data_[Mn2In2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.5164]
_cell_length_b [3.8016]
_cell_length_c [8.8159]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.4984]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [MnInCl3]
_chemical_formula_sum '[Mn2 In2 Cl6]'
_cell_volume [278.6580]
_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  0.1700  0.2500  0.6333  1
  In  In1  2  0.3675  0.7500  0.1865  1
  Cl  Cl2  2  0.0312  0.2500  0.3406  1
  Cl  Cl3  2  0.3020  0.2500  0.9120  1
  Cl  Cl4  2  0.3500  0.7500  0.5849  1
]