data_FeRh5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.31
_cell_length_b   7.13
_cell_length_c   7.13
_cell_angle_alpha   21.89
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRh5
_chemical_formula_sum   'Fe1 Rh5'
_cell_volume   81.84
_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  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.16  0.0  0.89  1.0
  Rh  Rh2  1  0.0  0.0  0.27  1.0
  Rh  Rh3  1  0.16  0.0  0.26  1.0
  Rh  Rh4  1  0.0  0.0  0.74  1.0
  Rh  Rh5  1  0.16  0.0  0.52  1.0

data_FeRh5
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.71
_cell_length_b   4.31
_cell_length_c   7.13
_cell_angle_alpha   90.0
_cell_angle_beta   100.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRh5
_chemical_formula_sum   'Fe1 Rh5'
_cell_volume   81.84
_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  1.0  0.0  1.0  1.0
  Rh  Rh1  1  0.11  0.16  0.11  1.0
  Rh  Rh2  1  0.26  0.0  0.26  1.0
  Rh  Rh3  1  0.48  0.16  0.48  1.0
  Rh  Rh4  1  0.73  0.0  0.73  1.0
  Rh  Rh5  1  0.74  0.16  0.74  1.0

Fe Rh Rh Rh Rh Rh