data_[Ce2B2Os2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  B  2.0400  0.8500  0.4100
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.9660]
_cell_length_b [3.9844]
_cell_length_c [6.3610]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.6093]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CeBOs]
_chemical_formula_sum '[Ce2 B2 Os2]'
_cell_volume [99.6316]
_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  0.2016  0.7500  0.6519  1
  B  B1  2  0.2804  0.7500  0.1516  1
  Os  Os2  2  0.2507  0.2500  0.0004  1
]