data_[Cs1K2Ho1P2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  Ho  1.2300  1.7500  1.0410
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.6945]
_cell_length_b [5.6945]
_cell_length_c [8.1632]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [CsK2Ho(PO4)2]
_chemical_formula_sum '[Cs1 K2 Ho1 P2 O8]'
_cell_volume [229.2449]
_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
[
  Cs  Cs0  1  0.0000  0.0000  0.5000  1.0
  K  K1  2  0.3333  0.6667  0.7429  1.0
  Ho  Ho2  1  0.0000  0.0000  0.0000  1.0
  P  P3  2  0.3333  0.6667  0.2276  1.0
  O  O4  6  0.1840  0.8160  0.1617  1.0
  O  O5  2  0.3333  0.6667  0.4148  1.0
]