data_[Sm2Tl6Pd14]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.6377]
_cell_length_b [9.8449]
_cell_length_c [5.6792]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.1950]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SmTl3Pd7]
_chemical_formula_sum '[Sm2 Tl6 Pd14]'
_cell_volume [447.1572]
_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  2  0.0000  0.5000  0.5000  1
  Tl  Tl1  4  0.0000  0.2276  0.0000  1
  Tl  Tl2  2  0.0000  0.0000  0.5000  1
  Pd  Pd3  8  0.1757  0.2371  0.6779  1
  Pd  Pd4  4  0.1974  0.0000  0.0446  1
  Pd  Pd5  2  0.0000  0.5000  0.0000  1
]