data_[Ac6Ce2Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Ce  1.1200  1.8500  1.0800
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [13.1757]
_cell_length_b [4.6869]
_cell_length_c [13.6273]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.3009]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ac3CeTe6]
_chemical_formula_sum '[Ac6 Ce2 Te12]'
_cell_volume [798.9644]
_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  0.1584  0.2500  0.0778  1
  Ac  Ac1  2  0.3155  0.7500  0.4944  1
  Ac  Ac2  2  0.4201  0.2500  0.8296  1
  Ce  Ce3  2  0.0414  0.2500  0.6865  1
  Te  Te4  2  0.0839  0.7500  0.8925  1
  Te  Te5  2  0.1057  0.2500  0.4623  1
  Te  Te6  2  0.1805  0.7500  0.2489  1
  Te  Te7  2  0.2392  0.7500  0.7128  1
  Te  Te8  2  0.4031  0.2500  0.0687  1
  Te  Te9  2  0.4838  0.2500  0.6177  1
]