data_[Ce6Th4Os4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Th  1.3000  1.8000  1.0800
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.6699]
_cell_length_b [3.8840]
_cell_length_c [8.5358]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4865]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce3(ThOs)2]
_chemical_formula_sum '[Ce6 Th4 Os4]'
_cell_volume [364.7308]
_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  4  0.1304  0.5000  0.4352  1
  Ce  Ce1  2  0.0000  0.5000  0.0000  1
  Th  Th2  4  0.1566  0.0000  0.7971  1
  Os  Os3  4  0.1580  0.0000  0.1895  1
]