data_[K4Tm4Mn2S12]
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
  Mn  1.5500  1.4000  0.6483
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.6163]
_cell_length_b [11.2945]
_cell_length_c [7.8549]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.9409]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K2Tm2MnS6]
_chemical_formula_sum '[K4 Tm4 Mn2 S12]'
_cell_volume [561.5073]
_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  0.0000  0.1718  0.0000  1.0
  Tm  Tm1  4  0.0000  0.3329  0.5000  1.0
  Mn  Mn2  2  0.0000  0.0000  0.5000  1.0
  S  S3  8  0.2173  0.1507  0.6880  1.0
  S  S4  4  0.2342  0.0000  0.3147  1.0
]