data_DyAlPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89
_cell_length_b   4.44
_cell_length_c   7.74
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   DyAlPt
_chemical_formula_sum   'Dy4 Al4 Pt4'
_cell_volume   236.69
_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
  Dy  Dy0  1  0.23  0.11  0.34  1.0
  Dy  Dy1  1  0.66  0.33  0.4  1.0
  Dy  Dy2  1  0.22  0.33  0.47  1.0
  Dy  Dy3  1  0.67  0.11  0.27  1.0
  Al  Al4  1  0.87  0.11  0.49  1.0
  Al  Al5  1  0.02  0.33  0.25  1.0
  Al  Al6  1  0.47  0.33  0.36  1.0
  Al  Al7  1  0.43  0.11  0.38  1.0
  Pt  Pt8  1  0.99  0.11  0.97  1.0
  Pt  Pt9  1  0.9  0.33  0.78  1.0
  Pt  Pt10  1  0.35  0.33  0.84  1.0
  Pt  Pt11  1  0.54  0.11  0.91  1.0

data_DyAlPt
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.44
_cell_length_b   6.89
_cell_length_c   7.74
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   DyAlPt
_chemical_formula_sum   'Dy4 Al4 Pt4'
_cell_volume   236.69
_cell_formula_units_Z   4
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
  Dy  Dy0  2  0.39  0.28  0.47  1.0
  Dy  Dy1  2  0.39  0.73  0.4  1.0
  Al  Al2  2  0.39  0.48  0.51  1.0
  Al  Al3  2  0.39  0.93  0.62  1.0
  Pt  Pt4  2  0.39  0.04  0.09  1.0
  Pt  Pt5  2  0.39  0.6  0.03  1.0

Dy Dy Dy Dy Al Al Al Al Pt Pt Pt Pt
Dy Dy Dy Dy Al Al Al Al Pt Pt Pt Pt 0 2 o o o 0 7 o o o 0 5 o o o 1 6 o o o 1 3 o o o 1 4 o o o 2 5 o o o 3 4 o o o 4 5 + o o 6 7 o o o 8 9 o o o 10 11 o o o 