data_[Cd4Sb20O4F112]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [18.6035]
_cell_length_b [12.7837]
_cell_length_c [10.2316]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2419]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [CdSb5OF28]
_chemical_formula_sum '[Cd4 Sb20 O4 F112]'
_cell_volume [2408.1848]
_cell_formula_units_Z [4]
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
[
  Cd  Cd0  4  0.2604  0.1430  0.8049  1
  Sb  Sb1  4  0.0963  0.2192  0.0262  1
  Sb  Sb2  4  0.1390  0.6312  0.2583  1
  Sb  Sb3  4  0.2920  0.0366  0.4101  1
  Sb  Sb4  4  0.3385  0.6021  0.4407  1
  Sb  Sb5  4  0.4304  0.2402  0.5965  1
  O  O6  4  0.0618  0.5484  0.8259  1
  F  F7  4  0.0118  0.2292  0.5929  1
  F  F8  4  0.0412  0.1524  0.8782  1
  F  F9  4  0.0419  0.5899  0.1900  1
  F  F10  4  0.0950  0.0940  0.1270  1
  F  F11  4  0.1024  0.1546  0.4286  1
  F  F12  4  0.1209  0.7218  0.7569  1
  F  F13  4  0.1250  0.6191  0.4361  1
  F  F14  4  0.1577  0.2181  0.6758  1
  F  F15  4  0.1651  0.6409  0.0862  1
  F  F16  4  0.1710  0.0132  0.7604  1
  F  F17  4  0.1860  0.1739  0.9654  1
  F  F18  4  0.2022  0.5253  0.8356  1
  F  F19  4  0.2447  0.6653  0.3266  1
  F  F20  4  0.2536  0.0903  0.5617  1
  F  F21  4  0.2648  0.1691  0.3257  1
  F  F22  4  0.2717  0.5022  0.4955  1
  F  F23  4  0.3195  0.6959  0.5732  1
  F  F24  4  0.3284  0.5807  0.0078  1
  F  F25  4  0.3349  0.5038  0.2930  1
  F  F26  4  0.3418  0.0035  0.2682  1
  F  F27  4  0.3498  0.1860  0.9952  1
  F  F28  4  0.3618  0.2057  0.7160  1
  F  F29  4  0.3842  0.7013  0.3448  1
  F  F30  4  0.3858  0.1121  0.4889  1
  F  F31  4  0.4230  0.5411  0.5310  1
  F  F32  4  0.4636  0.1422  0.1965  1
  F  F33  4  0.4839  0.2407  0.9552  1
  F  F34  4  0.4954  0.1410  0.6822  1
]