data_B2OsRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47
_cell_length_b   5.47
_cell_length_c   5.47
_cell_angle_alpha   149.67
_cell_angle_beta   149.61
_cell_angle_gamma   43.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B2OsRu
_chemical_formula_sum   'B2 Os1 Ru1'
_cell_volume   41.73
_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
  B  B0  1  0.0  0.43  0.66  1.0
  B  B1  1  0.0  0.0  0.12  1.0
  Os  Os2  1  0.0  0.43  0.42  1.0
  Ru  Ru3  1  0.0  0.0  0.04  1.0

data_B2OsRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   2.87
_cell_length_c   5.47
_cell_angle_alpha   105.19
_cell_angle_beta   105.17
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B2OsRu
_chemical_formula_sum   'B2 Os1 Ru1'
_cell_volume   41.73
_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
  B  B0  1  0.34  0.77  0.77  1.0
  B  B1  1  0.88  0.88  0.88  1.0
  Os  Os2  1  0.58  0.01  0.01  1.0
  Ru  Ru3  1  0.96  0.96  0.96  1.0

B B Os Ru