data_BP2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.42
_cell_length_b   6.42
_cell_length_c   6.42
_cell_angle_alpha   26.47
_cell_angle_beta   26.47
_cell_angle_gamma   26.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BP2Os
_chemical_formula_sum   'B1 P2 Os1'
_cell_volume   46.33
_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  0.0  0.0  1.0
  P  P2  1  0.0  0.0  0.93  1.0
  P  P3  1  0.0  0.0  0.64  1.0
  Os  Os1  1  0.0  0.0  0.29  1.0

data_BP2Os
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.09
_cell_length_b   2.94
_cell_length_c   6.42
_cell_angle_alpha   90.0
_cell_angle_beta   105.33
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BP2Os
_chemical_formula_sum   'B2 P4 Os2'
_cell_volume   92.66
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  P  P1  2  0.0  0.0  0.07  1.0
  P  P2  2  0.0  0.0  0.36  1.0
  Os  Os3  2  0.0  0.0  0.71  1.0

B P P Os