data_[La2Ho2Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ho  1.2300  1.7500  1.0410
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.4318]
_cell_length_b [5.3431]
_cell_length_c [5.7698]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.9417]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LaHoRu]
_chemical_formula_sum '[La2 Ho2 Ru2]'
_cell_volume [165.8516]
_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  0.4385  0.7500  0.7122  1.0
  Ho  Ho1  2  0.0088  0.7500  0.1819  1.0
  Ru  Ru2  2  0.0919  0.2500  0.3459  1.0
]