data_[Er4In5Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.6776]
_cell_length_b [3.5509]
_cell_length_c [9.7142]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.0911]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Er4In5Ru2]
_chemical_formula_sum '[Er4 In5 Ru2]'
_cell_volume [264.1566]
_cell_formula_units_Z [1]
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
[
  Er  Er0  2  0.1720  0.5000  0.8511  1.0
  Er  Er1  2  0.2129  0.5000  0.4473  1.0
  In  In2  2  0.1785  0.0000  0.1551  1.0
  In  In3  2  0.4491  0.0000  0.6760  1.0
  In  In4  1  0.5000  0.0000  0.0000  1.0
  Ru  Ru5  2  0.0738  0.0000  0.6442  1.0
]