data_[Mn1Tl1Sn2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Tl  1.6200  1.9000  1.3325
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4846]
_cell_length_b [7.1789]
_cell_length_c [8.5312]
_cell_angle_alpha [79.1987]
_cell_angle_beta [73.3491]
_cell_angle_gamma [85.8144]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [MnTl(SnCl4)2]
_chemical_formula_sum '[Mn1 Tl1 Sn2 Cl8]'
_cell_volume [373.6739]
_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
  Tl  Tl1  1  0.0000  0.0000  0.5000  1.0
  Sn  Sn2  2  0.4437  0.3948  0.7567  1.0
  Cl  Cl3  2  0.1441  0.2060  0.1110  1.0
  Cl  Cl4  2  0.1939  0.7501  0.1055  1.0
  Cl  Cl5  2  0.2401  0.5852  0.5254  1.0
  Cl  Cl6  2  0.3400  0.0756  0.7148  1.0
]