data_[La4Se8O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Se  2.5500  1.1500  1.0133
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.4916]
_cell_length_b [8.0923]
_cell_length_c [7.4471]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.9502]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La(SeO3)2]
_chemical_formula_sum '[La4 Se8 O24]'
_cell_volume [567.6307]
_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
[
  La  La0  4  0.0000  0.1586  0.2500  1.0
  Se  Se1  8  0.1906  0.4990  0.7086  1.0
  O  O2  8  0.0992  0.3248  0.0818  1.0
  O  O3  8  0.1314  0.0495  0.6435  1.0
  O  O4  8  0.1812  0.3940  0.4955  1.0
]