data_[Sn4Te4Pd14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  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 [9.1569]
_cell_length_b [9.8251]
_cell_length_c [5.2021]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.9326]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sn2Te2Pd7]
_chemical_formula_sum '[Sn4 Te4 Pd14]'
_cell_volume [427.7809]
_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
[
  Sn  Sn0  4  0.0000  0.2520  0.0000  1
  Te  Te1  4  0.2250  0.5000  0.5361  1
  Pd  Pd2  8  0.1696  0.2447  0.6868  1
  Pd  Pd3  4  0.1604  0.5000  0.9952  1
  Pd  Pd4  2  0.0000  0.0000  0.5000  1
]