data_[Ca14Pa2Pt9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Pa  1.5000  1.8000  1.0400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-3]
_cell_length_a [8.6199]
_cell_length_b [8.6199]
_cell_length_c [11.4738]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [147]
_chemical_formula_structural [Ca14Pa2Pt9]
_chemical_formula_sum '[Ca14 Pa2 Pt9]'
_cell_volume [738.3213]
_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
[
  Ca  Ca0  6  0.0377  0.6789  0.9063  1
  Ca  Ca1  6  0.0820  0.3985  0.6003  1
  Ca  Ca2  2  0.0000  0.0000  0.2577  1
  Pa  Pa3  2  0.3333  0.6667  0.2708  1
  Pt  Pt4  6  0.0629  0.3544  0.3436  1
  Pt  Pt5  2  0.3333  0.6667  0.0396  1
  Pt  Pt6  1  0.0000  0.0000  0.0000  1
]