data_TaOsPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.82
_cell_length_b   2.82
_cell_length_c   6.93
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaOsPd
_chemical_formula_sum   'Ta1 Os1 Pd1'
_cell_volume   47.77
_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  0.63  0.64  1.0
  Os  Os0  1  0.41  0.81  0.91  1.0
  Pd  Pd1  1  0.0  0.0  0.32  1.0

data_TaOsPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   2.82
_cell_length_c   6.93
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaOsPd
_chemical_formula_sum   'Ta1 Os1 Pd1'
_cell_volume   47.77
_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  0.63  0.64  1.0
  Pd  Pd1  1  0.0  0.0  0.32  1.0
  Os  Os2  1  0.41  0.81  0.91  1.0

Ta Os Pd
Ta Os Pd 0 1 - - o 0 1 - o o 0 1 o o o 0 0 + + o 0 0 o + o 0 0 + o o 0 2 o + o 0 2 o o o 1 1 + + o 1 1 o + o 1 1 + o o 1 2 + + + 1 2 o + + 2 2 + + o 2 2 o + o 2 2 + o o 