data_[U2Tl4Pd4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.2167]
_cell_length_b [10.7075]
_cell_length_c [8.1436]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5790]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [UTl2(PdS3)2]
_chemical_formula_sum '[U2 Tl4 Pd4 S12]'
_cell_volume [524.6314]
_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
[
  U  U0  2  0.0000  0.0000  0.5000  1
  Tl  Tl1  4  0.0000  0.1638  0.0000  1
  Pd  Pd2  4  0.0000  0.3322  0.5000  1
  S  S3  8  0.2313  0.1711  0.6884  1
  S  S4  4  0.2169  0.5000  0.6852  1
]