data_[Re4Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.0886]
_cell_length_b [7.2292]
_cell_length_c [7.6734]
_cell_angle_alpha [92.3165]
_cell_angle_beta [104.2044]
_cell_angle_gamma [118.9260]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [ReTe2]
_chemical_formula_sum '[Re4 Te8]'
_cell_volume [327.7260]
_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
[
  Re  Re0  2  0.0715  0.3222  0.4891  1.0
  Re  Re1  2  0.4862  0.2977  0.4956  1.0
  Te  Te2  2  0.2197  0.1063  0.7071  1.0
  Te  Te3  2  0.2477  0.8624  0.3207  1.0
  Te  Te4  2  0.2521  0.3839  0.2144  1.0
  Te  Te5  2  0.2791  0.6640  0.7482  1.0
]