data_[Sn4Sb8Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  Sb  2.0500  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [8.5634]
_cell_length_b [3.9461]
_cell_length_c [13.0320]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.5549]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Sn2Sb4Pt3]
_chemical_formula_sum '[Sn4 Sb8 Pt6]'
_cell_volume [435.4790]
_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
[
  Sn  Sn0  1  0.3259  0.5000  0.8086  1.0
  Sn  Sn1  1  0.6606  0.5000  0.4784  1.0
  Sn  Sn2  1  0.6752  0.5000  0.1907  1.0
  Sn  Sn3  1  0.9924  0.5000  0.1429  1.0
  Sb  Sb4  1  0.0079  0.5000  0.8573  1.0
  Sb  Sb5  1  0.0182  0.0000  0.6122  1.0
  Sb  Sb6  1  0.3142  0.0000  0.0544  1.0
  Sb  Sb7  1  0.3422  0.5000  0.5235  1.0
  Sb  Sb8  1  0.3534  0.0000  0.2787  1.0
  Sb  Sb9  1  0.6466  0.0000  0.7209  1.0
  Sb  Sb10  1  0.6861  0.0000  0.9465  1.0
  Sb  Sb11  1  0.9785  0.0000  0.3861  1.0
  Pt  Pt12  1  0.0010  0.0000  0.9981  1.0
  Pt  Pt13  1  0.1676  0.5000  0.3344  1.0
  Pt  Pt14  1  0.3320  0.0000  0.6647  1.0
  Pt  Pt15  1  0.4992  0.5000  0.9997  1.0
  Pt  Pt16  1  0.6657  0.0000  0.3341  1.0
  Pt  Pt17  1  0.8334  0.5000  0.6687  1.0
]