data_[Sm16Ag4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [8.6642]
_cell_length_b [14.8026]
_cell_length_c [7.1304]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.2251]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [Sm4AgPd2]
_chemical_formula_sum '[Sm16 Ag4 Pd8]'
_cell_volume [737.7254]
_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
[
  Sm  Sm0  4  0.0108  0.2380  0.4122  1.0
  Sm  Sm1  4  0.0622  0.9670  0.2400  1.0
  Sm  Sm2  4  0.0929  0.4757  0.5971  1.0
  Sm  Sm3  4  0.3232  0.8207  0.7450  1.0
  Ag  Ag4  4  0.3382  0.3670  0.4269  1.0
  Pd  Pd5  4  0.2232  0.3399  0.9479  1.0
  Pd  Pd6  4  0.3228  0.9074  0.1308  1.0
]