data_[K2Pr2Zn2Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Pr  1.1300  1.8500  1.0600
  Zn  1.6500  1.3500  0.8800
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.2682]
_cell_length_b [4.2593]
_cell_length_c [9.9446]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.5916]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KPrZnSe3]
_chemical_formula_sum '[K2 Pr2 Zn2 Se6]'
_cell_volume [378.1309]
_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  2  0.1986  0.2500  0.2279  1.0
  Pr  Pr1  2  0.3305  0.7500  0.8534  1.0
  Zn  Zn2  2  0.0825  0.2500  0.6057  1.0
  Se  Se3  2  0.1032  0.2500  0.8557  1.0
  Se  Se4  2  0.1943  0.7500  0.5274  1.0
  Se  Se5  2  0.4509  0.7500  0.1602  1.0
]