data_In2FeRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   2.85
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2FeRe
_chemical_formula_sum   'In2 Fe1 Re1'
_cell_volume   68.16
_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
  In  In1  1  0.48  0.02  0.43  1.0
  In  In2  1  0.48  0.98  0.43  1.0
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Re  Re3  1  0.95  0.0  0.0  1.0

data_In2FeRe
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   5.01
_cell_length_c   5.01
_cell_angle_alpha   107.79
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2FeRe
_chemical_formula_sum   'In2 Fe1 Re1'
_cell_volume   68.16
_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
  In  In0  1  0.43  0.48  0.02  1.0
  In  In1  1  0.43  0.48  0.98  1.0
  Fe  Fe2  1  0.0  0.0  0.0  1.0
  Re  Re3  1  -0.0  0.95  0.0  1.0

In In Fe Re
In In Fe Re 0 1 o - o 2 3 - o o 