data_[Mg4Ga2Si4Ru10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Ga  1.8100  1.3000  0.7600
  Si  1.9000  1.1000  0.5400
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.7046]
_cell_length_b [9.7046]
_cell_length_c [3.1584]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Mg2GaSi2Ru5]
_chemical_formula_sum '[Mg4 Ga2 Si4 Ru10]'
_cell_volume [297.4547]
_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
[
  Mg  Mg0  4  0.1699  0.6699  0.0000  1.0
  Ga  Ga1  2  0.0000  0.0000  0.0000  1.0
  Si  Si2  4  0.1305  0.3695  0.0000  1.0
  Ru  Ru3  8  0.0695  0.1983  0.5000  1.0
  Ru  Ru4  2  0.0000  0.5000  0.5000  1.0
]