data_[Na4Mn4In8Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Mn  1.5500  1.4000  0.6483
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.1537]
_cell_length_b [18.3605]
_cell_length_c [15.5686]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [NaMnIn2Br5]
_chemical_formula_sum '[Na4 Mn4 In8 Br20]'
_cell_volume [1187.3377]
_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
[
  Na  Na0  4  0.0000  0.4574  0.4518  1.0
  Mn  Mn1  4  0.0000  0.2252  0.0267  1.0
  In  In2  4  0.0000  0.0858  0.6515  1.0
  In  In3  4  0.0000  0.1371  0.2852  1.0
  Br  Br4  4  0.0000  0.0805  0.0678  1.0
  Br  Br5  4  0.0000  0.2609  0.6473  1.0
  Br  Br6  4  0.0000  0.2969  0.4155  1.0
  Br  Br7  4  0.0000  0.3691  0.9974  1.0
  Br  Br8  4  0.0000  0.4928  0.7807  1.0
]