data_[La14Sm4Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sm  1.1700  1.8500  1.2290
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.1579]
_cell_length_b [11.6682]
_cell_length_c [6.1904]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.3160]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La7(SmSc)2]
_chemical_formula_sum '[La14 Sm4 Sc4]'
_cell_volume [750.8152]
_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  8  0.1834  0.2409  0.1882  1
  La  La1  4  0.0786  0.5000  0.7965  1
  La  La2  2  0.0000  0.0000  0.0000  1
  Sm  Sm3  4  0.2142  0.0000  0.5830  1
  Sc  Sc4  4  0.0000  0.2201  0.5000  1
]