data_[K1Na2Mn1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Na  0.9300  1.8000  1.1600
  Mn  1.5500  1.4000  0.6483
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.7211]
_cell_length_b [8.8957]
_cell_length_c [6.4348]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9511]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [KNa2MnCl8]
_chemical_formula_sum '[K1 Na2 Mn1 Cl8]'
_cell_volume [327.2982]
_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
[
  K  K0  1  0.0000  0.5000  0.0000  1.0
  Na  Na1  2  0.5000  0.2186  0.5000  1.0
  Mn  Mn2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.2306  0.1856  0.8687  1.0
  Cl  Cl4  2  0.2205  0.0000  0.3054  1.0
  Cl  Cl5  2  0.2492  0.5000  0.4895  1.0
]