data_[Hf4In5Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.6237]
_cell_length_b [3.3061]
_cell_length_c [9.3480]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.1151]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Hf4In5Pd2]
_chemical_formula_sum '[Hf4 In5 Pd2]'
_cell_volume [235.0053]
_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
[
  Hf  Hf0  2  0.1925  0.5000  0.8586  1.0
  Hf  Hf1  2  0.2187  0.5000  0.4322  1.0
  In  In2  2  0.1553  0.0000  0.1397  1.0
  In  In3  2  0.4622  0.0000  0.6697  1.0
  In  In4  1  0.5000  0.0000  0.0000  1.0
  Pd  Pd5  2  0.0807  0.0000  0.6359  1.0
]