data_[Si4Te16Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Si  1.9000  1.1000  0.5400
  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 [13.3405]
_cell_length_b [8.6849]
_cell_length_c [6.0773]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.5731]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Si2Te8Pd]
_chemical_formula_sum '[Si4 Te16 Pd2]'
_cell_volume [684.4618]
_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
[
  Si  Si0  4  0.1859  0.0000  0.6258  1
  Te  Te1  8  0.0660  0.2157  0.7336  1
  Te  Te2  4  0.1263  0.5000  0.1890  1
  Te  Te3  4  0.2024  0.0000  0.2269  1
  Pd  Pd4  2  0.0000  0.0000  0.0000  1
]