data_[K1Mn1Ag2Br8]
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 [P-1]
_cell_length_a [6.8931]
_cell_length_b [6.9410]
_cell_length_c [8.9692]
_cell_angle_alpha [94.0686]
_cell_angle_beta [94.0027]
_cell_angle_gamma [109.5702]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KMn(AgBr4)2]
_chemical_formula_sum '[K1 Mn1 Ag2 Br8]'
_cell_volume [401.3220]
_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  0.0000  0.5000  1.0
  Mn  Mn1  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  2  0.0135  0.4623  0.2808  1.0
  Br  Br3  2  0.1739  0.8588  0.1983  1.0
  Br  Br4  2  0.2390  0.9413  0.8262  1.0
  Br  Br5  2  0.2473  0.3420  0.0797  1.0
  Br  Br6  2  0.2706  0.5018  0.5425  1.0
]