data_BTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.53
_cell_length_b   5.53
_cell_length_c   5.53
_cell_angle_alpha   112.45
_cell_angle_beta   112.45
_cell_angle_gamma   103.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BTe2
_chemical_formula_sum   'B2 Te4'
_cell_volume   129.35
_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
  B  B0  1  0.0  0.0  0.13  1.0
  B  B1  1  0.0  0.0  0.71  1.0
  Te  Te2  1  0.1  0.98  0.0  1.0
  Te  Te3  1  0.98  0.1  0.42  1.0
  Te  Te4  1  0.17  0.1  0.0  1.0
  Te  Te5  1  0.9  0.98  0.42  1.0

data_BTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.53
_cell_length_b   5.53
_cell_length_c   5.53
_cell_angle_alpha   103.66
_cell_angle_beta   112.45
_cell_angle_gamma   112.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BTe2
_chemical_formula_sum   'B2 Te4'
_cell_volume   129.35
_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
  B  B0  1  0.13  0.13  0.13  1.0
  B  B1  1  0.71  0.71  0.71  1.0
  Te  Te2  1  -0.0  0.83  0.9  1.0
  Te  Te3  1  -0.0  0.9  0.02  1.0
  Te  Te4  1  0.42  0.44  0.32  1.0
  Te  Te5  1  0.42  0.52  0.44  1.0

B B Te Te Te Te
B B Te Te Te Te 0 2 o - o 1 5 - - o 1 2 o - + 1 4 o o + 2 4 o + o 3 5 o - o 