data_[Y2Zr2Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Zr  1.3300  1.5500  0.8600
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.4521]
_cell_length_b [3.5706]
_cell_length_c [10.4868]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [YZrPt2]
_chemical_formula_sum '[Y2 Zr2 Pt4]'
_cell_volume [166.7034]
_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  0.5000  0.0000  0.5167  1.0
  Zr  Zr1  2  0.0000  0.0000  0.2362  1.0
  Pt  Pt2  2  0.0000  0.0000  0.9636  1.0
  Pt  Pt3  2  0.5000  0.0000  0.7836  1.0
]