data_[Ho4Pu4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Pu  1.2800  1.7500  0.9675
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.5126]
_cell_length_b [5.5535]
_cell_length_c [9.1651]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.7216]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [HoPuPd3]
_chemical_formula_sum '[Ho4 Pu4 Pd12]'
_cell_volume [417.0745]
_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
[
  Ho  Ho0  4  0.3316  0.7223  0.3332  1
  Pu  Pu1  4  0.2250  0.2450  0.5568  1
  Pd  Pd2  4  0.0032  0.5011  0.7524  1
  Pd  Pd3  4  0.1228  0.7450  0.5309  1
  Pd  Pd4  4  0.4686  0.2068  0.3690  1
]