data_FeRePd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.68
_cell_length_b   4.26
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   102.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRePd2
_chemical_formula_sum   'Fe1 Re1 Pd2'
_cell_volume   57.95
_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  0.27  0.0  0.83  1.0
  Re  Re3  1  0.35  0.13  0.53  1.0
  Pd  Pd1  1  1.0  0.13  0.93  1.0
  Pd  Pd2  1  0.67  0.0  0.4  1.0

data_FeRePd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.68
_cell_length_b   4.26
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   102.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeRePd2
_chemical_formula_sum   'Fe1 Re1 Pd2'
_cell_volume   57.95
_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  0.27  0.0  0.83  1.0
  Re  Re1  1  0.35  0.13  0.53  1.0
  Pd  Pd2  1  0.67  0.0  0.4  1.0
  Pd  Pd3  1  1.0  0.13  0.93  1.0

Fe Re Pd Pd