data_[Er8Ni4Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.7925]
_cell_length_b [7.1355]
_cell_length_c [7.4157]
_cell_angle_alpha [106.8424]
_cell_angle_beta [107.4707]
_cell_angle_gamma [105.8757]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Er4Ni2Pd]
_chemical_formula_sum '[Er8 Ni4 Pd2]'
_cell_volume [301.4669]
_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  1  0.1065  0.7266  0.6514  1.0
  Er  Er1  1  0.1749  0.3127  0.8189  1.0
  Er  Er2  1  0.2764  0.0536  0.4266  1.0
  Er  Er3  1  0.5282  0.4304  0.2852  1.0
  Er  Er4  1  0.5396  0.8532  0.1172  1.0
  Er  Er5  1  0.6595  0.9035  0.6759  1.0
  Er  Er6  1  0.7390  0.4933  0.8604  1.0
  Er  Er7  1  0.9615  0.3028  0.2084  1.0
  Ni  Ni8  1  0.2017  0.6387  0.1838  1.0
  Ni  Ni9  1  0.3549  0.4996  0.5892  1.0
  Ni  Ni10  1  0.4709  0.1201  0.8982  1.0
  Ni  Ni11  1  0.8804  0.7204  0.2825  1.0
  Pd  Pd12  1  0.0818  0.9724  0.0041  1.0
  Pd  Pd13  1  0.7746  0.2227  0.4982  1.0
]