data_[La4Bi4H24Ir8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Bi  2.0200  1.6000  1.0350
  H  2.2000  0.2500  0.0000
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.3951]
_cell_length_b [12.0386]
_cell_length_c [4.7084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.6366]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LaBi(H3Ir)2]
_chemical_formula_sum '[La4 Bi4 H24 Ir8]'
_cell_volume [472.6627]
_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
[
  La  La0  4  0.0000  0.1659  0.7500  1.0
  Bi  Bi1  4  0.0000  0.3989  0.2500  1.0
  H  H2  8  0.1435  0.0026  0.4809  1.0
  H  H3  8  0.1712  0.1876  0.3619  1.0
  H  H4  8  0.2073  0.3247  0.9821  1.0
  Ir  Ir5  8  0.2421  0.4220  0.7561  1.0
]