data_[Ac2Y6Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Y  1.2200  1.8000  1.0400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [4.3780]
_cell_length_b [4.3780]
_cell_length_c [30.2411]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [194]
_chemical_formula_structural [AcY3Te4]
_chemical_formula_sum '[Ac2 Y6 Te8]'
_cell_volume [501.9696]
_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
[
  Ac  Ac0  2  0.3333  0.6667  0.2500  1
  Y  Y1  4  0.3333  0.6667  0.8824  1
  Y  Y2  2  0.0000  0.0000  0.0000  1
  Te  Te3  4  0.0000  0.0000  0.1766  1
  Te  Te4  4  0.3333  0.6667  0.4411  1
]