data_[Bi4H2Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.5121]
_cell_length_b [5.8796]
_cell_length_c [7.9883]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.4287]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Bi2HPd4]
_chemical_formula_sum '[Bi4 H2 Pd8]'
_cell_volume [242.6099]
_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
[
  Bi  Bi0  2  0.2522  0.2500  0.0280  1
  Bi  Bi1  2  0.2566  0.7500  0.3843  1
  Pd  Pd2  4  0.3334  0.0048  0.7111  1
  H  H3  2  0.1590  0.7500  0.7564  1
  Pd  Pd4  2  0.1888  0.2500  0.3731  1
  Pd  Pd5  2  0.2643  0.7500  0.0068  1
]