data_[K1P1H2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4080]
_cell_length_b [7.0590]
_cell_length_c [8.6391]
_cell_angle_alpha [77.8045]
_cell_angle_beta [80.5218]
_cell_angle_gamma [67.9872]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KP(HCl4)2]
_chemical_formula_sum '[K1 P1 H2 Cl8]'
_cell_volume [352.5382]
_cell_formula_units_Z [1]
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
[
  K  K0  1  0.0000  0.0000  0.5000  1.0
  P  P1  1  0.0000  0.0000  0.0000  1.0
  H  H2  2  0.4609  0.7387  0.7513  1.0
  Cl  Cl3  2  0.0755  0.1895  0.1349  1.0
  Cl  Cl4  2  0.0841  0.1871  0.7819  1.0
  Cl  Cl5  2  0.3490  0.7906  0.9990  1.0
  Cl  Cl6  2  0.4752  0.2900  0.3973  1.0
]