data_[Th2Tl4Sb4Pd14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Tl  1.6200  1.9000  1.3325
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.8361]
_cell_length_b [5.8495]
_cell_length_c [15.4941]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.6825]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ThTl2Sb2Pd7]
_chemical_formula_sum '[Th2 Tl4 Sb4 Pd14]'
_cell_volume [526.3394]
_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
[
  Th  Th0  2  0.0000  0.0000  0.0000  1
  Tl  Tl1  4  0.1104  0.0000  0.4077  1
  Sb  Sb2  4  0.0695  0.5000  0.2504  1
  Pd  Pd3  8  0.2111  0.2505  0.8611  1
  Pd  Pd4  4  0.1033  0.5000  0.4202  1
  Pd  Pd5  2  0.0000  0.5000  0.0000  1
]