data_[Tb4Er16In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.3479]
_cell_length_b [12.0578]
_cell_length_c [10.9914]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [TbEr4In]
_chemical_formula_sum '[Tb4 Er16 In4]'
_cell_volume [708.7791]
_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
[
  Tb  Tb0  4  0.0000  0.3214  0.2715  1.0
  Er  Er1  4  0.0000  0.0013  0.3012  1.0
  Er  Er2  4  0.0000  0.1785  0.5535  1.0
  Er  Er3  4  0.0000  0.3236  0.8353  1.0
  Er  Er4  4  0.0000  0.4793  0.5550  1.0
  In  In5  4  0.0000  0.1512  0.0501  1.0
]