data_[K4Mn4Sn4Cl20]
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
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.1681]
_cell_length_b [12.2702]
_cell_length_c [10.1252]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.3947]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KMnSnCl5]
_chemical_formula_sum '[K4 Mn4 Sn4 Cl20]'
_cell_volume [1045.3869]
_cell_formula_units_Z [4]
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  4  0.0000  0.3461  0.7500  1.0
  Mn  Mn1  4  0.0000  0.3171  0.2500  1.0
  Sn  Sn2  4  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  8  0.1246  0.2092  0.1315  1.0
  Cl  Cl4  8  0.1713  0.4360  0.4294  1.0
  Cl  Cl5  4  0.0000  0.0931  0.7500  1.0
]