data_Bi3Pd5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.26
_cell_length_b   4.26
_cell_length_c   11.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi3Pd5
_chemical_formula_sum   'Bi3 Pd5'
_cell_volume   175.82
_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
  Bi  Bi0  1  0.0  0.0  0.59  1.0
  Bi  Bi1  1  0.0  0.46  0.52  1.0
  Bi  Bi2  1  0.0  0.46  0.67  1.0
  Pd  Pd3  1  0.13  0.23  0.32  1.0
  Pd  Pd4  1  0.13  0.23  0.04  1.0
  Pd  Pd5  1  0.13  0.23  0.15  1.0
  Pd  Pd6  1  0.13  0.23  0.87  1.0
  Pd  Pd7  1  0.0  0.0  0.0  1.0

data_Bi3Pd5
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.26
_cell_length_b   4.26
_cell_length_c   11.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi3Pd5
_chemical_formula_sum   'Bi3 Pd5'
_cell_volume   175.82
_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
  Bi  Bi0  1  -0.0  0.46  0.52  1.0
  Bi  Bi1  1  -0.0  0.46  0.67  1.0
  Bi  Bi2  1  0.0  0.0  0.59  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0
  Pd  Pd4  1  0.13  0.23  0.04  1.0
  Pd  Pd5  1  0.13  0.23  0.15  1.0
  Pd  Pd6  1  0.13  0.23  0.32  1.0
  Pd  Pd7  1  0.13  0.23  0.87  1.0

Bi Bi Bi Pd Pd Pd Pd Pd