data_[Cr16In4Cu4Se32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  In  1.7800  1.5500  0.9400
  Cu  1.9000  1.3500  0.8200
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [10.7034]
_cell_length_b [10.7034]
_cell_length_c [10.7034]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [216]
_chemical_formula_structural [Cr4InCuSe8]
_chemical_formula_sum '[Cr16 In4 Cu4 Se32]'
_cell_volume [1226.1981]
_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  16  0.1205  0.1205  0.3795  1.0
  In  In1  4  0.0000  0.0000  0.0000  1.0
  Cu  Cu2  4  0.2500  0.2500  0.7500  1.0
  Se  Se3  16  0.1160  0.1160  0.6160  1.0
  Se  Se4  16  0.1405  0.1405  0.1405  1.0
]