data_[Na4Tm4Pd4Se12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Tm  1.2500  1.7500  1.0950
  Pd  2.2000  1.4000  0.8462
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [10.0094]
_cell_length_b [4.0055]
_cell_length_c [14.3836]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [NaTmPdSe3]
_chemical_formula_sum '[Na4 Tm4 Pd4 Se12]'
_cell_volume [576.6833]
_cell_formula_units_Z [4]
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  0.2269  0.7500  0.0141  1
  Tm  Tm1  4  0.0156  0.2500  0.7462  1
  Pd  Pd2  4  0.2359  0.2500  0.2418  1
  Se  Se3  4  0.0550  0.2500  0.1218  1
  Se  Se4  4  0.0916  0.7500  0.6163  1
  Se  Se5  4  0.2355  0.7500  0.3513  1
]