data_[Sm2Hg6Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.2350]
_cell_length_b [4.4227]
_cell_length_c [9.5733]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.9217]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Sm(HgPd2)3]
_chemical_formula_sum '[Sm2 Hg6 Pd12]'
_cell_volume [377.8227]
_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
[
  Sm  Sm0  2  0.2769  0.2500  0.2685  1.0
  Hg  Hg1  2  0.1117  0.7500  0.9443  1.0
  Hg  Hg2  2  0.1926  0.2500  0.6466  1.0
  Hg  Hg3  2  0.4022  0.7500  0.7851  1.0
  Pd  Pd4  2  0.0045  0.2500  0.3801  1.0
  Pd  Pd5  2  0.0361  0.7500  0.2089  1.0
  Pd  Pd6  2  0.2469  0.7500  0.4708  1.0
  Pd  Pd7  2  0.3014  0.2500  0.9455  1.0
  Pd  Pd8  2  0.4141  0.7500  0.1079  1.0
  Pd  Pd9  2  0.4732  0.2500  0.5850  1.0
]