data_[Ce4Mg4Cu4Te4S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Mg  1.3100  1.5000  0.8600
  Cu  1.9000  1.3500  0.8200
  Te  2.1000  1.4000  1.2933
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.8952]
_cell_length_b [13.2696]
_cell_length_c [11.3054]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [CeMgCuTeS2]
_chemical_formula_sum '[Ce4 Mg4 Cu4 Te4 S8]'
_cell_volume [584.3533]
_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
[
  Ce  Ce0  4  0.0000  0.0000  0.0000  1
  Mg  Mg1  4  0.0000  0.1972  0.7500  1
  Cu  Cu2  4  0.0000  0.4828  0.2500  1
  Te  Te3  4  0.0000  0.1192  0.2500  1
  S  S4  8  0.0000  0.3647  0.0982  1
]