data_[Ga4Rh40]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.5598]
_cell_length_b [3.8257]
_cell_length_c [32.0310]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0084]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [GaRh10]
_chemical_formula_sum '[Ga4 Rh40]'
_cell_volume [1048.9164]
_cell_formula_units_Z [4]
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
[
  Ga  Ga0  4  0.1478  0.0000  0.2234  1
  Rh  Rh1  4  0.0475  0.5000  0.2713  1
  Rh  Rh2  4  0.0500  0.0000  0.6743  1
  Rh  Rh3  4  0.0502  0.5000  0.5403  1
  Rh  Rh4  4  0.0503  0.0000  0.4060  1
  Rh  Rh5  4  0.1479  0.5000  0.6206  1
  Rh  Rh6  4  0.1498  0.0000  0.4866  1
  Rh  Rh7  4  0.1514  0.5000  0.3522  1
  Rh  Rh8  4  0.1525  0.0000  0.7557  1
  Rh  Rh9  4  0.2462  0.5000  0.7012  1
  Rh  Rh10  4  0.2498  0.5000  0.4328  1
]