data_[Sm4Hg5Pd2]
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/m]
_cell_length_a [7.7922]
_cell_length_b [3.7919]
_cell_length_c [9.4767]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.7703]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Sm4Hg5Pd2]
_chemical_formula_sum '[Sm4 Hg5 Pd2]'
_cell_volume [279.0382]
_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
[
  Sm  Sm0  2  0.1799  0.5000  0.8578  1.0
  Sm  Sm1  2  0.2344  0.5000  0.4347  1.0
  Hg  Hg2  2  0.1669  0.0000  0.1439  1.0
  Hg  Hg3  2  0.4504  0.0000  0.6746  1.0
  Hg  Hg4  1  0.5000  0.0000  0.0000  1.0
  Pd  Pd5  2  0.0734  0.0000  0.6359  1.0
]