data_LaBi2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.65
_cell_length_b   7.23
_cell_length_c   7.23
_cell_angle_alpha   37.55
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBi2Os
_chemical_formula_sum   'La1 Bi2 Os1'
_cell_volume   116.39
_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
  La  La2  1  0.0  0.0  0.15  1.0
  Bi  Bi0  1  0.0  0.0  0.24  1.0
  Bi  Bi1  1  0.83  0.0  0.47  1.0
  Os  Os3  1  0.83  0.0  0.37  1.0

data_LaBi2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.65
_cell_length_b   4.65
_cell_length_c   7.23
_cell_angle_alpha   108.78
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBi2Os
_chemical_formula_sum   'La1 Bi2 Os1'
_cell_volume   116.39
_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
  La  La0  1  0.0  0.15  0.15  1.0
  Bi  Bi1  1  0.0  0.24  0.24  1.0
  Bi  Bi2  1  0.17  0.47  0.47  1.0
  Os  Os3  1  0.17  0.37  0.37  1.0

La Bi Bi Os
La Bi Bi Os 0 1 o o o 2 3 o o o 