data_[Ti10Pd10Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.0857]
_cell_length_b [3.8031]
_cell_length_c [9.0271]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.7386]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ti5Pd5Pt2]
_chemical_formula_sum '[Ti10 Pd10 Pt4]'
_cell_volume [376.8327]
_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  4  0.1550  0.0000  0.4856  1.0
  Ti  Ti1  4  0.2423  0.5000  0.7633  1.0
  Ti  Ti2  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd3  4  0.0936  0.5000  0.2581  1.0
  Pd  Pd4  4  0.1570  0.5000  0.9987  1.0
  Pd  Pd5  2  0.0000  0.5000  0.5000  1.0
  Pt  Pt6  4  0.0856  0.0000  0.7453  1.0
]