data_[Zr2Cd4Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Cd  1.6900  1.5500  1.0900
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.6540]
_cell_length_b [2.9606]
_cell_length_c [5.6518]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.3657]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [ZrCd2Pt]
_chemical_formula_sum '[Zr2 Cd4 Pt2]'
_cell_volume [159.3850]
_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
[
  Zr  Zr0  2  0.2574  0.5000  0.2863  1
  Cd  Cd1  2  0.2400  0.0000  0.7645  1
  Cd  Cd2  2  0.4973  0.5000  0.9841  1
  Pt  Pt3  2  0.0053  0.5000  0.4650  1
]