data_[Ca10Al2Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Al  1.6100  1.2500  0.6750
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [6.9226]
_cell_length_b [13.3642]
_cell_length_c [5.3100]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Ca5AlCd2]
_chemical_formula_sum '[Ca10 Al2 Cd4]'
_cell_volume [491.2532]
_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  4  0.1257  0.2755  0.0000  1
  Ca  Ca1  4  0.1670  0.6039  0.5000  1
  Ca  Ca2  2  0.0000  0.0000  0.0000  1
  Al  Al3  2  0.0000  0.5000  0.0000  1
  Cd  Cd4  4  0.1486  0.8656  0.5000  1
]