data_[Er4Sc2Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Sc  1.3600  1.6000  0.8850
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5938]
_cell_length_b [4.1754]
_cell_length_c [6.6601]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7083]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Er2ScPd8]
_chemical_formula_sum '[Er4 Sc2 Pd16]'
_cell_volume [384.3918]
_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  0.2174  0.0000  0.6662  1
  Sc  Sc1  2  0.0000  0.5000  0.0000  1
  Pd  Pd2  4  0.0364  0.0000  0.7221  1
  Pd  Pd3  4  0.0916  0.5000  0.4424  1
  Pd  Pd4  4  0.1393  0.0000  0.1752  1
  Pd  Pd5  4  0.1734  0.5000  0.9058  1
]