data_[Mn2Ag2Sn2Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [6.6815]
_cell_length_b [6.6815]
_cell_length_c [12.3229]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [MnAgSnBr6]
_chemical_formula_sum '[Mn2 Ag2 Sn2 Br12]'
_cell_volume [550.1303]
_cell_formula_units_Z [2]
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
[
  Mn  Mn0  2  0.0000  0.0000  0.3317  1.0
  Ag  Ag1  2  0.0000  0.0000  0.6695  1.0
  Sn  Sn2  2  0.0000  0.0000  0.9976  1.0
  Br  Br3  4  0.1901  0.8099  0.4889  1.0
  Br  Br4  4  0.1910  0.8090  0.1793  1.0
  Br  Br5  4  0.2156  0.7844  0.8324  1.0
]