data_[K2Rb4Pr2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Rb  0.8200  2.3500  1.6600
  Pr  1.1300  1.8500  1.0600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.8226]
_cell_length_b [8.2116]
_cell_length_c [13.5040]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.3480]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [KRb2PrCl6]
_chemical_formula_sum '[K2 Rb4 Pr2 Cl12]'
_cell_volume [716.1770]
_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
[
  Rb  Rb0  4  0.2801  0.0669  0.2554  1.0
  K  K1  2  0.5000  0.0000  0.0000  1.0
  Pr  Pr2  2  0.0000  0.0000  0.5000  1.0
  Cl  Cl3  4  0.1165  0.0468  0.7336  1.0
  Cl  Cl4  4  0.2473  0.7230  0.5676  1.0
  Cl  Cl5  4  0.3369  0.1872  0.5534  1.0
]