data_[La4Tl2Ag2Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tl  1.6200  1.9000  1.3325
  Ag  1.9300  1.6000  1.0867
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.1354]
_cell_length_b [4.1926]
_cell_length_c [8.4268]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.3442]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La2TlAgRu]
_chemical_formula_sum '[La4 Tl2 Ag2 Ru2]'
_cell_volume [269.4912]
_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  0.0343  0.7500  0.7449  1.0
  La  La1  2  0.3505  0.2500  0.1235  1.0
  Tl  Tl2  2  0.3308  0.7500  0.4610  1.0
  Ag  Ag3  2  0.3231  0.2500  0.7112  1.0
  Ru  Ru4  2  0.1108  0.7500  0.1232  1.0
]