data_[Cs4Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.8897]
_cell_length_b [4.3401]
_cell_length_c [7.5430]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.4240]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsSb2]
_chemical_formula_sum '[Cs4 Sb8]'
_cell_volume [499.3805]
_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
[
  Cs  Cs0  4  0.1248  0.0000  0.9942  1.0
  Sb  Sb1  4  0.0590  0.5000  0.4005  1.0
  Sb  Sb2  4  0.1895  0.0000  0.5594  1.0
]