data_[Pt10Se14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pt  2.2800  1.3500  0.8050
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Cmm2]
_cell_length_a [9.7331]
_cell_length_b [14.8316]
_cell_length_c [16.5606]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [35]
_chemical_formula_structural [Pt5Se7]
_chemical_formula_sum '[Pt10 Se14]'
_cell_volume [2390.6370]
_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
[
  Pt  Pt0  4  0.0000  0.3167  0.4927  1
  Pt  Pt1  4  0.2500  0.2500  0.5291  1
  Pt  Pt2  2  0.0000  0.5000  0.4878  1
  Se  Se3  8  0.2081  0.3960  0.4643  1
  Se  Se4  4  0.0000  0.1736  0.5566  1
  Se  Se5  2  0.0000  0.0000  0.5033  1
]