data_[Te4Rh4Pb4]
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
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9440]
_cell_length_b [6.7906]
_cell_length_c [6.9738]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.6016]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [TeRhPb]
_chemical_formula_sum '[Te4 Rh4 Pb4]'
_cell_volume [294.0308]
_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
[
  Te  Te0  4  0.3437  0.1330  0.6724  1.0
  Rh  Rh1  4  0.2897  0.0096  0.2940  1.0
  Pb  Pb2  4  0.1418  0.6532  0.3781  1.0
]