data_Bi2MoOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.2
_cell_length_b   4.48
_cell_length_c   5.9
_cell_angle_alpha   90.0
_cell_angle_beta   93.66
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi2MoOs
_chemical_formula_sum   'Bi2 Mo1 Os1'
_cell_volume   84.47
_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  0.61  0.24  0.41  1.0
  Bi  Bi1  1  0.21  0.24  0.48  1.0
  Mo  Mo2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.41  0.0  0.94  1.0

data_Bi2MoOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.2
_cell_length_b   4.48
_cell_length_c   5.9
_cell_angle_alpha   90.0
_cell_angle_beta   93.66
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi2MoOs
_chemical_formula_sum   'Bi2 Mo1 Os1'
_cell_volume   84.47
_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  0.21  0.24  0.48  1.0
  Bi  Bi1  1  0.61  0.24  0.41  1.0
  Mo  Mo2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.41  0.0  0.94  1.0

Bi Bi Mo Os
Bi Bi Mo Os 0 1 o o o 2 3 o o - 