data_Cr2InPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.7
_cell_length_b   4.7
_cell_length_c   4.7
_cell_angle_alpha   130.35
_cell_angle_beta   130.35
_cell_angle_gamma   72.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2InPd
_chemical_formula_sum   'Cr2 In1 Pd1'
_cell_volume   59.04
_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
  Cr  Cr0  1  0.0  0.97  0.89  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  In  In2  1  0.97  0.0  0.89  1.0
  Pd  Pd3  1  0.0  0.0  0.79  1.0

data_Cr2InPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.95
_cell_length_b   3.95
_cell_length_c   4.7
_cell_angle_alpha   114.82
_cell_angle_beta   114.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2InPd
_chemical_formula_sum   'Cr2 In1 Pd1'
_cell_volume   59.04
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.92  0.89  0.92  1.0
  In  In2  1  0.89  0.92  0.92  1.0
  Pd  Pd3  1  0.79  0.79  0.79  1.0

Cr Cr In Pd
Cr Cr In Pd 0 2 - + o 0 1 o + + 0 3 o + o 1 2 - o - 2 3 + o o 