data_[Mn1Tl1Ge2Cl8]
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
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9774]
_cell_length_b [7.7855]
_cell_length_c [8.6022]
_cell_angle_alpha [96.7139]
_cell_angle_beta [94.9895]
_cell_angle_gamma [111.0599]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [MnTl(GeCl4)2]
_chemical_formula_sum '[Mn1 Tl1 Ge2 Cl8]'
_cell_volume [367.4127]
_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
  Ge  Ge2  2  0.2826  0.6618  0.1645  1.0
  Cl  Cl3  2  0.0269  0.7743  0.8227  1.0
  Cl  Cl4  2  0.2927  0.2720  0.8474  1.0
  Cl  Cl5  2  0.3232  0.0012  0.1689  1.0
  Cl  Cl6  2  0.3236  0.7068  0.4341  1.0
]