data_[Na6Pr4Sm2Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pr  1.1300  1.8500  1.0600
  Sm  1.1700  1.8500  1.2290
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8878]
_cell_length_b [13.6662]
_cell_length_c [8.0165]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1457]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na3Pr2SmTe6]
_chemical_formula_sum '[Na6 Pr4 Sm2 Te12]'
_cell_volume [816.3535]
_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
[
  Na  Na0  4  0.0000  0.1681  0.5000  1.0
  Na  Na1  2  0.0000  0.5000  0.5000  1.0
  Pr  Pr2  4  0.0000  0.3336  0.0000  1.0
  Sm  Sm3  2  0.0000  0.0000  0.0000  1.0
  Te  Te4  8  0.2443  0.8355  0.2395  1.0
  Te  Te5  4  0.2489  0.0000  0.7605  1.0
]