data_Cr2PdRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76
_cell_length_b   4.76
_cell_length_c   4.48
_cell_angle_alpha   109.72
_cell_angle_beta   109.72
_cell_angle_gamma   33.77
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2PdRu
_chemical_formula_sum   'Cr2 Pd1 Ru1'
_cell_volume   52.91
_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  0.85  0.0  0.11  1.0
  Cr  Cr1  1  0.39  0.0  0.05  1.0
  Pd  Pd2  1  0.83  0.0  0.31  1.0
  Ru  Ru3  1  0.35  0.0  0.82  1.0

data_Cr2PdRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   4.48
_cell_length_c   4.76
_cell_angle_alpha   109.72
_cell_angle_beta   106.89
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2PdRu
_chemical_formula_sum   'Cr2 Pd1 Ru1'
_cell_volume   52.91
_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  0.0  0.05  0.39  1.0
  Cr  Cr1  1  0.0  0.11  0.85  1.0
  Pd  Pd2  1  0.0  0.31  0.83  1.0
  Ru  Ru3  1  0.0  0.82  0.35  1.0

Cr Cr Pd Ru