data_[Cs4K4Mn8Br24]
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
  Mn  1.5500  1.4000  0.6483
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.0016]
_cell_length_b [14.0986]
_cell_length_c [7.9401]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.2397]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsK(MnBr3)2]
_chemical_formula_sum '[Cs4 K4 Mn8 Br24]'
_cell_volume [1627.7496]
_cell_formula_units_Z [4]
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  4  0.0000  0.1823  0.7500  1.0
  K  K1  4  0.0000  0.3986  0.2500  1.0
  Mn  Mn2  8  0.2163  0.0876  0.2625  1.0
  Br  Br3  8  0.1143  0.4123  0.6615  1.0
  Br  Br4  8  0.1451  0.0276  0.5096  1.0
  Br  Br5  8  0.1505  0.2444  0.1739  1.0
]