data_[K6Ho2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ho  1.2300  1.7500  1.0410
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.5175]
_cell_length_b [7.9563]
_cell_length_c [13.0309]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.2395]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [K3HoCl6]
_chemical_formula_sum '[K6 Ho2 Cl12]'
_cell_volume [644.3202]
_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  4  0.2852  0.0715  0.7572  1.0
  K  K1  2  0.5000  0.0000  0.5000  1.0
  Ho  Ho2  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.0979  0.0556  0.2263  1.0
  Cl  Cl4  4  0.2444  0.7264  0.0763  1.0
  Cl  Cl5  4  0.3380  0.1799  0.0565  1.0
]