data_TlOsPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59
_cell_length_b   5.59
_cell_length_c   5.59
_cell_angle_alpha   150.2
_cell_angle_beta   128.33
_cell_angle_gamma   60.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlOsPd2
_chemical_formula_sum   'Tl1 Os1 Pd2'
_cell_volume   67.7
_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
  Tl  Tl3  1  0.0  0.44  0.02  1.0
  Os  Os0  1  0.0  0.0  0.3  1.0
  Pd  Pd1  1  0.0  0.44  0.76  1.0
  Pd  Pd2  1  0.0  0.0  0.4  1.0

data_TlOsPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   4.88
_cell_length_c   5.59
_cell_angle_alpha   115.84
_cell_angle_beta   104.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlOsPd2
_chemical_formula_sum   'Tl1 Os1 Pd2'
_cell_volume   67.7
_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
  Tl  Tl0  1  0.56  0.58  0.58  1.0
  Os  Os1  1  0.0  0.3  0.3  1.0
  Pd  Pd2  1  0.0  0.4  0.4  1.0
  Pd  Pd3  1  0.56  0.32  0.32  1.0

Tl Os Pd Pd