data_[Zn4Ga2Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.1114]
_cell_length_b [4.2248]
_cell_length_c [5.3521]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.5133]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Zn2GaRu]
_chemical_formula_sum '[Zn4 Ga2 Ru2]'
_cell_volume [114.8306]
_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
[
  Zn  Zn0  2  0.1120  0.7500  0.1716  1
  Zn  Zn1  2  0.3734  0.2500  0.9761  1
  Ga  Ga2  2  0.3346  0.2500  0.4693  1
  Ru  Ru3  2  0.1755  0.7500  0.6802  1
]