data_[La8Y4Er24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Y  1.2200  1.8000  1.0400
  Er  1.2400  1.7500  1.0300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.4382]
_cell_length_b [11.7680]
_cell_length_c [9.0911]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.6038]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La2YEr6]
_chemical_formula_sum '[La8 Y4 Er24]'
_cell_volume [1168.9219]
_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  8  0.1896  0.4106  0.4344  1.0
  Y  Y1  4  0.0000  0.1698  0.2500  1.0
  Er  Er2  8  0.0361  0.3684  0.9599  1.0
  Er  Er3  8  0.0968  0.0922  0.6846  1.0
  Er  Er4  8  0.2280  0.1638  0.1405  1.0
]