data_[Cs2Nd1Y1O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Nd  1.1400  1.8500  1.2765
  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 [6.2979]
_cell_length_b [3.6381]
_cell_length_c [7.2333]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7765]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Cs2NdYO4]
_chemical_formula_sum '[Cs2 Nd1 Y1 O4]'
_cell_volume [158.6788]
_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
[
  Cs  Cs0  1  0.0000  0.5000  0.5000  1.0
  Cs  Cs1  1  0.5000  0.0000  0.5000  1.0
  Nd  Nd2  1  0.5000  0.5000  0.0000  1.0
  Y  Y3  1  0.0000  0.0000  0.0000  1.0
  O  O4  2  0.2143  0.5000  0.1670  1.0
  O  O5  2  0.2688  0.0000  0.8325  1.0
]