data_FeBi2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.79
_cell_length_b   5.79
_cell_length_c   5.79
_cell_angle_alpha   139.05
_cell_angle_beta   139.05
_cell_angle_gamma   59.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeBi2Rh
_chemical_formula_sum   'Fe1 Bi2 Rh1'
_cell_volume   82.49
_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  Fe2  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.0  0.03  1.0
  Bi  Bi1  1  0.0  0.02  0.52  1.0
  Rh  Rh3  1  0.02  0.0  0.52  1.0

data_FeBi2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.05
_cell_length_b   4.05
_cell_length_c   5.79
_cell_angle_alpha   110.47
_cell_angle_beta   110.47
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeBi2Rh
_chemical_formula_sum   'Fe1 Bi2 Rh1'
_cell_volume   82.49
_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
  Bi  Bi1  1  0.51  0.02  0.51  1.0
  Bi  Bi2  1  0.97  0.0  0.97  1.0
  Rh  Rh3  1  0.48  0.0  0.51  1.0

Fe Bi Bi Rh
Fe Bi Bi Rh 0 1 o o o 2 3 o o o 