data_[Yb2Te3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Yb  1.1000  1.7500  1.0840
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [4.7002]
_cell_length_b [4.7002]
_cell_length_c [21.5857]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Yb2Te3]
_chemical_formula_sum '[Yb2 Te3]'
_cell_volume [412.9883]
_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
[
  Yb  Yb0  2  0.3333  0.6667  0.5903  1
  Te  Te1  2  0.6667  0.3333  0.6525  1
  Te  Te2  1  0.6667  0.3333  0.5000  1
]