data_[Ti10Mo2Ir4Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Mo  2.1600  1.4500  0.7750
  Ir  2.2000  1.3500  0.7650
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.8126]
_cell_length_b [10.8126]
_cell_length_c [2.9052]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Ti5Mo(IrPt)2]
_chemical_formula_sum '[Ti10 Mo2 Ir4 Pt4]'
_cell_volume [339.6536]
_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
[
  Ti  Ti0  8  0.1377  0.8431  0.5000  1
  Ti  Ti1  2  0.0000  0.5000  0.5000  1
  Mo  Mo2  2  0.0000  0.0000  0.0000  1
  Ir  Ir3  4  0.1446  0.6446  0.0000  1
  Pt  Pt4  4  0.1520  0.3480  0.0000  1
]