data_[Ca1Bi2Pt1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Bi  2.0200  1.6000  1.0350
  Pt  2.2800  1.3500  0.8050
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.9265]
_cell_length_b [6.8511]
_cell_length_c [4.9319]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.6473]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CaBi2PtO8]
_chemical_formula_sum '[Ca1 Bi2 Pt1 O8]'
_cell_volume [166.3923]
_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  1  0.0000  0.5000  0.0000  1.0
  Bi  Bi1  2  0.5000  0.2471  0.5000  1.0
  Pt  Pt2  1  0.0000  0.0000  0.0000  1.0
  O  O3  4  0.1612  0.2232  0.2182  1.0
  O  O4  2  0.3202  0.0000  0.7461  1.0
  O  O5  2  0.3422  0.5000  0.7066  1.0
]