data_[La16Zn2Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Zn  1.6500  1.3500  0.8800
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8734]
_cell_length_b [8.7437]
_cell_length_c [6.9573]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.3047]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La8ZnRu2]
_chemical_formula_sum '[La16 Zn2 Ru4]'
_cell_volume [734.4603]
_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
[
  La  La0  8  0.1200  0.2994  0.2813  1
  La  La1  4  0.1195  0.0000  0.7058  1
  La  La2  4  0.1635  0.5000  0.7942  1
  Zn  Zn3  2  0.0000  0.0000  0.0000  1
  Ru  Ru4  4  0.1717  0.0000  0.3493  1
]