data_[Ac16Pt6Se8N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Pt  2.2800  1.3500  0.8050
  Se  2.5500  1.1500  1.0133
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1055]
_cell_length_b [8.5612]
_cell_length_c [9.0685]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.8176]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac8Pt3Se4N]
_chemical_formula_sum '[Ac16 Pt6 Se8 N2]'
_cell_volume [985.5737]
_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
[
  Ac  Ac0  8  0.0046  0.2309  0.2866  1
  Ac  Ac1  4  0.2443  0.5000  0.7275  1
  Ac  Ac2  4  0.2480  0.0000  0.7319  1
  Pt  Pt3  4  0.2500  0.2500  0.5000  1
  Pt  Pt4  2  0.0000  0.5000  0.5000  1
  Se  Se5  4  0.2500  0.2500  0.0000  1
  Se  Se6  2  0.0000  0.0000  0.0000  1
  Se  Se7  2  0.0000  0.5000  0.0000  1
  N  N8  2  0.0000  0.0000  0.5000  1
]