data_Be2CdPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83
_cell_length_b   4.83
_cell_length_c   4.83
_cell_angle_alpha   136.49
_cell_angle_beta   136.49
_cell_angle_gamma   63.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2CdPd
_chemical_formula_sum   'Be2 Cd1 Pd1'
_cell_volume   52.74
_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  0.79  0.06  1.0
  Be  Be1  1  0.0  0.0  0.0  1.0
  Cd  Cd2  1  0.79  0.0  0.06  1.0
  Pd  Pd3  1  0.0  0.0  0.11  1.0

data_Be2CdPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.58
_cell_length_b   3.58
_cell_length_c   4.83
_cell_angle_alpha   111.75
_cell_angle_beta   111.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2CdPd
_chemical_formula_sum   'Be2 Cd1 Pd1'
_cell_volume   52.74
_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
  Be  Be1  1  0.27  0.06  0.27  1.0
  Cd  Cd2  1  0.06  0.27  0.27  1.0
  Pd  Pd3  1  0.11  0.11  0.11  1.0

Be Be Cd Pd
Be Be Cd Pd 0 3 o + o 1 3 o o o 2 3 + o o 