data_[Cr84Re8C24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  Re  1.9000  1.3500  0.7125
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [10.6194]
_cell_length_b [10.6194]
_cell_length_c [10.6194]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [225]
_chemical_formula_structural [Cr21(ReC3)2]
_chemical_formula_sum '[Cr84 Re8 C24]'
_cell_volume [1197.5777]
_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
[
  Cr  Cr0  48  0.0000  0.1691  0.1691  1
  Cr  Cr1  32  0.1163  0.1163  0.3837  1
  Cr  Cr2  4  0.0000  0.0000  0.0000  1
  Re  Re3  8  0.2500  0.2500  0.2500  1
  C  C4  24  0.0000  0.0000  0.2754  1
]