data_[Li4Mg1Ge1Pt2]
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
  Ge  2.0100  1.2500  0.7700
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.3643]
_cell_length_b [4.3643]
_cell_length_c [6.0803]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Li4MgGePt2]
_chemical_formula_sum '[Li4 Mg1 Ge1 Pt2]'
_cell_volume [115.8103]
_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  0.2396  1
  Li  Li1  1  0.0000  0.0000  0.5000  1
  Li  Li2  1  0.5000  0.5000  0.0000  1
  Mg  Mg3  1  0.5000  0.5000  0.5000  1
  Ge  Ge4  1  0.0000  0.0000  0.0000  1
  Pt  Pt5  2  0.0000  0.5000  0.7722  1
]