data_SbO2F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11
_cell_length_b   5.11
_cell_length_c   5.56
_cell_angle_alpha   119.36
_cell_angle_beta   119.36
_cell_angle_gamma   61.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbO2F
_chemical_formula_sum   'Sb2 O4 F2'
_cell_volume   104.69
_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
  Sb  Sb0  1  0.95  0.53  0.88  1.0
  Sb  Sb1  1  0.53  0.47  0.6  1.0
  O  O2  1  0.67  0.4  0.69  1.0
  O  O3  1  0.14  0.21  0.73  1.0
  O  O4  1  0.26  0.6  0.41  1.0
  O  O5  1  0.73  0.79  0.45  1.0
  F  F6  1  0.34  0.7  0.73  1.0
  F  F7  1  0.93  0.3  0.45  1.0

data_SbO2F
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.11
_cell_length_b   5.11
_cell_length_c   5.4
_cell_angle_alpha   93.25
_cell_angle_beta   116.17
_cell_angle_gamma   118.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbO2F
_chemical_formula_sum   'Sb2 O4 F2'
_cell_volume   104.69
_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
  Sb  Sb0  1  0.07  0.47  0.12  1.0
  Sb  Sb1  1  0.93  0.53  0.4  1.0
  O  O2  1  0.28  0.21  0.55  1.0
  O  O3  1  0.41  0.79  0.27  1.0
  O  O4  1  0.85  0.4  0.59  1.0
  O  O5  1  0.98  0.6  0.31  1.0
  F  F6  1  0.48  0.7  0.55  1.0
  F  F7  1  0.61  0.3  0.27  1.0

Sb Sb O O O O F F
Sb Sb O O O O F F 0 2 o o o 0 3 + o o 0 5 o o o 1 2 o o o 1 4 o o o 1 5 o o o 1 5 o - o 1 6 o o o 2 5 o o o 2 5 o - o 3 7 - o o 3 5 - - o 4 6 o o o 4 5 o o o 4 5 - o o 5 6 + o o 5 7 o o o 