data_[Nd4Sm6Sc2Te12]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.3588]
_cell_length_b [4.3851]
_cell_length_c [8.8951]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.2786]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd2Sm3ScTe6]
_chemical_formula_sum '[Nd4 Sm6 Sc2 Te12]'
_cell_volume [734.9152]
_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  4  0.1713  0.0000  0.3356  1.0
  Sm  Sm1  4  0.1772  0.0000  0.8386  1.0
  Sm  Sm2  2  0.0000  0.5000  0.5000  1.0
  Sc  Sc3  2  0.0000  0.5000  0.0000  1.0
  Te  Te4  4  0.0034  0.0000  0.7659  1.0
  Te  Te5  4  0.1561  0.5000  0.0740  1.0
  Te  Te6  4  0.1629  0.5000  0.5848  1.0
]