data_[Mn2Ag2Br2Cl12]
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
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [7.2344]
_cell_length_b [11.0555]
_cell_length_c [7.3389]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.7820]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [MnAgBrCl6]
_chemical_formula_sum '[Mn2 Ag2 Br2 Cl12]'
_cell_volume [586.9108]
_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  0.6795  0.5000  1.0
  Ag  Ag1  2  0.0000  0.3462  0.5000  1.0
  Br  Br2  2  0.0000  0.8340  0.0000  1.0
  Cl  Cl3  4  0.0946  0.5408  0.3006  1.0
  Cl  Cl4  4  0.1177  0.8377  0.3091  1.0
  Cl  Cl5  4  0.2224  0.1918  0.3553  1.0
]