data_BTe2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26
_cell_length_b   6.26
_cell_length_c   6.26
_cell_angle_alpha   148.52
_cell_angle_beta   125.86
_cell_angle_gamma   63.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BTe2Pb
_chemical_formula_sum   'B1 Te2 Pb1'
_cell_volume   102.84
_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
  B  B0  1  0.0  0.0  0.0  1.0
  Te  Te2  1  0.7  0.0  0.72  1.0
  Te  Te3  1  0.0  0.85  0.59  1.0
  Pb  Pb1  1  0.0  0.0  0.31  1.0

data_BTe2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   5.7
_cell_length_c   6.26
_cell_angle_alpha   117.07
_cell_angle_beta   105.74
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BTe2Pb
_chemical_formula_sum   'B1 Te2 Pb1'
_cell_volume   102.84
_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
  B  B0  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.41  0.26  0.26  1.0
  Te  Te2  1  0.98  0.28  0.98  1.0
  Pb  Pb3  1  0.69  0.69  0.69  1.0

B Te Te Pb
B Te Te Pb 0 1 - o - 0 2 o - - 0 3 o o o 1 2 + - o 