data_InTePb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.6
_cell_length_b   11.6
_cell_length_c   11.6
_cell_angle_alpha   17.26
_cell_angle_beta   17.26
_cell_angle_gamma   17.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InTePb2
_chemical_formula_sum   'In1 Te1 Pb2'
_cell_volume   119.74
_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
  In  In0  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.0  0.0  0.13  1.0
  Pb  Pb1  1  0.0  0.0  0.57  1.0
  Pb  Pb2  1  0.0  0.0  0.69  1.0

data_InTePb2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.03
_cell_length_b   3.48
_cell_length_c   11.6
_cell_angle_alpha   90.0
_cell_angle_beta   99.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   InTePb2
_chemical_formula_sum   'In2 Te2 Pb4'
_cell_volume   239.48
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  In  In0  2  0.0  0.0  0.0  1.0
  Te  Te1  2  0.0  0.0  0.87  1.0
  Pb  Pb2  2  0.0  0.0  0.31  1.0
  Pb  Pb3  2  0.0  0.0  0.43  1.0

In Te Pb Pb