data_[K4Te4P8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Te  2.1000  1.4000  1.2933
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.1465]
_cell_length_b [6.6284]
_cell_length_c [10.1762]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4307]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KTeP2]
_chemical_formula_sum '[K4 Te4 P8]'
_cell_volume [482.0268]
_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  2  0.0260  0.2500  0.6129  1.0
  K  K1  2  0.2318  0.2500  0.9923  1.0
  Te  Te2  2  0.1629  0.7500  0.7362  1.0
  Te  Te3  2  0.2918  0.7500  0.1030  1.0
  P  P4  4  0.3916  0.0051  0.4203  1.0
  P  P5  2  0.4887  0.2500  0.2860  1.0
  P  P6  2  0.4950  0.2500  0.7003  1.0
]