data_[Te4Rh2I2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  Rh  2.2800  1.3500  0.7450
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.5928]
_cell_length_b [3.1912]
_cell_length_c [9.4685]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.5999]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Te2RhI]
_chemical_formula_sum '[Te4 Rh2 I2]'
_cell_volume [229.3329]
_cell_formula_units_Z [2]
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  4  0.2007  0.5000  0.3389  1
  Rh  Rh1  2  0.0000  0.0000  0.5000  1
  I  I2  2  0.0000  0.0000  0.0000  1
]