data_[Ba4H2Pd4Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.7634]
_cell_length_b [4.8175]
_cell_length_c [8.2366]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.0536]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2H(PdPb)2]
_chemical_formula_sum '[Ba4 H2 Pd4 Pb4]'
_cell_volume [372.5195]
_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
[
  Ba  Ba0  4  0.0590  0.5000  0.8253  1.0
  Pd  Pd1  4  0.1755  0.0000  0.2331  1.0
  H  H2  2  0.0000  0.0000  0.0000  1.0
  Pb  Pb3  4  0.1722  0.0000  0.5873  1.0
]