data_FeRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.63
_cell_length_b   4.63
_cell_length_c   4.56
_cell_angle_alpha   98.95
_cell_angle_beta   98.95
_cell_angle_gamma   120.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRh
_chemical_formula_sum   'Fe3 Rh3'
_cell_volume   79.57
_cell_formula_units_Z   3
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  0.56  0.0  0.16  1.0
  Fe  Fe1  1  0.28  0.67  0.0  1.0
  Fe  Fe2  1  0.28  0.97  0.0  1.0
  Rh  Rh3  1  0.56  0.35  0.16  1.0
  Rh  Rh4  1  0.56  0.69  0.16  1.0
  Rh  Rh5  1  0.28  0.28  0.0  1.0

data_FeRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.56
_cell_length_b   4.57
_cell_length_c   4.63
_cell_angle_alpha   60.43
_cell_angle_beta   81.05
_cell_angle_gamma   71.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRh
_chemical_formula_sum   'Fe3 Rh3'
_cell_volume   79.57
_cell_formula_units_Z   3
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  -0.0  0.67  0.61  1.0
  Fe  Fe1  1  -0.0  0.97  0.31  1.0
  Fe  Fe2  1  0.84  0.0  0.56  1.0
  Rh  Rh3  1  -0.0  0.28  0.0  1.0
  Rh  Rh4  1  0.84  0.35  0.21  1.0
  Rh  Rh5  1  0.84  0.69  0.87  1.0

Fe Fe Fe Rh Rh Rh