data_[Ce2Sn6Os2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Sn  1.9600  1.4500  0.8300
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [4.7734]
_cell_length_b [4.7734]
_cell_length_c [11.1310]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [CeSn3Os]
_chemical_formula_sum '[Ce2 Sn6 Os2]'
_cell_volume [253.6232]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.4260  1
  Sn  Sn1  4  0.0000  0.5000  0.1632  1
  Sn  Sn2  2  0.0000  0.0000  0.9854  1
  Os  Os3  2  0.0000  0.0000  0.7582  1
]