data_LiFeSbO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26
_cell_length_b   6.26
_cell_length_c   6.26
_cell_angle_alpha   121.73
_cell_angle_beta   120.25
_cell_angle_gamma   88.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeSbO4
_chemical_formula_sum   'Li2 Fe2 Sb2 O8'
_cell_volume   170.57
_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
  Li  Li0  1  0.05  0.56  0.68  1.0
  Li  Li1  1  0.0  0.56  0.81  1.0
  Fe  Fe2  1  0.48  0.56  0.25  1.0
  Fe  Fe3  1  0.52  0.56  0.25  1.0
  Sb  Sb4  1  0.0  0.0  0.0  1.0
  Sb  Sb5  1  0.0  0.12  0.0  1.0
  O  O6  1  0.68  0.44  0.5  1.0
  O  O7  1  0.37  0.56  0.01  1.0
  O  O8  1  0.68  0.56  0.48  1.0
  O  O9  1  0.37  0.68  0.99  1.0
  O  O10  1  0.0  0.09  0.97  1.0
  O  O11  1  0.0  0.03  0.97  1.0
  O  O12  1  0.05  0.03  0.52  1.0
  O  O13  1  0.05  0.09  0.52  1.0

data_LiFeSbO4
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.09
_cell_length_b   6.23
_cell_length_c   6.26
_cell_angle_alpha   119.88
_cell_angle_beta   119.13
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeSbO4
_chemical_formula_sum   'Li2 Fe2 Sb2 O8'
_cell_volume   170.57
_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
  Li  Li0  1  0.19  0.75  0.75  1.0
  Li  Li1  1  0.37  0.88  0.93  1.0
  Fe  Fe2  1  0.23  0.31  0.79  1.0
  Fe  Fe3  1  0.28  0.31  0.84  1.0
  Sb  Sb4  1  0.0  0.0  0.0  1.0
  Sb  Sb5  1  0.0  0.12  0.12  1.0
  O  O6  1  0.03  0.05  0.05  1.0
  O  O7  1  0.03  0.12  0.12  1.0
  O  O8  1  0.18  0.94  0.62  1.0
  O  O9  1  0.19  0.08  0.75  1.0
  O  O10  1  0.36  0.55  0.92  1.0
  O  O11  1  0.38  0.68  0.05  1.0
  O  O12  1  0.53  0.51  0.56  1.0
  O  O13  1  0.53  0.58  0.62  1.0

Li Li Fe Fe Sb Sb O O O O O O O O
Li Li Fe Fe Sb Sb O O O O O O O O 0 1 o o o 2 3 o o o 4 11 o o - 5 10 o o - 6 8 o o o 7 9 o o - 12 13 o o o 