# generated using pymatgen
data_Li4NbFe3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.06040197
_cell_length_b   6.06040197
_cell_length_c   6.08297112
_cell_angle_alpha   60.34504570
_cell_angle_beta   60.34504570
_cell_angle_gamma   60.37160325
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4NbFe3O8
_chemical_formula_sum   'Li4 Nb1 Fe3 O8'
_cell_volume   159.24526455
_cell_formula_units_Z   1
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  0.50000000  0.50000000  0.00000000  1
  Li  Li1  1  0.00000000  0.50000000  0.50000000  1
  Li  Li2  1  0.00000000  0.00000000  0.00000000  1
  Li  Li3  1  0.50000000  0.00000000  0.50000000  1
  Nb  Nb4  1  0.00000000  0.00000000  0.50000000  1
  Fe  Fe5  1  0.50000000  0.00000000  0.00000000  1
  Fe  Fe6  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe7  1  0.00000000  0.50000000  0.00000000  1
  O  O8  1  0.26550800  0.26550800  0.75234300  1
  O  O9  1  0.75063600  0.23863100  0.27340200  1
  O  O10  1  0.76487900  0.76487900  0.72722600  1
  O  O11  1  0.73449200  0.73449200  0.24765700  1
  O  O12  1  0.23863100  0.75063600  0.27340200  1
  O  O13  1  0.24936400  0.76136900  0.72659800  1
  O  O14  1  0.23512100  0.23512100  0.27277400  1
  O  O15  1  0.76136900  0.24936400  0.72659800  1
