data_[Re6Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.1471]
_cell_length_b [3.1471]
_cell_length_c [29.9829]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [139]
_chemical_formula_structural [Re3Sb4]
_chemical_formula_sum '[Re6 Sb8]'
_cell_volume [296.9609]
_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
[
  Re  Re0  4  0.0000  0.0000  0.2763  1
  Re  Re1  2  0.0000  0.0000  0.0000  1
  Sb  Sb2  4  0.0000  0.0000  0.1624  1
  Sb  Sb3  4  0.0000  0.0000  0.4431  1
]