data_[Sn6Mo2Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  Mo  2.1600  1.4500  0.7750
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [4.0197]
_cell_length_b [9.8594]
_cell_length_c [5.9458]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [Sn3MoPt2]
_chemical_formula_sum '[Sn6 Mo2 Pt4]'
_cell_volume [235.6432]
_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  2  0.0000  0.3845  0.1816  1
  Sn  Sn1  2  0.5000  0.0682  0.3144  1
  Sn  Sn2  2  0.5000  0.2730  0.8069  1
  Mo  Mo3  2  0.0000  0.1028  0.9959  1
  Pt  Pt4  2  0.0000  0.2013  0.5142  1
  Pt  Pt5  2  0.5000  0.4630  0.4857  1
]