data_Bi2PPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   3.64
_cell_angle_alpha   93.2
_cell_angle_beta   93.2
_cell_angle_gamma   99.77
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi2PPd
_chemical_formula_sum   'Bi2 P1 Pd1'
_cell_volume   90.3
_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
  Bi  Bi0  1  0.46  0.08  0.81  1.0
  Bi  Bi1  1  0.46  0.92  0.81  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.24  0.0  0.0  1.0

data_Bi2PPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.64
_cell_length_b   5.03
_cell_length_c   5.03
_cell_angle_alpha   99.77
_cell_angle_beta   93.2
_cell_angle_gamma   93.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi2PPd
_chemical_formula_sum   'Bi2 P1 Pd1'
_cell_volume   90.3
_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
  Bi  Bi0  1  0.81  0.46  0.08  1.0
  Bi  Bi1  1  0.81  0.46  0.92  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  -0.0  0.24  0.0  1.0

Bi Bi P Pd
Bi Bi P Pd 0 1 o - o 0 3 o o + 1 3 o + + 2 3 o o o 