data_[K1Rb2Mn1Cl8]
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
  Mn  1.5500  1.4000  0.6483
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5967]
_cell_length_b [6.8559]
_cell_length_c [9.0526]
_cell_angle_alpha [80.7582]
_cell_angle_beta [77.5156]
_cell_angle_gamma [72.3136]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KRb2MnCl8]
_chemical_formula_sum '[K1 Rb2 Mn1 Cl8]'
_cell_volume [378.8544]
_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
[
  Rb  Rb0  2  0.3961  0.3827  0.8118  1.0
  K  K1  1  0.0000  0.0000  0.5000  1.0
  Mn  Mn2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.1131  0.6642  0.0961  1.0
  Cl  Cl4  2  0.2003  0.5101  0.4937  1.0
  Cl  Cl5  2  0.2225  0.0809  0.1285  1.0
  Cl  Cl6  2  0.2693  0.9363  0.7883  1.0
]