data_[Hg4Bi12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.9136]
_cell_length_b [9.7793]
_cell_length_c [9.6437]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.2252]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HgBi3Pd]
_chemical_formula_sum '[Hg4 Bi12 Pd4]'
_cell_volume [557.5760]
_cell_formula_units_Z [4]
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
[
  Hg  Hg0  4  0.2475  0.5000  0.5685  1
  Bi  Bi1  8  0.2417  0.1683  0.7441  1
  Bi  Bi2  4  0.2465  0.5000  0.9066  1
  Pd  Pd3  4  0.0000  0.2499  0.0000  1
]