data_[Ag1Te1Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0016]
_cell_length_b [5.2609]
_cell_length_c [5.3654]
_cell_angle_alpha [89.2629]
_cell_angle_beta [78.4956]
_cell_angle_gamma [87.5607]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [AgTePd6]
_chemical_formula_sum '[Ag1 Te1 Pd6]'
_cell_volume [138.2169]
_cell_formula_units_Z [1]
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
[
  Ag  Ag0  1  0.5000  0.5000  0.5000  1.0
  Te  Te1  1  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  2  0.0142  0.2465  0.5651  1.0
  Pd  Pd3  2  0.2442  0.4198  0.0612  1.0
  Pd  Pd4  2  0.4914  0.9914  0.2559  1.0
]