data_[As2Pt30]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  As  2.1800  1.1500  0.6600
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [4.7988]
_cell_length_b [30.5396]
_cell_length_c [4.7987]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4283]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [AsPt15]
_chemical_formula_sum '[As2 Pt30]'
_cell_volume [663.2237]
_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
[
  As  As0  2  0.5000  0.1570  0.7500  1
  Pt  Pt1  2  0.0000  0.1519  0.2500  1
  Pt  Pt2  2  0.0000  0.1929  0.7500  1
  Pt  Pt3  2  0.0000  0.2434  0.2500  1
  Pt  Pt4  2  0.0000  0.2903  0.7500  1
  Pt  Pt5  2  0.0000  0.3371  0.2500  1
  Pt  Pt6  2  0.0000  0.3838  0.7500  1
  Pt  Pt7  2  0.0000  0.4302  0.2500  1
  Pt  Pt8  2  0.0000  0.4768  0.7500  1
  Pt  Pt9  2  0.5000  0.1929  0.2500  1
  Pt  Pt10  2  0.5000  0.2434  0.7500  1
  Pt  Pt11  2  0.5000  0.2904  0.2500  1
  Pt  Pt12  2  0.5000  0.3371  0.7500  1
  Pt  Pt13  2  0.5000  0.3839  0.2500  1
  Pt  Pt14  2  0.5000  0.4304  0.7500  1
  Pt  Pt15  2  0.5000  0.4767  0.2500  1
]