data_Cr2MoPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.62
_cell_length_b   4.0
_cell_length_c   5.34
_cell_angle_alpha   90.0
_cell_angle_beta   101.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2MoPd
_chemical_formula_sum   'Cr2 Mo1 Pd1'
_cell_volume   54.82
_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
  Cr  Cr0  1  0.16  0.0  0.18  1.0
  Cr  Cr1  1  0.92  1.0  0.2  1.0
  Mo  Mo2  1  0.96  0.0  0.51  1.0
  Pd  Pd3  1  0.66  1.0  0.97  1.0

data_Cr2MoPd
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.62
_cell_length_b   4.0
_cell_length_c   5.34
_cell_angle_alpha   90.0
_cell_angle_beta   101.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Cr2MoPd
_chemical_formula_sum   'Cr2 Mo1 Pd1'
_cell_volume   54.82
_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
  Cr  Cr0  1  0.16  0.0  0.18  1.0
  Cr  Cr1  1  0.92  0.0  0.2  1.0
  Mo  Mo2  1  0.96  0.0  0.51  1.0
  Pd  Pd3  1  0.66  0.0  0.97  1.0

Cr Cr Mo Pd