data_[Li1Y2Cr1O6]
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
  Cr  1.6600  1.4000  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [5.1146]
_cell_length_b [5.1146]
_cell_length_c [4.7988]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [LiY2CrO6]
_chemical_formula_sum '[Li1 Y2 Cr1 O6]'
_cell_volume [125.5308]
_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  1  0.5000  0.5000  0.5656  1
  Y  Y1  2  0.0000  0.5000  0.0039  1
  Cr  Cr2  1  0.0000  0.0000  0.5878  1
  O  O3  4  0.2357  0.2357  0.7243  1
  O  O4  1  0.0000  0.0000  0.2274  1
  O  O5  1  0.5000  0.5000  0.1612  1
]