# generated using pymatgen
data_Li2Fe3NiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69356983
_cell_length_b   5.69356983
_cell_length_c   5.92288689
_cell_angle_alpha   60.94356666
_cell_angle_beta   60.94356666
_cell_angle_gamma   60.34199582
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe3NiO8
_chemical_formula_sum   'Li2 Fe3 Ni1 O8'
_cell_volume   138.03130438
_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  0.00000000  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.00000000  1
  Fe  Fe2  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe3  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe4  1  0.50000000  0.50000000  0.50000000  1
  Ni  Ni5  1  0.00000000  0.00000000  0.50000000  1
  O  O6  1  0.23070500  0.23070500  0.29330700  1
  O  O7  1  0.23685600  0.74614700  0.29635400  1
  O  O8  1  0.74614700  0.23685600  0.29635400  1
  O  O9  1  0.73170600  0.73170600  0.29092000  1
  O  O10  1  0.26829400  0.26829400  0.70908000  1
  O  O11  1  0.25385300  0.76314400  0.70364600  1
  O  O12  1  0.76314400  0.25385300  0.70364600  1
  O  O13  1  0.76929500  0.76929500  0.70669300  1
