data_[Er10Hg4Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.4983]
_cell_length_b [5.5881]
_cell_length_c [9.5750]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.9399]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Er5(HgPd6)2]
_chemical_formula_sum '[Er10 Hg4 Pd24]'
_cell_volume [800.4432]
_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
[
  Er  Er0  4  0.1547  0.5000  0.8720  1
  Er  Er1  4  0.1855  0.5000  0.3775  1
  Er  Er2  2  0.0000  0.0000  0.5000  1
  Hg  Hg3  4  0.0000  0.2492  0.0000  1
  Pd  Pd4  8  0.1571  0.2514  0.6093  1
  Pd  Pd5  8  0.1878  0.2396  0.1299  1
  Pd  Pd6  4  0.0104  0.5000  0.3670  1
  Pd  Pd7  4  0.1153  0.0000  0.3208  1
]