data_[Nd7Sm3In1]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [7.1450]
_cell_length_b [7.1450]
_cell_length_c [8.7203]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Nd7Sm3In]
_chemical_formula_sum '[Nd7 Sm3 In1]'
_cell_volume [385.5377]
_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  3  0.0041  0.5021  0.5516  1
  Nd  Nd1  3  0.3286  0.1643  0.8781  1
  Nd  Nd2  1  0.3333  0.6667  0.8899  1
  Sm  Sm3  3  0.1666  0.3331  0.2201  1
  In  In4  1  0.0000  0.0000  0.5453  1
]