data_[Li2Mn2In2Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [P2_1/m]
_cell_length_a [6.5910]
_cell_length_b [8.6093]
_cell_length_c [8.6554]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.5465]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiMnInBr4]
_chemical_formula_sum '[Li2 Mn2 In2 Br8]'
_cell_volume [479.4171]
_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
[
  Li  Li0  2  0.2905  0.2500  0.6845  1.0
  Mn  Mn1  2  0.2194  0.7500  0.3081  1.0
  In  In2  2  0.1727  0.2500  0.0953  1.0
  Br  Br3  4  0.0400  0.0307  0.7344  1.0
  Br  Br4  2  0.3968  0.7500  0.0785  1.0
  Br  Br5  2  0.4827  0.2500  0.4600  1.0
]