data_[Tm12Be6B36Os6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Be  1.5700  1.0500  0.5900
  B  2.0400  0.8500  0.4100
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.0425]
_cell_length_b [5.0425]
_cell_length_c [30.7929]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Tm2BeB6Os]
_chemical_formula_sum '[Tm12 Be6 B36 Os6]'
_cell_volume [678.0638]
_cell_formula_units_Z [6]
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
[
  Tm  Tm0  6  0.0000  0.0000  0.1313  1
  Tm  Tm1  6  0.0000  0.0000  0.2946  1
  Be  Be2  3  -0.0000  -0.0000  0.5000  1
  Be  Be3  3  0.0000  0.0000  0.0000  1
  B  B4  18  0.1063  0.5532  0.7195  1
  B  B5  18  0.1110  0.2220  0.2120  1
  Os  Os6  6  0.0000  0.0000  0.4192  1
]