data_[U1Sn2Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0102]
_cell_length_b [5.0165]
_cell_length_c [7.6933]
_cell_angle_alpha [95.4517]
_cell_angle_beta [94.5818]
_cell_angle_gamma [97.9643]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [U(SnPd4)2]
_chemical_formula_sum '[U1 Sn2 Pd8]'
_cell_volume [189.7805]
_cell_formula_units_Z [1]
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  1  0.5000  0.0000  0.0000  1
  Sn  Sn1  2  0.0959  0.8022  0.2884  1
  Pd  Pd2  2  0.0314  0.2674  0.0890  1
  Pd  Pd3  2  0.2256  0.3630  0.4512  1
  Pd  Pd4  2  0.3464  0.9104  0.6432  1
  Pd  Pd5  2  0.4301  0.4504  0.8170  1
]