data_Te2PbAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.06
_cell_length_b   6.06
_cell_length_c   6.06
_cell_angle_alpha   140.33
_cell_angle_beta   121.15
_cell_angle_gamma   73.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2PbAu
_chemical_formula_sum   'Te2 Pb1 Au1'
_cell_volume   118.99
_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
  Te  Te2  1  0.06  0.0  0.81  1.0
  Te  Te3  1  0.0  0.98  0.05  1.0
  Pb  Pb1  1  0.0  0.0  0.86  1.0
  Au  Au0  1  0.0  0.0  0.0  1.0

data_Te2PbAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.11
_cell_length_b   5.95
_cell_length_c   6.06
_cell_angle_alpha   119.42
_cell_angle_beta   109.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2PbAu
_chemical_formula_sum   'Te2 Pb1 Au1'
_cell_volume   118.99
_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
  Te  Te0  1  0.25  0.19  0.25  1.0
  Te  Te1  1  0.95  0.93  0.93  1.0
  Pb  Pb2  1  0.14  0.14  0.14  1.0
  Au  Au3  1  0.0  0.0  0.0  1.0

Te Te Pb Au