  Mg0  4  0.0157  0.5000  0.3117  1.0
  Mg  Mg1  4  0.1896  0.0000  0.3291  1.0
  Tl  Tl2  4  0.1676  0.5000  0.0065  1.0
  In  In3  2  0.0000  0.0000  0.0000  1.0
  Pb  Pb4  4  0.1365  0.0000  0.6247  1.0
]