data_TaPOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.54
_cell_length_b   4.54
_cell_length_c   4.54
_cell_angle_alpha   141.83
_cell_angle_beta   126.01
_cell_angle_gamma   68.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaPOs
_chemical_formula_sum   'Ta1 P1 Os1'
_cell_volume   46.1
_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
  Ta  Ta2  1  0.0  0.0  0.55  1.0
  P  P1  1  0.0  0.0  0.04  1.0
  Os  Os0  1  0.0  0.0  0.47  1.0

data_TaPOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.12
_cell_length_c   4.54
_cell_angle_alpha   117.0
_cell_angle_beta   109.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaPOs
_chemical_formula_sum   'Ta1 P1 Os1'
_cell_volume   46.1
_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
  Ta  Ta0  1  0.0  0.55  0.55  1.0
  P  P1  1  0.0  0.04  0.04  1.0
  Os  Os2  1  0.0  0.47  0.47  1.0

Ta P Os