data_[La16Tl4Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tl  1.6200  1.9000  1.3325
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.6491]
_cell_length_b [5.6810]
_cell_length_c [7.0434]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.8125]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La8Tl2Rh]
_chemical_formula_sum '[La16 Tl4 Rh2]'
_cell_volume [702.0512]
_cell_formula_units_Z [2]
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  4  0.0038  0.0000  0.7787  1.0
  La  La1  4  0.0921  0.5000  0.4078  1.0
  La  La2  4  0.1466  0.5000  0.9262  1.0
  La  La3  4  0.2093  0.0000  0.2456  1.0
  Tl  Tl4  4  0.1767  0.0000  0.6900  1.0
  Rh  Rh5  2  0.0000  0.5000  0.0000  1.0
]