data_Fe2PRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82
_cell_length_b   4.82
_cell_length_c   4.82
_cell_angle_alpha   147.37
_cell_angle_beta   129.41
_cell_angle_gamma   61.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2PRh
_chemical_formula_sum   'Fe2 P1 Rh1'
_cell_volume   46.06
_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  0.06  0.37  1.0
  Fe  Fe1  1  0.35  0.0  0.76  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.0  0.0  0.14  1.0

data_Fe2PRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.71
_cell_length_b   4.11
_cell_length_c   4.82
_cell_angle_alpha   115.29
_cell_angle_beta   106.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2PRh
_chemical_formula_sum   'Fe2 P1 Rh1'
_cell_volume   46.06
_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  0.76  0.41  1.0
  Fe  Fe1  1  0.94  0.32  0.32  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.0  0.14  0.14  1.0

Fe Fe P Rh
Fe Fe P Rh 0 3 o o o 0 1 o o o 2 3 o o o 