# generated using pymatgen
data_LiNbFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.19795425
_cell_length_b   6.20553841
_cell_length_c   6.23519837
_cell_angle_alpha   119.82555859
_cell_angle_beta   60.22576446
_cell_angle_gamma   89.96997771
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbFeO4
_chemical_formula_sum   'Li2 Nb2 Fe2 O8'
_cell_volume   170.55241993
_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  0.10719600  0.14274800  0.28549500  1
  Li  Li1  1  0.89280400  0.85725000  0.71450400  1
  Nb  Nb2  1  0.00000200  0.49999700  0.99999600  1
  Nb  Nb3  1  0.50000200  0.49999700  0.99999700  1
  Fe  Fe4  1  0.50000400  0.50000000  0.50001800  1
  Fe  Fe5  1  0.49999100  0.00001400  0.49999800  1
  O  O6  1  0.24468300  0.27558800  0.55163600  1
  O  O7  1  0.70393500  0.27611000  0.55177000  1
  O  O8  1  0.29606300  0.72389100  0.44822800  1
  O  O9  1  0.75531900  0.72440900  0.44836200  1
  O  O10  1  0.24489900  0.28757700  0.01014700  1
  O  O11  1  0.24482100  0.72256900  0.01014800  1
  O  O12  1  0.75510200  0.71242000  0.98985100  1
  O  O13  1  0.75518000  0.27742900  0.98985100  1
