data_[Te6Ir1Rh1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5236]
_cell_length_b [6.5761]
_cell_length_c [6.6379]
_cell_angle_alpha [119.6415]
_cell_angle_beta [119.3778]
_cell_angle_gamma [90.0432]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Te6IrRh]
_chemical_formula_sum '[Te6 Ir1 Rh1]'
_cell_volume [204.2345]
_cell_formula_units_Z [1]
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
[
  Te  Te0  2  0.0516  0.2693  0.8218  1.0
  Te  Te1  2  0.2513  0.4386  0.5004  1.0
  Te  Te2  2  0.4495  0.9484  0.1832  1.0
  Ir  Ir3  1  0.5000  0.5000  0.0000  1.0
  Rh  Rh4  1  0.0000  0.0000  0.0000  1.0
]