data_CeIn2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81
_cell_length_b   5.81
_cell_length_c   7.54
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   132.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeIn2Pd
_chemical_formula_sum   'Ce2 In4 Pd2'
_cell_volume   187.39
_cell_formula_units_Z   2
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
  Ce  Ce0  1  0.34  0.47  0.65  1.0
  Ce  Ce1  1  0.34  0.53  0.88  1.0
  In  In2  1  0.34  0.45  0.14  1.0
  In  In3  1  0.34  0.55  0.38  1.0
  In  In4  1  0.34  0.55  0.39  1.0
  In  In5  1  0.34  0.45  0.16  1.0
  Pd  Pd6  1  0.34  0.86  0.65  1.0
  Pd  Pd7  1  0.34  0.14  0.88  1.0

data_CeIn2Pd
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.67
_cell_length_b   5.81
_cell_length_c   7.54
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.72
_symmetry_Int_Tables_number   2
_chemical_formula_structural   CeIn2Pd
_chemical_formula_sum   'Ce2 In4 Pd2'
_cell_volume   187.39
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Ce  Ce0  2  0.47  0.47  0.62  1.0
  In  In1  2  0.45  0.45  0.11  1.0
  In  In2  2  0.45  0.45  0.12  1.0
  Pd  Pd3  2  0.14  0.14  0.38  1.0

Ce Ce In In In In Pd Pd
Ce Ce In In In In Pd Pd 0 4 o o o 0 3 o o o 0 6 o o o 0 1 o o o 0 7 o o o 1 5 o o + 1 2 o o + 1 7 o o o 1 6 o o o 2 5 o o o 2 7 o o - 3 4 o o o 3 6 o o o 4 6 o o o 5 7 o o - 6 7 o + o 