data_[Gd6Mg2Al2S14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  Mg  1.3100  1.5000  0.8600
  Al  1.6100  1.2500  0.6750
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P6_3]
_cell_length_a [9.8121]
_cell_length_b [9.8121]
_cell_length_c [6.1570]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [173]
_chemical_formula_structural [Gd3MgAlS7]
_chemical_formula_sum '[Gd6 Mg2 Al2 S14]'
_cell_volume [513.3652]
_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
[
  Gd  Gd0  6  0.1468  0.7676  0.7131  1
  Mg  Mg1  2  0.0000  0.0000  0.0335  1
  Al  Al2  2  0.3333  0.6667  0.1358  1
  S  S3  6  0.0953  0.5188  0.9810  1
  S  S4  6  0.1000  0.8579  0.2932  1
  S  S5  2  0.3333  0.6667  0.4997  1
]