data_BePdRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16
_cell_length_b   5.16
_cell_length_c   2.69
_cell_angle_alpha   103.86
_cell_angle_beta   103.86
_cell_angle_gamma   119.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BePdRh2
_chemical_formula_sum   'Be1 Pd1 Rh2'
_cell_volume   54.63
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.6  0.0  0.0  1.0
  Rh  Rh2  1  0.66  0.77  0.18  1.0
  Rh  Rh3  1  0.66  0.23  0.18  1.0

data_BePdRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.69
_cell_length_b   4.57
_cell_length_c   5.16
_cell_angle_alpha   115.53
_cell_angle_beta   103.86
_cell_angle_gamma   92.7
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BePdRh2
_chemical_formula_sum   'Be1 Pd1 Rh2'
_cell_volume   54.63
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.0  0.0  0.6  1.0
  Rh  Rh2  1  0.41  0.23  0.89  1.0
  Rh  Rh3  1  0.95  0.77  0.43  1.0

Be Pd Rh Rh