data_[Ca2Tl2Bi2Pt2N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Tl  1.6200  1.9000  1.3325
  Bi  2.0200  1.6000  1.0350
  Pt  2.2800  1.3500  0.8050
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.8051]
_cell_length_b [4.2179]
_cell_length_c [6.6247]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.1154]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [CaTlBiPtN]
_chemical_formula_sum '[Ca2 Tl2 Bi2 Pt2 N2]'
_cell_volume [249.9629]
_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
[
  Ca  Ca0  2  0.0886  0.5000  0.8548  1
  Tl  Tl1  2  0.4574  0.5000  0.1339  1
  Bi  Bi2  2  0.3108  0.5000  0.4802  1
  Pt  Pt3  2  0.2318  0.0000  0.6558  1
  N  N4  2  0.0663  0.0000  0.7108  1
]