data_OsPt2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.49
_cell_length_b   5.49
_cell_length_c   5.49
_cell_angle_alpha   149.93
_cell_angle_beta   129.23
_cell_angle_gamma   60.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsPt2Se
_chemical_formula_sum   'Os1 Pt2 Se1'
_cell_volume   63.87
_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  Os0  1  0.0  0.0  0.76  1.0
  Pt  Pt1  1  0.43  0.0  0.4  1.0
  Pt  Pt2  1  0.0  0.36  0.36  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

data_OsPt2Se
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.71
_cell_length_c   5.49
_cell_angle_alpha   115.39
_cell_angle_beta   105.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   OsPt2Se
_chemical_formula_sum   'Os1 Pt2 Se1'
_cell_volume   63.87
_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  Os0  1  0.24  0.24  0.24  1.0
  Pt  Pt1  1  0.03  0.6  0.03  1.0
  Pt  Pt2  1  0.64  1.0  1.0  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

Os Pt Pt Se