data_Te2RuPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.2
_cell_length_b   3.58
_cell_length_c   7.41
_cell_angle_alpha   90.0
_cell_angle_beta   103.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2RuPb
_chemical_formula_sum   'Te2 Ru1 Pb1'
_cell_volume   108.37
_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  0.49  0.79  0.43  1.0
  Te  Te3  1  0.44  0.0  0.03  1.0
  Ru  Ru1  1  0.54  0.0  0.29  1.0
  Pb  Pb0  1  0.45  0.79  0.06  1.0

data_Te2RuPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.58
_cell_length_b   4.2
_cell_length_c   7.41
_cell_angle_alpha   103.39
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2RuPb
_chemical_formula_sum   'Te2 Ru1 Pb1'
_cell_volume   108.37
_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  0.0  0.56  0.97  1.0
  Te  Te1  1  0.21  0.51  0.57  1.0
  Ru  Ru2  1  0.0  0.46  0.71  1.0
  Pb  Pb3  1  0.21  0.55  0.94  1.0

Te Te Ru Pb