data_[Cs2P2Cl8]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [10.2203]
_cell_length_b [5.6623]
_cell_length_c [8.3896]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [CsPCl4]
_chemical_formula_sum '[Cs2 P2 Cl8]'
_cell_volume [485.5119]
_cell_formula_units_Z [2]
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  2  0.0000  0.2595  0.9893  1.0
  P  P1  2  0.0000  0.7172  0.5375  1.0
  Cl  Cl2  4  0.1593  0.7351  0.7033  1.0
  Cl  Cl3  2  0.0000  0.3542  0.5027  1.0
  Cl  Cl4  2  0.0000  0.7610  0.1919  1.0
]