data_[Cs4Sc4Co4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sc  1.3600  1.6000  0.8850
  Co  1.8800  1.3500  0.7683
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.1533]
_cell_length_b [17.5048]
_cell_length_c [11.0006]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [CsScCoTe3]
_chemical_formula_sum '[Cs4 Sc4 Co4 Te12]'
_cell_volume [799.7754]
_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
[
  Cs  Cs0  4  0.0000  0.2547  0.2500  1.0
  Sc  Sc1  4  0.0000  0.0000  0.0000  1.0
  Co  Co2  4  0.0000  0.4699  0.7500  1.0
  Te  Te3  8  0.0000  0.3878  0.5587  1.0
  Te  Te4  4  0.0000  0.0585  0.7500  1.0
]