data_[Cd4Pd2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  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 [7.4601]
_cell_length_b [14.5184]
_cell_length_c [2.8259]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.5553]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd2PdPt6]
_chemical_formula_sum '[Cd4 Pd2 Pt12]'
_cell_volume [300.8870]
_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
[
  Cd  Cd0  4  0.0000  0.1689  0.5000  1.0
  Pd  Pd1  2  0.0000  0.0000  0.0000  1.0
  Pt  Pt2  8  0.1705  0.3376  0.8406  1.0
  Pt  Pt3  4  0.1661  0.5000  0.3370  1.0
]