data_[Nd16Co2Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Co  1.8800  1.3500  0.7683
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.3758]
_cell_length_b [12.8449]
_cell_length_c [6.3632]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.7307]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Nd8CoRu2]
_chemical_formula_sum '[Nd16 Co2 Ru4]'
_cell_volume [635.9430]
_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
[
  Nd  Nd0  4  0.2212  0.1330  0.5924  1
  Nd  Nd1  4  0.2877  0.3691  0.3652  1
  Nd  Nd2  4  0.4980  0.3007  0.9916  1
  Nd  Nd3  2  0.1499  0.5000  0.7910  1
  Nd  Nd4  2  0.3525  0.0000  0.1800  1
  Co  Co5  2  0.0045  0.0000  0.1751  1
  Ru  Ru6  4  0.0065  0.3106  0.4775  1
]