data_POs2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.39
_cell_length_b   4.39
_cell_length_c   6.03
_cell_angle_alpha   99.29
_cell_angle_beta   99.29
_cell_angle_gamma   39.88
_symmetry_Int_Tables_number   1
_chemical_formula_structural   POs2Pb
_chemical_formula_sum   'P1 Os2 Pb1'
_cell_volume   73.46
_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
  P  P2  1  0.72  0.0  0.01  1.0
  Os  Os0  1  0.06  0.0  0.63  1.0
  Os  Os1  1  0.38  0.0  0.87  1.0
  Pb  Pb3  1  0.89  0.0  0.35  1.0

data_POs2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.99
_cell_length_b   4.39
_cell_length_c   6.03
_cell_angle_alpha   99.29
_cell_angle_beta   90.0
_cell_angle_gamma   109.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   POs2Pb
_chemical_formula_sum   'P1 Os2 Pb1'
_cell_volume   73.46
_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
  P  P0  1  0.0  0.28  0.99  1.0
  Os  Os1  1  0.0  0.62  0.13  1.0
  Os  Os2  1  0.0  0.94  0.37  1.0
  Pb  Pb3  1  0.0  0.11  0.65  1.0

P Os Os Pb
P Os Os Pb 0 2 o o - 0 3 o o o 1 3 - o o 1 2 o o o 