data_[Mn1Sn1Ge2Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Sn  1.9600  1.4500  0.8300
  Ge  2.0100  1.2500  0.7700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5449]
_cell_length_b [6.9921]
_cell_length_c [8.5237]
_cell_angle_alpha [89.7205]
_cell_angle_beta [89.9324]
_cell_angle_gamma [87.8455]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [MnSn(GeBr4)2]
_chemical_formula_sum '[Mn1 Sn1 Ge2 Br8]'
_cell_volume [389.7852]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1.0
  Sn  Sn1  1  0.0000  0.0000  0.5000  1.0
  Ge  Ge2  2  0.4656  0.4588  0.7635  1.0
  Br  Br3  2  0.2110  0.8239  0.7782  1.0
  Br  Br4  2  0.2472  0.3193  0.9824  1.0
  Br  Br5  2  0.2508  0.8543  0.2275  1.0
  Br  Br6  2  0.2713  0.3371  0.5221  1.0
]