data_[K12H2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.7105]
_cell_length_b [13.3564]
_cell_length_c [7.7058]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4768]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K6HCl5]
_chemical_formula_sum '[K12 H2 Cl10]'
_cell_volume [748.1611]
_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
[
  K  K0  8  0.2424  0.1608  0.2442  1
  K  K1  4  0.2391  0.0000  0.7587  1
  H  H2  2  0.0000  0.0000  0.0000  1
  Cl  Cl3  4  0.0000  0.1680  0.5000  1
  Cl  Cl4  4  0.0000  0.3335  0.0000  1
  Cl  Cl5  2  0.0000  0.5000  0.5000  1
]