data_[Zr2Te6Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Te  2.1000  1.4000  1.2933
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [4.4558]
_cell_length_b [20.3657]
_cell_length_c [11.7730]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [ZrTe3Pb]
_chemical_formula_sum '[Zr2 Te6 Pb2]'
_cell_volume [1068.3353]
_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
[
  Zr  Zr0  2  0.0000  0.4980  0.2804  1
  Te  Te1  2  0.0000  0.3683  0.7359  1
  Te  Te2  2  0.0000  0.4801  0.0183  1
  Te  Te3  2  0.5000  0.4124  0.2693  1
  Pb  Pb4  2  0.5000  0.4082  0.5505  1
]