data_[Mn2Bi4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Bi  2.0200  1.6000  1.0350
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.9847]
_cell_length_b [3.7572]
_cell_length_c [9.6202]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.4244]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mn(BiCl4)2]
_chemical_formula_sum '[Mn2 Bi4 Cl16]'
_cell_volume [685.5862]
_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  0.5000  0.0000  1
  Bi  Bi1  4  0.1514  0.0000  0.2662  1
  Cl  Cl2  4  0.0010  0.0000  0.8224  1
  Cl  Cl3  4  0.0970  0.5000  0.4383  1
  Cl  Cl4  4  0.1347  0.5000  0.0388  1
  Cl  Cl5  4  0.2412  0.0000  0.6964  1
]