data_[P2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  P  2.1900  1.0000  0.5500
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [7.8142]
_cell_length_b [7.8879]
_cell_length_c [6.6921]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [PCl5]
_chemical_formula_sum '[P2 Cl10]'
_cell_volume [412.4907]
_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
[
  P  P0  2  0.0000  0.5000  0.7988  1.0
  Cl  Cl1  4  0.0000  0.2267  0.8001  1.0
  Cl  Cl2  4  0.2243  0.5000  0.6440  1.0
  Cl  Cl3  2  0.0000  0.5000  0.1026  1.0
]