data_[Mo4Ru4Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mo  2.1600  1.4500  0.7750
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.3788]
_cell_length_b [5.5218]
_cell_length_c [9.5287]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [MoRuRh2]
_chemical_formula_sum '[Mo4 Ru4 Rh8]'
_cell_volume [230.3910]
_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
[
  Mo  Mo0  2  0.0000  0.0000  0.6655  1.0
  Mo  Mo1  2  0.5000  0.0000  0.3344  1.0
  Ru  Ru2  4  0.5000  0.2496  0.5829  1.0
  Rh  Rh3  4  0.0000  0.2494  0.4167  1.0
  Rh  Rh4  2  0.0000  0.0000  0.1668  1.0
  Rh  Rh5  2  0.5000  0.0000  0.8338  1.0
]