data_FeBiPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   5.03
_cell_angle_alpha   131.58
_cell_angle_beta   131.58
_cell_angle_gamma   70.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeBiPd2
_chemical_formula_sum   'Fe1 Bi1 Pd2'
_cell_volume   69.54
_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  Fe1  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.0  0.09  1.0
  Pd  Pd2  1  0.06  0.0  0.05  1.0
  Pd  Pd3  1  0.0  0.06  0.05  1.0

data_FeBiPd2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.83
_cell_length_b   5.83
_cell_length_c   5.03
_cell_angle_alpha   90.0
_cell_angle_beta   125.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   FeBiPd2
_chemical_formula_sum   'Fe2 Bi2 Pd4'
_cell_volume   139.08
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  Bi  Bi1  2  0.0  0.0  0.09  1.0
  Pd  Pd2  4  0.47  0.53  0.99  1.0

Fe Bi Pd Pd