data_[Li2La1Sc1In2Cu2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  La  1.1000  1.9500  1.1720
  Sc  1.3600  1.6000  0.8850
  In  1.7800  1.5500  0.9400
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.7358]
_cell_length_b [4.7358]
_cell_length_c [6.6938]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Li2LaSc(InCu)2]
_chemical_formula_sum '[Li2 La1 Sc1 In2 Cu2]'
_cell_volume [150.1241]
_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
[
  Li  Li0  2  0.0000  0.5000  0.2320  1
  La  La1  1  0.0000  0.0000  0.5000  1
  Sc  Sc2  1  0.5000  0.5000  0.0000  1
  In  In3  1  0.0000  0.0000  0.0000  1
  In  In4  1  0.5000  0.5000  0.5000  1
  Cu  Cu5  2  0.0000  0.5000  0.7732  1
]