data_CoBiTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.02
_cell_length_b   4.02
_cell_length_c   7.69
_cell_angle_alpha   99.37
_cell_angle_beta   99.37
_cell_angle_gamma   55.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoBiTe2
_chemical_formula_sum   'Co1 Bi1 Te2'
_cell_volume   100.98
_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  Co1  1  0.01  0.0  0.73  1.0
  Bi  Bi0  1  0.71  0.0  0.35  1.0
  Te  Te2  1  0.22  0.0  0.68  1.0
  Te  Te3  1  0.57  0.0  0.58  1.0

data_CoBiTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.77
_cell_length_b   4.02
_cell_length_c   7.69
_cell_angle_alpha   99.37
_cell_angle_beta   90.0
_cell_angle_gamma   117.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoBiTe2
_chemical_formula_sum   'Co1 Bi1 Te2'
_cell_volume   100.98
_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  0.99  0.27  1.0
  Bi  Bi1  1  0.0  0.29  0.65  1.0
  Te  Te2  1  0.0  0.43  0.42  1.0
  Te  Te3  1  0.0  0.78  0.32  1.0

Co Bi Te Te
Co Bi Te Te 0 2 o o o 0 3 - o o 1 3 o o o 2 3 o o o 