data_[Er9Tl3Rh24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Tl  1.6200  1.9000  1.3325
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.2929]
_cell_length_b [5.2929]
_cell_length_c [26.1838]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Er3TlRh8]
_chemical_formula_sum '[Er9 Tl3 Rh24]'
_cell_volume [635.2684]
_cell_formula_units_Z [3]
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
[
  Er  Er0  3  0.0000  0.0000  0.0044  1
  Er  Er1  3  0.0000  0.0000  0.4960  1
  Er  Er2  3  0.0000  0.0000  0.6244  1
  Tl  Tl3  3  0.0000  0.0000  0.1262  1
  Rh  Rh4  9  0.0001  0.5001  0.5633  1
  Rh  Rh5  9  0.1671  0.3343  0.3949  1
  Rh  Rh6  3  0.0000  0.0000  0.3124  1
  Rh  Rh7  3  0.0000  0.0000  0.8122  1
]