data_[Mg10In4Hg2Pd4]
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
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.4785]
_cell_length_b [10.4785]
_cell_length_c [3.8249]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Mg5In2HgPd2]
_chemical_formula_sum '[Mg10 In4 Hg2 Pd4]'
_cell_volume [419.9729]
_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  0.0758  0.2034  0.5000  1.0
  Mg  Mg1  2  0.0000  0.5000  0.5000  1.0
  In  In2  4  0.1696  0.6696  0.0000  1.0
  Hg  Hg3  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd4  4  0.1269  0.3731  0.0000  1.0
]