data_Sb2TeOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99
_cell_length_b   4.99
_cell_length_c   6.66
_cell_angle_alpha   111.33
_cell_angle_beta   111.33
_cell_angle_gamma   44.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2TeOs
_chemical_formula_sum   'Sb2 Te1 Os1'
_cell_volume   107.5
_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
  Sb  Sb1  1  0.21  0.0  0.44  1.0
  Sb  Sb2  1  0.65  0.0  0.23  1.0
  Te  Te3  1  0.99  0.0  0.29  1.0
  Os  Os0  1  0.65  0.0  0.33  1.0

data_Sb2TeOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.81
_cell_length_b   4.99
_cell_length_c   6.66
_cell_angle_alpha   111.33
_cell_angle_beta   90.0
_cell_angle_gamma   112.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2TeOs
_chemical_formula_sum   'Sb2 Te1 Os1'
_cell_volume   107.5
_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
  Sb  Sb0  1  0.0  0.35  0.77  1.0
  Sb  Sb1  1  0.0  0.79  0.56  1.0
  Te  Te2  1  0.0  0.01  0.71  1.0
  Os  Os3  1  0.0  0.35  0.67  1.0

Sb Sb Te Os