data_[Nd8Sm4Sc2]
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
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.2375]
_cell_length_b [8.0728]
_cell_length_c [9.5370]
_cell_angle_alpha [89.6870]
_cell_angle_beta [89.8282]
_cell_angle_gamma [75.0313]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Nd4Sm2Sc]
_chemical_formula_sum '[Nd8 Sm4 Sc2]'
_cell_volume [463.9305]
_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
[
  Nd  Nd0  1  0.1228  0.7375  0.0683  1
  Nd  Nd1  1  0.1242  0.2346  0.5737  1
  Nd  Nd2  1  0.4132  0.8685  0.3596  1
  Nd  Nd3  1  0.5517  0.9510  0.9983  1
  Nd  Nd4  1  0.7002  0.0238  0.6447  1
  Nd  Nd5  1  0.8351  0.5828  0.7847  1
  Nd  Nd6  1  0.8395  0.0938  0.2845  1
  Nd  Nd7  1  0.9836  0.6559  0.4298  1
  Sm  Sm8  1  0.2679  0.3043  0.2139  1
  Sm  Sm9  1  0.2682  0.8024  0.7143  1
  Sm  Sm10  1  0.4123  0.3729  0.8565  1
  Sm  Sm11  1  0.6958  0.5143  0.1429  1
  Sc  Sc12  1  0.5529  0.4454  0.4996  1
  Sc  Sc13  1  0.9825  0.1630  0.9293  1
]