data_[K8Mn4Ag4Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Mn  1.5500  1.4000  0.6483
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.3225]
_cell_length_b [20.0419]
_cell_length_c [13.5006]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [K2MnAgBr5]
_chemical_formula_sum '[K8 Mn4 Ag4 Br20]'
_cell_volume [1169.5652]
_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
[
  K  K0  4  0.0000  0.1241  0.3167  1.0
  K  K1  4  0.0000  0.1309  0.6825  1.0
  Mn  Mn2  4  0.0000  0.4302  0.4370  1.0
  Ag  Ag3  4  0.0000  0.2264  0.0389  1.0
  Br  Br4  4  0.0000  0.0415  0.0306  1.0
  Br  Br5  4  0.0000  0.3004  0.6624  1.0
  Br  Br6  4  0.0000  0.3125  0.3780  1.0
  Br  Br7  4  0.0000  0.3586  0.0006  1.0
  Br  Br8  4  0.0000  0.4921  0.2772  1.0
]