data_[Hf2Tl2Te2Pd2Se4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Tl  1.6200  1.9000  1.3325
  Te  2.1000  1.4000  1.2933
  Pd  2.2000  1.4000  0.8462
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3604]
_cell_length_b [3.8744]
_cell_length_c [10.4676]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.0690]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [HfTlTePdSe2]
_chemical_formula_sum '[Hf2 Tl2 Te2 Pd2 Se4]'
_cell_volume [316.3919]
_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
[
  Hf  Hf0  2  0.2774  0.2500  0.3163  1
  Tl  Tl1  2  0.2597  0.7500  0.8034  1
  Te  Te2  2  0.4359  0.2500  0.6232  1
  Pd  Pd3  2  0.0860  0.7500  0.1043  1
  Se  Se4  2  0.0801  0.7500  0.3504  1
  Se  Se5  2  0.2573  0.2500  0.0609  1
]