data_OsPdCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11
_cell_length_b   5.11
_cell_length_c   5.11
_cell_angle_alpha   144.07
_cell_angle_beta   122.67
_cell_angle_gamma   69.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsPdCl2
_chemical_formula_sum   'Os1 Pd1 Cl2'
_cell_volume   64.94
_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
  Os  Os2  1  0.0  0.0  0.2  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0
  Cl  Cl0  1  0.0  0.45  0.11  1.0
  Cl  Cl1  1  0.58  0.0  0.09  1.0

data_OsPdCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.15
_cell_length_b   4.9
_cell_length_c   5.11
_cell_angle_alpha   118.66
_cell_angle_beta   107.97
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsPdCl2
_chemical_formula_sum   'Os1 Pd1 Cl2'
_cell_volume   64.94
_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
  Pd  Pd0  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.8  0.8  0.8  1.0
  Cl  Cl2  1  0.49  0.91  0.49  1.0
  Cl  Cl3  1  0.89  0.34  0.34  1.0

Os Pd Cl Cl