data_[Cs8P8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [6.2672]
_cell_length_b [7.2645]
_cell_length_c [12.9784]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [CsP]
_chemical_formula_sum '[Cs8 P8]'
_cell_volume [590.8807]
_cell_formula_units_Z [8]
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  0.1045  0.1192  0.0818  1.0
  Cs  Cs1  4  0.1597  0.3708  0.7097  1.0
  P  P2  4  0.0994  0.6010  0.9713  1.0
  P  P3  4  0.1575  0.1916  0.4140  1.0
]