data_[Li5Y1O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Y  1.2200  1.8000  1.0400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.2896]
_cell_length_b [3.2901]
_cell_length_c [5.5474]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.7936]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Li5YO4]
_chemical_formula_sum '[Li5 Y1 O4]'
_cell_volume [96.5353]
_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
[
  Li  Li0  2  0.3580  0.5000  0.6470  1
  Li  Li1  2  0.3905  0.0000  0.1889  1
  Li  Li2  1  0.0000  0.0000  0.5000  1
  Y  Y3  1  0.0000  0.5000  0.0000  1
  O  O4  2  0.2409  0.0000  0.8321  1
  O  O5  2  0.2621  0.5000  0.3223  1
]