data_[Zr8Al8Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Al  1.6100  1.2500  0.6750
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [8.2808]
_cell_length_b [5.3883]
_cell_length_c [9.2102]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [ZrAlRh]
_chemical_formula_sum '[Zr8 Al8 Rh8]'
_cell_volume [410.9577]
_cell_formula_units_Z [8]
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
[
  Zr  Zr0  4  0.1787  0.0000  0.6690  1.0
  Zr  Zr1  4  0.2906  0.0000  0.3342  1.0
  Al  Al2  4  0.2442  0.0000  0.9951  1.0
  Al  Al3  4  0.5000  0.2425  0.5885  1.0
  Rh  Rh4  4  0.0000  0.2467  0.4147  1.0
  Rh  Rh5  2  0.0000  0.0000  0.1656  1.0
  Rh  Rh6  2  0.5000  0.0000  0.8314  1.0
]