data_[La16Os4Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Os  2.2000  1.3000  0.6730
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8297]
_cell_length_b [15.4401]
_cell_length_c [7.1746]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.9653]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La4OsPd]
_chemical_formula_sum '[La16 Os4 Pd4]'
_cell_volume [781.5203]
_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
[
  La  La0  8  0.2047  0.2980  0.2065  1.0
  La  La1  8  0.2464  0.5481  0.2399  1.0
  Pd  Pd2  4  0.0000  0.0968  0.7500  1.0
  Os  Os3  4  0.0000  0.4148  0.2500  1.0
]