data_Re2SnPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.85
_cell_angle_alpha   130.1
_cell_angle_beta   130.1
_cell_angle_gamma   73.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Re2SnPt
_chemical_formula_sum   'Re2 Sn1 Pt1'
_cell_volume   65.24
_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
  Re  Re1  1  0.0  0.0  0.89  1.0
  Re  Re2  1  0.05  0.0  0.95  1.0
  Sn  Sn3  1  0.0  0.0  0.0  1.0
  Pt  Pt0  1  0.0  0.05  0.95  1.0

data_Re2SnPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.09
_cell_length_b   4.09
_cell_length_c   4.85
_cell_angle_alpha   114.95
_cell_angle_beta   114.95
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Re2SnPt
_chemical_formula_sum   'Re2 Sn1 Pt1'
_cell_volume   65.24
_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
  Re  Re0  1  0.89  0.89  0.89  1.0
  Re  Re1  1  0.95  0.9  0.9  1.0
  Sn  Sn2  1  0.0  0.0  0.0  1.0
  Pt  Pt3  1  0.9  0.95  0.9  1.0

Re Re Sn Pt
Re Re Sn Pt 0 3 o o o 0 1 o o o 0 2 o o + 1 2 o o + 2 3 o o - 