data_[Y6Pd2Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.5764]
_cell_length_b [7.1401]
_cell_length_c [7.1508]
_cell_angle_alpha [97.8235]
_cell_angle_beta [112.7265]
_cell_angle_gamma [90.5656]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Y3PdPt]
_chemical_formula_sum '[Y6 Pd2 Pt2]'
_cell_volume [259.5565]
_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
[
  Y  Y0  2  0.1030  0.2467  0.0041  1
  Y  Y1  2  0.2237  0.8449  0.6667  1
  Y  Y2  2  0.4469  0.3347  0.6641  1
  Pd  Pd3  2  0.0454  0.5170  0.3217  1
  Pt  Pt4  2  0.2622  0.0147  0.3220  1
]