data_[La2Sm6Tm2Sc2]
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
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.9353]
_cell_length_b [5.0921]
_cell_length_c [10.1119]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.9032]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LaSm3TmSc]
_chemical_formula_sum '[La2 Sm6 Tm2 Sc2]'
_cell_volume [386.5547]
_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  2  0.1783  0.2500  0.2971  1.0
  Sm  Sm1  2  0.1729  0.7500  0.0433  1.0
  Sm  Sm2  2  0.1731  0.2500  0.7905  1.0
  Sm  Sm3  2  0.1780  0.7500  0.5437  1.0
  Tm  Tm4  2  0.4989  0.7500  0.8744  1.0
  Sc  Sc5  2  0.4998  0.2500  0.6254  1.0
]