data_[Y1H8Ir1Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  H  2.2000  0.2500  0.0000
  Ir  2.2000  1.3500  0.7650
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.4657]
_cell_length_b [4.4968]
_cell_length_c [5.9944]
_cell_angle_alpha [71.0060]
_cell_angle_beta [73.3530]
_cell_angle_gamma [77.3729]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [YH8IrPd2]
_chemical_formula_sum '[Y1 H8 Ir1 Pd2]'
_cell_volume [108.0018]
_cell_formula_units_Z [1]
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
[
  Y  Y0  1  0.0000  0.0000  0.5000  1.0
  H  H1  2  0.1125  0.6860  0.2302  1.0
  H  H2  2  0.2278  0.2164  0.0540  1.0
  H  H3  2  0.3114  0.8775  0.7897  1.0
  H  H4  2  0.4156  0.2998  0.5330  1.0
  Pd  Pd5  2  0.4595  0.4772  0.7524  1.0
  Ir  Ir6  1  0.0000  0.0000  0.0000  1.0
]