data_[Nd1Sm1Sc2Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sm  1.1700  1.8500  1.2290
  Sc  1.3600  1.6000  0.8850
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.6364]
_cell_length_b [4.4482]
_cell_length_c [7.6706]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5466]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [NdSm(ScBi2)2]
_chemical_formula_sum '[Nd1 Sm1 Sc2 Bi4]'
_cell_volume [245.5414]
_cell_formula_units_Z [1]
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
[
  Nd  Nd0  1  0.0000  0.0000  0.0000  1.0
  Sm  Sm1  1  0.0000  0.5000  0.5000  1.0
  Sc  Sc2  1  0.5000  0.0000  0.5000  1.0
  Sc  Sc3  1  0.5000  0.5000  0.0000  1.0
  Bi  Bi4  2  0.2711  0.0000  0.7554  1.0
  Bi  Bi5  2  0.2722  0.5000  0.2589  1.0
]