data_[Er6Te2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Te  2.1000  1.4000  1.2933
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.7984]
_cell_length_b [4.6061]
_cell_length_c [9.7687]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.4064]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Er3TeRh]
_chemical_formula_sum '[Er6 Te2 Rh2]'
_cell_volume [301.7824]
_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
[
  Er  Er0  2  0.0411  0.2500  0.6949  1
  Er  Er1  2  0.2995  0.2500  0.0233  1
  Er  Er2  2  0.4401  0.7500  0.2988  1
  Te  Te3  2  0.2709  0.7500  0.5765  1
  Rh  Rh4  2  0.1233  0.7500  0.0791  1
]