data_[La6Er2In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.3553]
_cell_length_b [10.3113]
_cell_length_c [6.9017]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [La3ErIn2]
_chemical_formula_sum '[La6 Er2 In4]'
_cell_volume [381.1080]
_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  0.0000  0.0416  0.4481  1
  La  La1  2  0.0000  0.3257  0.8090  1
  La  La2  2  0.5000  0.1856  0.1978  1
  Er  Er3  2  0.5000  0.4597  0.5398  1
  In  In4  2  0.0000  0.3634  0.2968  1
  In  In5  2  0.5000  0.1446  0.7085  1
]