data_Bi2TeOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32
_cell_length_b   5.32
_cell_length_c   3.65
_cell_angle_alpha   94.5
_cell_angle_beta   94.5
_cell_angle_gamma   104.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi2TeOs
_chemical_formula_sum   'Bi2 Te1 Os1'
_cell_volume   99.17
_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
  Bi  Bi0  1  0.39  0.89  0.81  1.0
  Bi  Bi1  1  0.39  0.11  0.81  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.24  0.0  0.0  1.0

data_Bi2TeOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.65
_cell_length_b   5.32
_cell_length_c   5.32
_cell_angle_alpha   104.96
_cell_angle_beta   94.5
_cell_angle_gamma   94.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi2TeOs
_chemical_formula_sum   'Bi2 Te1 Os1'
_cell_volume   99.17
_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
  Bi  Bi0  1  0.81  0.39  0.11  1.0
  Bi  Bi1  1  0.81  0.39  0.89  1.0
  Te  Te2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.24  0.0  1.0

Bi Bi Te Os