data_Pt2RhSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.44
_cell_length_b   5.44
_cell_length_c   5.44
_cell_angle_alpha   149.02
_cell_angle_beta   129.14
_cell_angle_gamma   60.75
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pt2RhSe
_chemical_formula_sum   'Pt2 Rh1 Se1'
_cell_volume   63.85
_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
  Pt  Pt0  1  0.0  0.34  0.57  1.0
  Pt  Pt1  1  0.0  0.0  0.39  1.0
  Rh  Rh2  1  0.0  0.34  0.18  1.0
  Se  Se3  1  0.0  0.0  0.95  1.0

data_Pt2RhSe
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.91
_cell_length_b   4.67
_cell_length_c   5.44
_cell_angle_alpha   115.43
_cell_angle_beta   105.49
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pt2RhSe
_chemical_formula_sum   'Pt2 Rh1 Se1'
_cell_volume   63.85
_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
  Pt  Pt0  1  0.43  0.77  0.77  1.0
  Pt  Pt1  1  0.61  0.61  0.61  1.0
  Rh  Rh2  1  0.82  0.16  0.16  1.0
  Se  Se3  1  0.05  0.05  0.05  1.0

Pt Pt Rh Se
Pt Pt Rh Se 0 1 o o o 2 3 o o - 