data_[Mg4Sc10Ni4Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Sc  1.3600  1.6000  0.8850
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.8976]
_cell_length_b [10.8976]
_cell_length_c [3.3571]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Mg2Sc5Ni2Pd]
_chemical_formula_sum '[Mg4 Sc10 Ni4 Pd2]'
_cell_volume [398.6886]
_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
[
  Mg  Mg0  4  0.1744  0.3256  0.0000  1
  Sc  Sc1  8  0.0698  0.7984  0.5000  1
  Sc  Sc2  2  0.0000  0.5000  0.5000  1
  Ni  Ni3  4  0.1317  0.6317  0.0000  1
  Pd  Pd4  2  0.0000  0.0000  0.0000  1
]