data_[Li2Mg10In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [6.5771]
_cell_length_b [12.8150]
_cell_length_c [4.2008]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [LiMg5In2]
_chemical_formula_sum '[Li2 Mg10 In4]'
_cell_volume [354.0642]
_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
[
  Li  Li0  2  0.0000  0.5000  0.0000  1.0
  Mg  Mg1  4  0.0057  0.7493  0.0000  1.0
  Mg  Mg2  4  0.2414  0.3778  0.5000  1.0
  Mg  Mg3  2  0.0000  0.0000  0.0000  1.0
  In  In4  4  0.2495  0.6241  0.5000  1.0
]