data_[Sc4Be4Ag2Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Be  1.5700  1.0500  0.5900
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.3864]
_cell_length_b [9.3864]
_cell_length_c [3.4628]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Sc2Be2AgPd5]
_chemical_formula_sum '[Sc4 Be4 Ag2 Pd10]'
_cell_volume [305.0826]
_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
[
  Sc  Sc0  4  0.1773  0.6773  0.0000  1.0
  Be  Be1  4  0.1213  0.3787  0.0000  1.0
  Ag  Ag2  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd3  8  0.0727  0.2153  0.5000  1.0
  Pd  Pd4  2  0.0000  0.5000  0.5000  1.0
]