data_[Ce4B8Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  B  2.0400  0.8500  0.4100
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.2810]
_cell_length_b [5.5572]
_cell_length_c [7.3712]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.0356]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce2B4Pd5]
_chemical_formula_sum '[Ce4 B8 Pd10]'
_cell_volume [340.5585]
_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
[
  Ce  Ce0  4  0.2269  0.5000  0.1506  1
  B  B1  4  0.0996  0.5000  0.6323  1
  B  B2  4  0.2256  0.0000  0.3341  1
  Pd  Pd3  8  0.0738  0.2508  0.3680  1
  Pd  Pd4  2  0.0000  0.0000  0.0000  1
]