data_Ce4CdPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.86
_cell_length_b   9.86
_cell_length_c   9.86
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce4CdPt
_chemical_formula_sum   'Ce16 Cd4 Pt4'
_cell_volume   677.15
_cell_formula_units_Z   4
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  0.41  0.5  0.41  1.0
  Ce  Ce1  1  0.5  0.5  0.5  1.0
  Ce  Ce2  1  0.5  0.41  0.41  1.0
  Ce  Ce3  1  0.41  0.41  0.5  1.0
  Ce  Ce4  1  0.21  0.48  0.48  1.0
  Ce  Ce5  1  0.76  0.48  0.48  1.0
  Ce  Ce6  1  0.48  0.48  0.21  1.0
  Ce  Ce7  1  0.48  0.48  0.76  1.0
  Ce  Ce8  1  0.48  0.76  0.48  1.0
  Ce  Ce9  1  0.48  0.21  0.48  1.0
  Ce  Ce10  1  0.39  0.97  0.97  1.0
  Ce  Ce11  1  0.55  0.97  0.97  1.0
  Ce  Ce12  1  0.97  0.97  0.39  1.0
  Ce  Ce13  1  0.97  0.97  0.55  1.0
  Ce  Ce14  1  0.97  0.55  0.97  1.0
  Ce  Ce15  1  0.97  0.39  0.97  1.0
  Cd  Cd16  1  0.57  0.34  0.57  1.0
  Cd  Cd17  1  0.34  0.34  0.34  1.0
  Cd  Cd18  1  0.34  0.57  0.57  1.0
  Cd  Cd19  1  0.57  0.57  0.34  1.0
  Pt  Pt20  1  0.47  0.5  0.47  1.0
  Pt  Pt21  1  0.5  0.5  0.5  1.0
  Pt  Pt22  1  0.5  0.47  0.47  1.0
  Pt  Pt23  1  0.47  0.47  0.5  1.0

data_Ce4CdPt
_symmetry_space_group_name_H-M   R3m
_cell_length_a   9.86
_cell_length_b   9.86
_cell_length_c   24.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   Ce4CdPt
_chemical_formula_sum   'Ce48 Cd12 Pt12'
_cell_volume   2031.44
_cell_formula_units_Z   12
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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  9  0.03  0.07  0.56  1.0
  Ce  Ce1  9  0.05  0.53  0.56  1.0
  Ce  Ce2  9  0.09  0.18  0.42  1.0
  Ce  Ce3  9  0.18  0.09  0.61  1.0
  Ce  Ce4  9  0.19  0.39  0.84  1.0
  Ce  Ce5  3  0.0  0.0  0.5  1.0
  Cd  Cd6  9  0.15  0.07  0.51  1.0
  Cd  Cd7  3  0.0  0.0  0.66  1.0
  Pt  Pt8  9  0.01  0.02  0.52  1.0
  Pt  Pt9  3  0.0  0.0  0.5  1.0
