data_[La6Sn2Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sn  1.9600  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.8163]
_cell_length_b [6.2386]
_cell_length_c [8.9595]
_cell_angle_alpha [110.1085]
_cell_angle_beta [97.1607]
_cell_angle_gamma [104.1209]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [La3SnRu]
_chemical_formula_sum '[La6 Sn2 Ru2]'
_cell_volume [288.1930]
_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  0.0162  0.3700  0.2863  1.0
  La  La1  2  0.3344  0.1838  0.5983  1.0
  La  La2  2  0.3954  0.2478  0.0345  1.0
  Sn  Sn3  2  0.1653  0.8361  0.1753  1.0
  Ru  Ru4  2  0.4420  0.7056  0.6454  1.0
]