data_[Sc4Ta2Be4Rh10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Ta  1.5000  1.4500  0.8200
  Be  1.5700  1.0500  0.5900
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.5710]
_cell_length_b [9.5710]
_cell_length_c [3.1776]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Sc2TaBe2Rh5]
_chemical_formula_sum '[Sc4 Ta2 Be4 Rh10]'
_cell_volume [291.0833]
_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  0.1736  0.6736  0.0000  1.0
  Ta  Ta1  2  0.0000  0.0000  0.0000  1.0
  Be  Be2  4  0.1216  0.3784  0.0000  1.0
  Rh  Rh3  8  0.0709  0.2112  0.5000  1.0
  Rh  Rh4  2  0.0000  0.5000  0.5000  1.0
]