data_[Mg16In2Pb10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [8.8884]
_cell_length_b [8.8884]
_cell_length_c [9.2665]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Mg8InPb5]
_chemical_formula_sum '[Mg16 In2 Pb10]'
_cell_volume [732.0797]
_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  8  0.0745  0.1676  0.8479  1
  Mg  Mg1  8  0.0826  0.3385  0.4853  1
  In  In2  2  0.0000  0.5000  0.7500  1
  Pb  Pb3  8  0.1429  0.2681  0.1677  1
  Pb  Pb4  2  0.0000  0.0000  0.5000  1
]