data_[Ce24Co8Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Co  1.8800  1.3500  0.7683
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9169]
_cell_length_b [9.6732]
_cell_length_c [8.6163]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.3542]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce6Co2Ru]
_chemical_formula_sum '[Ce24 Co8 Ru4]'
_cell_volume [799.9199]
_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
[
  Ce  Ce0  8  0.0027  0.1751  0.2062  1
  Ce  Ce1  8  0.2489  0.1898  0.7045  1
  Ce  Ce2  4  0.1465  0.5000  0.4703  1
  Ce  Ce3  4  0.1644  0.5000  0.8864  1
  Co  Co4  4  0.0000  0.2983  0.5000  1
  Co  Co5  4  0.1455  0.0000  0.1235  1
  Ru  Ru6  2  0.0000  0.0000  0.5000  1
  Ru  Ru7  2  0.0000  0.5000  0.0000  1
]