data_[Hg2Pd4Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.5582]
_cell_length_b [4.4858]
_cell_length_c [9.6251]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.9528]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Hg(PdPb)2]
_chemical_formula_sum '[Hg2 Pd4 Pb4]'
_cell_volume [238.6839]
_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
[
  Hg  Hg0  2  0.4103  0.7500  0.2187  1.0
  Pd  Pd1  2  0.2306  0.2500  0.3490  1.0
  Pd  Pd2  2  0.3518  0.2500  0.0385  1.0
  Pb  Pb3  2  0.1297  0.7500  0.8829  1.0
  Pb  Pb4  2  0.2542  0.7500  0.5383  1.0
]