data_[Tb6B16Os6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  B  2.0400  0.8500  0.4100
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.3565]
_cell_length_b [9.3454]
_cell_length_c [10.7537]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Tb3B8Os3]
_chemical_formula_sum '[Tb6 B16 Os6]'
_cell_volume [337.3185]
_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
[
  Tb  Tb0  4  0.0000  0.0000  0.2108  1
  Tb  Tb1  2  0.0000  0.0000  0.5000  1
  B  B2  8  0.0000  0.2945  0.1948  1
  B  B3  8  0.0000  0.2953  0.3605  1
  Os  Os4  4  0.0000  0.2371  0.0000  1
  Os  Os5  2  0.0000  0.5000  0.5000  1
]