# generated using pymatgen
data_Li3FeNi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82360866
_cell_length_b   5.82360866
_cell_length_c   5.85109048
_cell_angle_alpha   60.97015407
_cell_angle_beta   60.97015407
_cell_angle_gamma   59.49112203
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3FeNi3O8
_chemical_formula_sum   'Li3 Fe1 Ni3 O8'
_cell_volume   141.76747076
_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  0.50000000  1
  Li  Li1  1  0.00000000  0.00000000  0.50000000  1
  Li  Li2  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe3  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni4  1  0.00000000  0.50000000  0.00000000  1
  Ni  Ni5  1  0.50000000  0.00000000  0.00000000  1
  Ni  Ni6  1  0.00000000  0.00000000  0.00000000  1
  O  O7  1  0.23258400  0.76384800  0.77846900  1
  O  O8  1  0.73819300  0.73819300  0.77704900  1
  O  O9  1  0.22379600  0.22379600  0.79588300  1
  O  O10  1  0.76384800  0.23258400  0.77846900  1
  O  O11  1  0.23615200  0.76741600  0.22153100  1
  O  O12  1  0.77620400  0.77620400  0.20411700  1
  O  O13  1  0.26180700  0.26180700  0.22295100  1
  O  O14  1  0.76741600  0.23615200  0.22153100  1
