data_[Bi1Pt15]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [2.8419]
_cell_length_b [3.9332]
_cell_length_c [35.9026]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [BiPt15]
_chemical_formula_sum '[Bi1 Pt15]'
_cell_volume [401.3116]
_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
[
  Bi  Bi0  1  0.5000  0.5000  0.7992  1
  Pt  Pt1  1  0.0000  0.0000  0.2110  1
  Pt  Pt2  1  0.0000  0.0000  0.2863  1
  Pt  Pt3  1  0.0000  0.0000  0.3631  1
  Pt  Pt4  1  0.0000  0.0000  0.4407  1
  Pt  Pt5  1  0.0000  0.0000  0.5184  1
  Pt  Pt6  1  0.0000  0.0000  0.5960  1
  Pt  Pt7  1  0.0000  0.0000  0.6743  1
  Pt  Pt8  1  0.0000  0.0000  0.7553  1
  Pt  Pt9  1  0.5000  0.5000  0.2439  1
  Pt  Pt10  1  0.5000  0.5000  0.3243  1
  Pt  Pt11  1  0.5000  0.5000  0.4021  1
  Pt  Pt12  1  0.5000  0.5000  0.4796  1
  Pt  Pt13  1  0.5000  0.5000  0.5571  1
  Pt  Pt14  1  0.5000  0.5000  0.6351  1
  Pt  Pt15  1  0.5000  0.5000  0.7135  1
]