data_[Hf10Sn4Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.6165]
_cell_length_b [7.3979]
_cell_length_c [6.8063]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.9589]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Hf5(SnPd6)2]
_chemical_formula_sum '[Hf10 Sn4 Pd24]'
_cell_volume [677.2571]
_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
[
  Hf  Hf0  4  0.1639  0.5000  0.9368  1
  Hf  Hf1  4  0.2499  0.0000  0.5447  1
  Hf  Hf2  2  0.0000  0.0000  0.5000  1
  Sn  Sn3  4  0.0000  0.2043  0.0000  1
  Pd  Pd4  8  0.1054  0.3008  0.5890  1
  Pd  Pd5  8  0.1942  0.2063  0.2094  1
  Pd  Pd6  4  0.0471  0.5000  0.2407  1
  Pd  Pd7  4  0.1418  0.0000  0.8514  1
]