data_[Ce2B4Ir3Rh3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  B  2.0400  0.8500  0.4100
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.5178]
_cell_length_b [3.1018]
_cell_length_c [9.5513]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0135]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ce2B4(IrRh)3]
_chemical_formula_sum '[Ce2 B4 Ir3 Rh3]'
_cell_volume [163.4723]
_cell_formula_units_Z [1]
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
[
  Ce  Ce0  2  0.2501  0.0000  0.2498  1.0
  B  B1  2  0.2500  0.0000  0.5833  1.0
  B  B2  2  0.2501  0.0000  0.9165  1.0
  Ir  Ir3  2  0.2500  0.5000  0.7503  1.0
  Ir  Ir4  1  0.0000  0.5000  0.5000  1.0
  Rh  Rh5  1  0.0000  0.5000  0.0000  1.0
  Rh  Rh6  1  0.5000  0.5000  0.0000  1.0
  Rh  Rh7  1  0.5000  0.5000  0.5000  1.0
]