data_[K8Mn4Te12]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [14.0465]
_cell_length_b [10.1855]
_cell_length_c [6.2120]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [K2MnTe3]
_chemical_formula_sum '[K8 Mn4 Te12]'
_cell_volume [888.7516]
_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  8  0.1393  0.3368  0.2500  1.0
  Mn  Mn1  4  0.0000  0.1030  0.7500  1.0
  Te  Te2  8  0.1473  0.0000  0.0000  1.0
  Te  Te3  4  0.0000  0.3582  0.7500  1.0
]