data_[Sm3Sc3Te2Pd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Sc  1.3600  1.6000  0.8850
  Te  2.1000  1.4000  1.2933
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-62m]
_cell_length_a [8.3905]
_cell_length_b [8.3905]
_cell_length_c [3.8177]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [189]
_chemical_formula_structural [Sm3Sc3Te2Pd]
_chemical_formula_sum '[Sm3 Sc3 Te2 Pd1]'
_cell_volume [232.7554]
_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
[
  Sm  Sm0  3  0.0000  0.2559  0.5000  1
  Sc  Sc1  3  0.0000  0.5970  0.0000  1
  Te  Te2  2  0.3333  0.6667  0.5000  1
  Pd  Pd3  1  0.0000  0.0000  0.0000  1
]