data_[Al4In5Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.3752]
_cell_length_b [3.1162]
_cell_length_c [9.5826]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.5929]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Al4In5Ru2]
_chemical_formula_sum '[Al4 In5 Ru2]'
_cell_volume [219.7999]
_cell_formula_units_Z [1]
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
[
  Al  Al0  2  0.1701  0.5000  0.4438  1
  Al  Al1  2  0.2117  0.5000  0.8374  1
  In  In2  2  0.1445  0.0000  0.1402  1
  In  In3  2  0.4851  0.0000  0.6578  1
  In  In4  1  0.5000  0.0000  0.0000  1
  Ru  Ru5  2  0.0940  0.0000  0.6462  1
]