data_[Co6Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.3268]
_cell_length_b [3.8491]
_cell_length_c [5.3041]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1556]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CoTe2]
_chemical_formula_sum '[Co6 Te12]'
_cell_volume [394.5730]
_cell_formula_units_Z [6]
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
[
  Co  Co0  4  0.1586  0.5000  0.0082  1.0
  Co  Co1  2  0.0000  0.0000  0.5000  1.0
  Te  Te2  4  0.0456  0.5000  0.7749  1.0
  Te  Te3  4  0.1189  0.0000  0.2834  1.0
  Te  Te4  4  0.2170  0.0000  0.7688  1.0
]