data_Sc2CdPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.45
_cell_length_b   4.77
_cell_length_c   4.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2CdPt
_chemical_formula_sum   'Sc2 Cd1 Pt1'
_cell_volume   78.56
_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
  Sc  Sc2  1  0.0  0.0  0.57  1.0
  Sc  Sc3  1  0.0  0.38  0.01  1.0
  Cd  Cd0  1  0.73  0.0  0.93  1.0
  Pt  Pt1  1  0.73  0.38  0.65  1.0

data_Sc2CdPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.45
_cell_length_b   4.77
_cell_length_c   4.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2CdPt
_chemical_formula_sum   'Sc2 Cd1 Pt1'
_cell_volume   78.56
_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
  Sc  Sc0  1  0.0  0.0  0.57  1.0
  Sc  Sc1  1  0.0  0.38  0.01  1.0
  Cd  Cd2  1  0.73  0.0  0.93  1.0
  Pt  Pt3  1  0.73  0.38  0.65  1.0

Sc Sc Cd Pt
Sc Sc Cd Pt 0 3 - o o 0 2 - o o 1 2 - o - 1 3 - o - 2 3 o o o 