data_[Sr12P4Pt2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  P  2.1900  1.0000  0.5500
  Pt  2.2800  1.3500  0.8050
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.2685]
_cell_length_b [4.4126]
_cell_length_c [8.9450]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.1825]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr6P2PtCl3]
_chemical_formula_sum '[Sr12 P4 Pt2 Cl6]'
_cell_volume [737.3602]
_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
[
  Sr  Sr0  4  0.0050  0.0000  0.2349  1.0
  Sr  Sr1  4  0.1585  0.5000  0.1040  1.0
  Sr  Sr2  4  0.1742  0.5000  0.5648  1.0
  P  P3  4  0.1650  0.0000  0.3341  1.0
  Pt  Pt4  2  0.0000  0.5000  0.0000  1.0
  Cl  Cl5  4  0.1704  0.0000  0.8327  1.0
  Cl  Cl6  2  0.0000  0.5000  0.5000  1.0
]