data_[U4P12Pd20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  P  2.1900  1.0000  0.5500
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.9283]
_cell_length_b [13.0749]
_cell_length_c [11.7406]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [UP3Pd5]
_chemical_formula_sum '[U4 P12 Pd20]'
_cell_volume [603.0178]
_cell_formula_units_Z [4]
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  4  0.0000  0.1099  0.2500  1
  P  P1  8  0.0000  0.4090  0.5818  1
  P  P2  4  0.0000  0.1362  0.7500  1
  Pd  Pd3  8  0.0000  0.2342  0.5821  1
  Pd  Pd4  8  0.0000  0.4077  0.1342  1
  Pd  Pd5  4  0.0000  0.0000  0.0000  1
]