data_[Li8Er16Zn24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Er  1.2400  1.7500  1.0300
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [6.7260]
_cell_length_b [9.0923]
_cell_length_c [15.8523]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [LiEr2Zn3]
_chemical_formula_sum '[Li8 Er16 Zn24]'
_cell_volume [969.4493]
_cell_formula_units_Z [8]
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  8  0.0000  0.0000  0.3332  1.0
  Er  Er1  8  0.2486  0.0000  0.0000  1.0
  Er  Er2  8  0.2500  0.2500  0.2500  1.0
  Zn  Zn3  16  0.0000  0.2499  0.0834  1.0
  Zn  Zn4  8  0.0000  0.0000  0.1670  1.0
]