data_[Li2Lu2Te6Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Lu  1.2700  1.7500  1.0010
  Te  2.1000  1.4000  1.2933
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.1939]
_cell_length_b [4.3434]
_cell_length_c [10.6986]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.9722]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiLuTe3Pb]
_chemical_formula_sum '[Li2 Lu2 Te6 Pb2]'
_cell_volume [366.0556]
_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
[
  Li  Li0  2  0.0834  0.2500  0.0886  1
  Lu  Lu1  2  0.3057  0.7500  0.3383  1
  Te  Te2  2  0.0516  0.2500  0.3360  1
  Te  Te3  2  0.2734  0.7500  0.0447  1
  Te  Te4  2  0.4248  0.7500  0.6346  1
  Pb  Pb5  2  0.2644  0.2500  0.8045  1
]