data_[Sc4Tl2B4Rh10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Tl  1.6200  1.9000  1.3325
  B  2.0400  0.8500  0.4100
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.5206]
_cell_length_b [9.5206]
_cell_length_c [3.1692]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Sc2TlB2Rh5]
_chemical_formula_sum '[Sc4 Tl2 B4 Rh10]'
_cell_volume [287.2667]
_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  0.1743  0.3257  0.0000  1
  Tl  Tl1  2  0.0000  0.0000  0.0000  1
  B  B2  4  0.1225  0.6225  0.0000  1
  Rh  Rh3  8  0.0718  0.7738  0.5000  1
  Rh  Rh4  2  0.0000  0.5000  0.5000  1
]