data_[Sm14Tl2In8]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.1743]
_cell_length_b [5.9466]
_cell_length_c [10.6438]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.5386]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm7TlIn4]
_chemical_formula_sum '[Sm14 Tl2 In8]'
_cell_volume [747.7905]
_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  0.0588  0.0000  0.3542  1
  Sm  Sm1  4  0.1856  0.5000  0.6118  1
  Sm  Sm2  4  0.2037  0.0000  0.9059  1
  Sm  Sm3  2  0.0000  0.5000  0.0000  1
  Tl  Tl4  2  0.0000  0.0000  0.0000  1
  In  In5  4  0.0564  0.5000  0.7590  1
  In  In6  4  0.2066  0.5000  0.3281  1
]