data_[U2Ag6Pd4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Ag  1.9300  1.6000  1.0867
  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 [6.6761]
_cell_length_b [10.6277]
_cell_length_c [6.7424]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.9926]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [UAg3(PdS3)2]
_chemical_formula_sum '[U2 Ag6 Pd4 S12]'
_cell_volume [457.5013]
_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  0.0000  1
  Ag  Ag1  4  0.0000  0.1431  0.5000  1
  Ag  Ag2  2  0.0000  0.5000  0.5000  1
  Pd  Pd3  4  0.0000  0.3271  0.0000  1
  S  S4  8  0.2053  0.1742  0.2449  1
  S  S5  4  0.1913  0.5000  0.2042  1
]