data_Fe2RePt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56
_cell_length_b   4.56
_cell_length_c   4.56
_cell_angle_alpha   130.68
_cell_angle_beta   130.68
_cell_angle_gamma   72.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2RePt
_chemical_formula_sum   'Fe2 Re1 Pt1'
_cell_volume   53.14
_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
  Fe  Fe0  1  0.9  0.0  0.84  1.0
  Fe  Fe1  1  0.0  0.9  0.84  1.0
  Re  Re3  1  0.0  0.0  0.0  1.0
  Pt  Pt2  1  0.0  0.0  0.68  1.0

data_Fe2RePt
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.38
_cell_length_b   5.38
_cell_length_c   4.56
_cell_angle_alpha   90.0
_cell_angle_beta   126.16
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Fe2RePt
_chemical_formula_sum   'Fe4 Re2 Pt2'
_cell_volume   106.28
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Fe  Fe0  4  0.05  0.05  0.94  1.0
  Re  Re1  2  0.0  0.0  0.0  1.0
  Pt  Pt2  2  0.0  0.0  0.68  1.0

Fe Fe Re Pt