data_In2BiPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22
_cell_length_b   5.22
_cell_length_c   6.57
_cell_angle_alpha   111.06
_cell_angle_beta   111.06
_cell_angle_gamma   38.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2BiPd
_chemical_formula_sum   'In2 Bi1 Pd1'
_cell_volume   102.55
_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
  In  In1  1  0.59  0.0  0.93  1.0
  In  In2  1  0.4  0.0  0.91  1.0
  Bi  Bi0  1  0.38  0.0  0.54  1.0
  Pd  Pd3  1  0.16  0.0  0.82  1.0

data_In2BiPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   5.22
_cell_length_c   6.57
_cell_angle_alpha   111.06
_cell_angle_beta   90.0
_cell_angle_gamma   109.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2BiPd
_chemical_formula_sum   'In2 Bi1 Pd1'
_cell_volume   102.55
_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
  In  In0  1  0.0  0.41  0.07  1.0
  In  In1  1  0.0  0.6  0.09  1.0
  Bi  Bi2  1  0.0  0.62  0.46  1.0
  Pd  Pd3  1  0.0  0.84  0.18  1.0

In In Bi Pd
In In Bi Pd 0 1 o o o 0 2 o o o 1 3 o o o 1 2 o o o 2 3 o o o 