data_[Ca22Cd18Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Cd  1.6900  1.5500  1.0900
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [14.6120]
_cell_length_b [21.8570]
_cell_length_c [3.9248]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Ca11Cd9Pt4]
_chemical_formula_sum '[Ca22 Cd18 Pt8]'
_cell_volume [1253.4964]
_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
[
  Ca  Ca0  8  0.2470  0.1680  0.0000  1
  Ca  Ca1  4  0.0000  0.1651  0.0000  1
  Ca  Ca2  4  0.0000  0.3722  0.0000  1
  Ca  Ca3  4  0.1941  0.5000  0.0000  1
  Ca  Ca4  2  0.0000  0.0000  0.0000  1
  Cd  Cd5  8  0.1061  0.2654  0.5000  1
  Cd  Cd6  8  0.1451  0.0720  0.5000  1
  Cd  Cd7  2  0.0000  0.5000  0.5000  1
  Pt  Pt8  8  0.1494  0.4006  0.5000  1
]