data_[Ac4Sb4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Sb  2.0500  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.9056]
_cell_length_b [4.6241]
_cell_length_c [8.8970]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.4867]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AcSbTe3]
_chemical_formula_sum '[Ac4 Sb4 Te12]'
_cell_volume [771.1497]
_cell_formula_units_Z [4]
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  4  0.2074  0.0000  0.2444  1
  Sb  Sb1  4  0.0599  0.5000  0.7049  1
  Te  Te2  4  0.0253  0.0000  0.2135  1
  Te  Te3  4  0.1580  0.5000  0.9818  1
  Te  Te4  4  0.1771  0.0000  0.6074  1
]