data_[Sc4Cd5Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Cd  1.6900  1.5500  1.0900
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.6305]
_cell_length_b [3.3150]
_cell_length_c [9.4582]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.4624]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Sc4Cd5Pt2]
_chemical_formula_sum '[Sc4 Cd5 Pt2]'
_cell_volume [238.8097]
_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  2  0.1714  0.5000  0.8537  1.0
  Sc  Sc1  2  0.2113  0.5000  0.4418  1.0
  Cd  Cd2  2  0.1793  0.0000  0.1449  1.0
  Cd  Cd3  2  0.4613  0.0000  0.6696  1.0
  Cd  Cd4  1  0.5000  0.0000  0.0000  1.0
  Pt  Pt5  2  0.0760  0.0000  0.6418  1.0
]