data_[La8Te3Se1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Te  2.1000  1.4000  1.2933
  Se  2.5500  1.1500  1.0133
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.1059]
_cell_length_b [4.1059]
_cell_length_c [26.1803]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [La8Te3SeO8]
_chemical_formula_sum '[La8 Te3 Se1 O8]'
_cell_volume [441.3643]
_cell_formula_units_Z [1]
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
[
  La  La0  2  0.0000  0.0000  0.1670  1.0
  La  La1  2  0.0000  0.0000  0.3275  1.0
  La  La2  2  0.5000  0.5000  0.0749  1.0
  La  La3  2  0.5000  0.5000  0.4197  1.0
  Te  Te4  2  0.5000  0.5000  0.2474  1.0
  Te  Te5  1  0.0000  0.0000  0.5000  1.0
  Se  Se6  1  0.0000  0.0000  0.0000  1.0
  O  O7  4  0.0000  0.5000  0.1210  1.0
  O  O8  4  0.0000  0.5000  0.3736  1.0
]