data_CoB2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.67
_cell_length_b   3.67
_cell_length_c   4.82
_cell_angle_alpha   94.29
_cell_angle_beta   94.29
_cell_angle_gamma   54.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoB2Te
_chemical_formula_sum   'Co1 B2 Te1'
_cell_volume   52.79
_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
  Co  Co2  1  0.05  0.0  0.93  1.0
  B  B0  1  0.23  0.0  0.76  1.0
  B  B1  1  0.31  0.0  0.12  1.0
  Te  Te3  1  0.12  0.0  0.4  1.0

data_CoB2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   3.67
_cell_length_c   4.82
_cell_angle_alpha   94.29
_cell_angle_beta   90.0
_cell_angle_gamma   117.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoB2Te
_chemical_formula_sum   'Co1 B2 Te1'
_cell_volume   52.79
_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
  Co  Co0  1  0.0  0.95  0.07  1.0
  B  B1  1  0.0  0.69  0.88  1.0
  B  B2  1  0.0  0.77  0.24  1.0
  Te  Te3  1  0.0  0.88  0.6  1.0

Co B B Te
Co B B Te 0 1 o o o 0 2 o o + 1 3 o o o 2 3 o o o 