data_La2POs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55
_cell_length_b   6.55
_cell_length_c   6.55
_cell_angle_alpha   146.41
_cell_angle_beta   140.71
_cell_angle_gamma   52.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2POs
_chemical_formula_sum   'La2 P1 Os1'
_cell_volume   98.06
_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  0.2  0.85  1.0
  La  La1  1  0.0  0.0  0.63  1.0
  P  P3  1  0.0  0.0  0.78  1.0
  Os  Os2  1  0.89  0.0  0.24  1.0

data_La2POs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.79
_cell_length_b   4.41
_cell_length_c   6.55
_cell_angle_alpha   109.64
_cell_angle_beta   106.79
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2POs
_chemical_formula_sum   'La2 P1 Os1'
_cell_volume   98.06
_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  0.63  0.63  1.0
  La  La1  1  0.8  0.65  0.65  1.0
  P  P2  1  0.0  0.78  0.78  1.0
  Os  Os3  1  0.0  0.24  0.35  1.0

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