data_FeMoPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.72
_cell_length_b   2.72
_cell_length_c   7.94
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeMoPd2
_chemical_formula_sum   'Fe1 Mo1 Pd2'
_cell_volume   58.64
_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  0.01  1.0
  Mo  Mo1  1  0.88  0.0  0.05  1.0
  Pd  Pd2  1  0.0  0.0  0.04  1.0
  Pd  Pd3  1  0.88  0.0  0.82  1.0

data_FeMoPd2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.72
_cell_length_b   2.72
_cell_length_c   7.94
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   FeMoPd2
_chemical_formula_sum   'Fe1 Mo1 Pd2'
_cell_volume   58.69
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.01  1.0
  Mo  Mo1  1  0.88  0.0  0.05  1.0
  Pd  Pd2  1  0.0  0.0  0.04  1.0
  Pd  Pd3  1  0.88  0.0  0.82  1.0

Fe Mo Pd Pd