data_[Cr58]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
]
_symmetry_space_group_name_H-M [I-43m]
_cell_length_a [8.7591]
_cell_length_b [8.7591]
_cell_length_c [8.7591]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [217]
_chemical_formula_structural [Cr]
_chemical_formula_sum '[Cr58]'
_cell_volume [672.0156]
_cell_formula_units_Z [58]
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  24  0.0425  0.3610  0.6390  1
  Cr  Cr1  24  0.0930  0.0930  0.7156  1
  Cr  Cr2  8  0.1845  0.8155  0.8155  1
  Cr  Cr3  2  0.0000  0.0000  0.0000  1
]