data_[Fe6Os2Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Os  2.2000  1.3000  0.6730
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.4030]
_cell_length_b [3.8124]
_cell_length_c [8.5244]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.0578]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Fe3OsRh6]
_chemical_formula_sum '[Fe6 Os2 Rh12]'
_cell_volume [273.0338]
_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
[
  Fe  Fe0  2  0.2537  0.2500  0.0016  1
  Fe  Fe1  2  0.3544  0.7500  0.8017  1
  Fe  Fe2  2  0.4511  0.2500  0.6024  1
  Os  Os3  2  0.0476  0.2500  0.4057  1
  Rh  Rh4  2  0.0543  0.7500  0.9001  1
  Rh  Rh5  2  0.1523  0.7500  0.1992  1
  Rh  Rh6  2  0.1537  0.2500  0.7026  1
  Rh  Rh7  2  0.2537  0.7500  0.5037  1
  Rh  Rh8  2  0.3533  0.2500  0.3047  1
  Rh  Rh9  2  0.4512  0.7500  0.1008  1
]