data_[Re4Pd4Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.9127]
_cell_length_b [3.8630]
_cell_length_c [5.6108]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0873]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [RePdPt]
_chemical_formula_sum '[Re4 Pd4 Pt4]'
_cell_volume [183.6342]
_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
[
  Re  Re0  2  0.1860  0.5000  0.5064  1.0
  Re  Re1  2  0.3257  0.0000  0.3464  1.0
  Pd  Pd2  2  0.0018  0.0000  0.6715  1.0
  Pd  Pd3  2  0.1772  0.5000  0.0132  1.0
  Pt  Pt4  2  0.0096  0.0000  0.1909  1.0
  Pt  Pt5  2  0.3312  0.0000  0.8399  1.0
]