data_[Cs2Ce2Mg28]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ce  1.1200  1.8500  1.0800
  Mg  1.3100  1.5000  0.8600
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [10.8366]
_cell_length_b [6.8004]
_cell_length_c [11.1688]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [CsCeMg14]
_chemical_formula_sum '[Cs2 Ce2 Mg28]'
_cell_volume [823.0639]
_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
[
  Cs  Cs0  2  0.5000  0.0000  0.4043  1
  Ce  Ce1  2  0.5000  0.0000  0.8994  1
  Mg  Mg2  8  0.2217  0.2468  0.8915  1
  Mg  Mg3  4  0.0000  0.2459  0.5685  1
  Mg  Mg4  4  0.2510  0.0000  0.6526  1
  Mg  Mg5  4  0.2511  0.0000  0.1338  1
  Mg  Mg6  4  0.5000  0.2467  0.1526  1
  Mg  Mg7  2  0.0000  0.0000  0.3059  1
  Mg  Mg8  2  0.0000  0.0000  0.8095  1
]