data_[Li4Mg2In4Hg10]
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
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.3136]
_cell_length_b [10.3136]
_cell_length_c [4.2647]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Li2MgIn2Hg5]
_chemical_formula_sum '[Li4 Mg2 In4 Hg10]'
_cell_volume [453.6312]
_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  4  0.1240  0.6240  0.0000  1
  Mg  Mg1  2  0.0000  0.0000  0.0000  1
  In  In2  4  0.1700  0.3300  0.0000  1
  Hg  Hg3  8  0.0889  0.8066  0.5000  1
  Hg  Hg4  2  0.0000  0.5000  0.5000  1
]