data_Cd2BPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.24
_cell_length_b   3.43
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   113.02
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2BPt
_chemical_formula_sum   'Cd2 B1 Pt1'
_cell_volume   69.42
_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
  Cd  Cd1  1  0.29  0.71  0.35  1.0
  Cd  Cd2  1  0.32  0.0  0.4  1.0
  B  B0  1  0.4  0.0  0.14  1.0
  Pt  Pt3  1  0.43  0.71  0.26  1.0

data_Cd2BPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.43
_cell_length_b   4.24
_cell_length_c   5.19
_cell_angle_alpha   113.02
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2BPt
_chemical_formula_sum   'Cd2 B1 Pt1'
_cell_volume   69.42
_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
  Cd  Cd0  1  0.0  0.68  0.6  1.0
  Cd  Cd1  1  0.29  0.71  0.65  1.0
  B  B2  1  0.0  0.6  0.86  1.0
  Pt  Pt3  1  0.29  0.57  0.74  1.0

Cd Cd B Pt