data_[Sm12Tl2Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  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 [10.6518]
_cell_length_b [5.0280]
_cell_length_c [9.3985]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9239]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm6TlRh2]
_chemical_formula_sum '[Sm12 Tl2 Rh4]'
_cell_volume [490.6121]
_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
[
  Sm  Sm0  4  0.0311  0.0000  0.8472  1
  Sm  Sm1  4  0.1613  0.5000  0.3853  1
  Sm  Sm2  4  0.2101  0.5000  0.8348  1
  Tl  Tl3  2  0.0000  0.0000  0.5000  1
  Rh  Rh4  4  0.1248  0.5000  0.0949  1
]