data_[K2Hf2Mn2Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Hf  1.3000  1.5500  0.8500
  Mn  1.5500  1.4000  0.6483
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.8509]
_cell_length_b [4.1547]
_cell_length_c [10.9267]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.5477]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KHfMnTe3]
_chemical_formula_sum '[K2 Hf2 Mn2 Te6]'
_cell_volume [371.0953]
_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  0.2643  0.7500  0.2929  1
  Hf  Hf1  2  0.3058  0.2500  0.8357  1
  Mn  Mn2  2  0.0789  0.7500  0.6076  1
  Te  Te3  2  0.0850  0.7500  0.8536  1
  Te  Te4  2  0.2452  0.2500  0.5577  1
  Te  Te5  2  0.4448  0.2500  0.1292  1
]