data_AlB2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.4
_cell_length_b   3.4
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlB2Te
_chemical_formula_sum   'Al1 B2 Te1'
_cell_volume   61.82
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  B  B1  1  0.96  0.0  0.8  1.0
  B  B2  1  0.96  0.0  0.89  1.0
  Te  Te3  1  0.0  0.0  0.84  1.0

data_AlB2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   3.4
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlB2Te
_chemical_formula_sum   'Al1 B2 Te1'
_cell_volume   61.82
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  B  B1  1  0.96  0.0  0.8  1.0
  B  B2  1  0.96  0.0  0.89  1.0
  Te  Te3  1  0.0  0.0  0.84  1.0

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