data_[Tc12B4Os4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tc  1.9000  1.3500  0.7417
  B  2.0400  0.8500  0.4100
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.0433]
_cell_length_b [5.7408]
_cell_length_c [6.7332]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.3139]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tc3BOs]
_chemical_formula_sum '[Tc12 B4 Os4]'
_cell_volume [262.5545]
_cell_formula_units_Z [4]
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
[
  Tc  Tc0  8  0.0234  0.2494  0.8136  1
  Tc  Tc1  4  0.1935  0.0000  0.6385  1
  B  B2  4  0.2499  0.0000  0.0017  1
  Os  Os3  4  0.1941  0.5000  0.6400  1
]