data_[Mg6Cd10In1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P-31m]
_cell_length_a [8.5058]
_cell_length_b [8.5058]
_cell_length_c [6.1450]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [162]
_chemical_formula_structural [Mg6Cd10In]
_chemical_formula_sum '[Mg6 Cd10 In1]'
_cell_volume [385.0190]
_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
[
  Mg  Mg0  6  0.0000  0.3473  0.3450  1
  Cd  Cd1  6  0.0000  0.3007  0.8465  1
  Cd  Cd2  2  0.3333  0.6667  0.5000  1
  Cd  Cd3  2  0.3333  0.6667  0.0000  1
  In  In4  1  0.0000  0.0000  0.5000  1
]