data_[Ac12Si4Te6Se2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Si  1.9000  1.1000  0.5400
  Te  2.1000  1.4000  1.2933
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [20.4457]
_cell_length_b [4.6206]
_cell_length_c [9.3979]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.7185]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac6Si2Te3Se]
_chemical_formula_sum '[Ac12 Si4 Te6 Se2]'
_cell_volume [858.7044]
_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  4  0.0089  0.0000  0.2444  1
  Ac  Ac1  4  0.1650  0.5000  0.1037  1
  Ac  Ac2  4  0.1732  0.5000  0.5670  1
  Si  Si3  4  0.1653  0.0000  0.3296  1
  Te  Te4  4  0.1640  0.0000  0.8336  1
  Te  Te5  2  0.0000  0.5000  0.5000  1
  Se  Se6  2  0.0000  0.5000  0.0000  1
]