data_[K2Mn4Tl4Cl14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Mn  1.5500  1.4000  0.6483
  Tl  1.6200  1.9000  1.3325
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.4036]
_cell_length_b [23.9406]
_cell_length_c [6.7425]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [KMn2Tl2Cl7]
_chemical_formula_sum '[K2 Mn4 Tl4 Cl14]'
_cell_volume [710.8273]
_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
[
  K  K0  2  0.0000  0.0000  0.0796  1.0
  Mn  Mn1  4  0.0000  0.3992  0.0458  1.0
  Tl  Tl2  4  0.0000  0.2993  0.5875  1.0
  Cl  Cl3  4  0.0000  0.1135  0.3717  1.0
  Cl  Cl4  4  0.0000  0.2938  0.1050  1.0
  Cl  Cl5  4  0.0000  0.4193  0.3860  1.0
  Cl  Cl6  2  0.0000  0.5000  0.9280  1.0
]