data_[K4Tm2B4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Tm  1.2500  1.7500  1.0950
  B  2.0400  0.8500  0.4100
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.5114]
_cell_length_b [6.5606]
_cell_length_c [8.2497]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.3687]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K2Tm(BS3)2]
_chemical_formula_sum '[K4 Tm2 B4 S12]'
_cell_volume [548.2069]
_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  4  0.2024  0.5000  0.1864  1
  Tm  Tm1  2  0.0000  0.5000  0.5000  1
  B  B2  4  0.0650  0.0000  0.2817  1
  S  S3  8  0.0303  0.2346  0.7684  1
  S  S4  4  0.2381  0.0000  0.3491  1
]