data_[Al2Te8Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Te  2.1000  1.4000  1.2933
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8544]
_cell_length_b [4.1099]
_cell_length_c [7.0092]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.1175]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AlTe4Pd]
_chemical_formula_sum '[Al2 Te8 Pd2]'
_cell_volume [317.0165]
_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
[
  Al  Al0  2  0.0000  0.0000  0.0000  1
  Te  Te1  4  0.1322  0.0000  0.4631  1
  Te  Te2  4  0.1327  0.5000  0.9522  1
  Pd  Pd3  2  0.0000  0.5000  0.5000  1
]