data_[Te4Pd2Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.5210]
_cell_length_b [6.7693]
_cell_length_c [6.8299]
_cell_angle_alpha [118.2325]
_cell_angle_beta [104.1854]
_cell_angle_gamma [100.6755]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Te2PdPt2]
_chemical_formula_sum '[Te4 Pd2 Pt4]'
_cell_volume [204.0308]
_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
[
  Te  Te0  2  0.1803  0.3921  0.3043  1.0
  Te  Te1  2  0.3518  0.1067  0.7118  1.0
  Pd  Pd2  2  0.2543  0.9783  0.0191  1.0
  Pt  Pt3  2  0.1149  0.7292  0.2334  1.0
  Pt  Pt4  2  0.3609  0.5279  0.7756  1.0
]