# generated using pymatgen
data_Li2NbFe3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.04113064
_cell_length_b   6.02837662
_cell_length_c   10.62775027
_cell_angle_alpha   73.48758689
_cell_angle_beta   89.95188545
_cell_angle_gamma   119.89928285
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2NbFe3O8
_chemical_formula_sum   'Li4 Nb2 Fe6 O16'
_cell_volume   316.92692474
_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  0.93461400  0.86983800  0.19503600  1
  Li  Li1  1  0.43459000  0.86982800  0.69504700  1
  Li  Li2  1  0.56540000  0.13018000  0.30492600  1
  Li  Li3  1  0.06538700  0.13016800  0.80493000  1
  Nb  Nb4  1  0.75012700  0.49994200  0.75004800  1
  Nb  Nb5  1  0.25012800  0.49993200  0.25005600  1
  Fe  Fe6  1  0.50001100  0.50009300  0.99996900  1
  Fe  Fe7  1  0.49987700  0.99999000  0.00003400  1
  Fe  Fe8  1  0.50003600  0.50006100  0.50004200  1
  Fe  Fe9  1  0.99997300  0.50001100  0.49995200  1
  Fe  Fe10  1  0.99988000  0.99998500  0.50002800  1
  Fe  Fe11  1  0.00002700  0.49995000  0.00010800  1
  O  O12  1  0.86481100  0.73230800  0.40067900  1
  O  O13  1  0.36478600  0.73231500  0.90070500  1
  O  O14  1  0.63518600  0.26771700  0.09931900  1
  O  O15  1  0.13522300  0.26770300  0.59928100  1
  O  O16  1  0.09475400  0.73563700  0.62354400  1
  O  O17  1  0.59477400  0.73566700  0.12355500  1
  O  O18  1  0.64112500  0.28165300  0.62407300  1
  O  O19  1  0.14099400  0.28159500  0.12409900  1
  O  O20  1  0.64091800  0.73563400  0.62409600  1
  O  O21  1  0.14098300  0.73563600  0.12411900  1
  O  O22  1  0.85907200  0.26434200  0.87590700  1
  O  O23  1  0.35913300  0.26441500  0.37583200  1
  O  O24  1  0.85882000  0.71827500  0.87583800  1
  O  O25  1  0.35886500  0.71835500  0.37592200  1
  O  O26  1  0.40523000  0.26439800  0.87643500  1
  O  O27  1  0.90527400  0.26437200  0.37642000  1
