data_[Nb10Mo4Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  Mo  2.1600  1.4500  0.7750
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [5.4859]
_cell_length_b [10.8312]
_cell_length_c [4.6234]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Nb5Mo2Ru]
_chemical_formula_sum '[Nb10 Mo4 Ru2]'
_cell_volume [274.7167]
_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
[
  Nb  Nb0  4  0.1481  0.2568  0.0000  1
  Nb  Nb1  4  0.1640  0.6186  0.5000  1
  Nb  Nb2  2  0.0000  0.0000  0.0000  1
  Mo  Mo3  4  0.1653  0.8794  0.5000  1
  Ru  Ru4  2  0.0000  0.5000  0.0000  1
]