data_[Cd4Sn2B2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Sn  1.9600  1.4500  0.8300
  B  2.0400  0.8500  0.4100
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [5.7142]
_cell_length_b [8.5763]
_cell_length_c [7.7508]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Cd2SnBPt6]
_chemical_formula_sum '[Cd4 Sn2 B2 Pt12]'
_cell_volume [379.8412]
_cell_formula_units_Z [2]
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  4  0.0000  0.2314  0.7677  1
  Sn  Sn1  2  0.0000  0.5000  0.3589  1
  B  B2  2  0.0000  0.0000  0.1609  1
  Pt  Pt3  4  0.0000  0.2444  0.1560  1
  Pt  Pt4  4  0.2382  0.5000  0.6507  1
  Pt  Pt5  4  0.2437  0.5000  0.0370  1
]