data_[La2Zn6Ru2]
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 [P2_1/m]
_cell_length_a [5.5546]
_cell_length_b [5.3185]
_cell_length_c [6.2568]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.2897]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LaZn3Ru]
_chemical_formula_sum '[La2 Zn6 Ru2]'
_cell_volume [184.5364]
_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  2  0.3636  0.2500  0.2989  1.0
  Zn  Zn1  4  0.1614  0.0112  0.8384  1.0
  Zn  Zn2  2  0.1076  0.7500  0.4611  1.0
  Ru  Ru3  2  0.3879  0.7500  0.1497  1.0
]